Changeset 170 for trunk/testinp
- Timestamp:
- Nov 2, 2010 5:04:27 PM (13 years ago)
- File:
-
- 1 edited
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trunk/testinp/spctestinp.py
r57 r170 1 # output from GSASIIspc computed on platform darwin on 2010- 04-281 # output from GSASIIspc computed on platform darwin on 2010-10-31 2 2 import numpy as np 3 3 array = np.array … … 4448 4448 } 4449 4449 SGlist = { 4450 "p 4/n b m": [' Space Group P 4/n b m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X , Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X , Z ', '( 5) -X ,1/2+Y , Z ( 6) -Y , -X , Z ', '( 7) 1/2+X , -Y , Z ( 8) 1/2+Y ,1/2+X , Z'] ,4451 "p -4 c 2": [' Space Group P -4 c 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y ,1/2+Z ( 6) Y , X ,1/2-Z ', '( 7) X , -Y ,1/2+Z ( 8) -Y , -X ,1/2-Z'] ,4452 "r -3 m": [' Space Group R -3 m', 'The lattice is centrosymmetric R-centered trigonal', 'Multiplicity of a general site is 36', 'The Laue symmetry is 3m1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y , Z ( 5) -Y , -X , Z ( 6) X , X-Y, Z'] ,4453 "p 42 n m": [' Space Group P 42 n m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) 1/2+Y ,1/2-X ,1/2+Z ', '( 5) 1/2-X ,1/2+Y ,1/2+Z ( 6) -Y , -X , Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) Y , X , Z'] ,4454 "a b a 2": [' Space Group A b a 2', 'The lattice is noncentrosymmetric A-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4455 "p 42/m b c": [' Space Group P 42/m b c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) 1/2-X ,1/2+Y , Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4456 "p m n 21": [' Space Group P m n 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) 1/2+X , -Y ,1/2+Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4457 "i 4/m c m ": [' Space Group I 4/m c m', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 32', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X ,1/2+Z'] ,4458 "p 42/m c m": [' Space Group P 42/m c m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X , Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X , Z'] ,4459 "p m -3": [' Space Group P m -3', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4460 "p b a 2": [' Space Group P b a 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4461 "i b a m": [' Space Group I b a m', 'The lattice is centrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4462 "p 21/m": [' Space Group P 21/m', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y , -Z'] ,4463 "p 41": [' Space Group P 41', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 4', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) Y , -X ,3/4+Z'] ,4464 "p 42": [' Space Group P 42', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 4', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z'] ,4465 "p 43": [' Space Group P 43', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 4', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,3/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) Y , -X ,1/4+Z'] ,4466 "f 4 3 2": [' Space Group F 4 3 2', 'The lattice is noncentrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) -Y , X , Z ( 5) Z , -Y , X ( 6) X , Z , -Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) Y , -X , Z (14) Z , Y , -X (15) -X , Z , Y ', '(16) -X , -Z , -Y (17) -Y , -X , -Z (18) -Z , -Y , -X ', '(19) Y , -Z , -X (20) Y , X , -Z (21) -Z , Y , X ', '(22) X , -Z , Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4467 "p -4 21 m": [' Space Group P -4 21 m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) 1/2-X ,1/2+Y , -Z ( 6) 1/2+Y ,1/2+X , Z ', '( 7) 1/2+X ,1/2-Y , -Z ( 8) 1/2-Y ,1/2-X , Z'] ,4468 "p 63/m c m": [' Space Group P 63/m c m', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 24', 'The Laue symmetry is 6/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z ', '( 7) Y-X, Y ,1/2+Z ( 8) -X , Y-X, Z ( 9) -Y , -X ,1/2+Z ', '(10) X-Y, -Y , Z (11) X , X-Y,1/2+Z (12) Y , X , Z'] ,4469 "p 2 3": [' Space Group P 2 3', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 12', 'The Laue symmetry is m3', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , -Y , -Z ( 5) -Z , X , -Y ( 6) -Y , -Z , X ', '( 7) -Z , -X , Y ( 8) Y , -Z , -X ( 9) -Y , Z , -X ', '(10) -X , -Y , Z (11) Z , -X , -Y (12) -X , Y , -Z'] ,4470 "i a 3": [' Space Group I a 3', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X , Y ,1/2-Z ( 5) 1/2-Z ,1/2+X , Y ( 6) Y ,1/2-Z ,1/2+X ', '( 7) -Z ,1/2+X ,1/2-Y ( 8) 1/2-Y , -Z ,1/2+X ( 9) 1/2+Y ,1/2-Z , -X ', '(10) -X ,1/2+Y ,1/2-Z (11) 1/2-Z , -X ,1/2+Y (12) 1/2+X ,1/2-Y , -Z'] ,4471 "p 3 2 1": [' Space Group P 3 2 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3m1', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X , -Z ( 5) -X , Y-X, -Z ( 6) X-Y, -Y , -Z'] ,4472 "i a -3 d": [' Space Group I a -3 d', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X , Y ,1/2-Z ( 5) 1/2-Z ,1/2+X , Y ( 6) Y ,1/2-Z ,1/2+X ', '( 7) -Z ,1/2+X ,1/2-Y ( 8) 1/2-Y , -Z ,1/2+X ( 9) 1/2+Y ,1/2-Z , -X ', '(10) -X ,1/2+Y ,1/2-Z (11) 1/2-Z , -X ,1/2+Y (12) 1/2+X ,1/2-Y , -Z ', '(13) 1/4+Y ,1/4+X ,1/4+Z (14) 1/4+Z ,1/4+Y ,1/4+X (15) 1/4+X ,1/4+Z ,1/4+Y ', '(16) 3/4+Y ,1/4+X ,1/4-Z (17) 1/4-Z ,3/4+Y ,1/4+X (18) 1/4+X ,1/4-Z ,3/4+Y ', '(19) 3/4-Z ,3/4+Y ,1/4-X (20) 1/4-X ,3/4-Z ,3/4+Y (21) 3/4+X ,1/4-Z ,3/4-Y ', '(22) 3/4-Y ,3/4+X ,1/4-Z (23) 1/4-Z ,3/4-Y ,3/4+X (24) 3/4+Y ,1/4-X ,3/4-Z'] ,4473 "p a -3": [' Space Group P a -3', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X , Y ,1/2-Z ( 5) 1/2-Z ,1/2+X , Y ( 6) Y ,1/2-Z ,1/2+X ', '( 7) -Z ,1/2+X ,1/2-Y ( 8) 1/2-Y , -Z ,1/2+X ( 9) 1/2+Y ,1/2-Z , -X ', '(10) -X ,1/2+Y ,1/2-Z (11) 1/2-Z , -X ,1/2+Y (12) 1/2+X ,1/2-Y , -Z'] ,4474 "c 2": [' Space Group C 2', 'The lattice is noncentrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in y', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4475 "r 3 2 h": [' Space Group R 3 2 h', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3m1', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X , -Z ( 5) -X , Y-X, -Z ( 6) X-Y, -Y , -Z'] ,4476 "p c": [' Space Group P c', 'The lattice is noncentrosymmetric primitive monoclinic', 'Multiplicity of a general site is 2', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in x z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X , -Y ,1/2+Z'] ,4477 "f 2 2 2": [' Space Group F 2 2 2', 'The lattice is noncentrosymmetric F-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y , -Z ( 4) -X , -Y , Z'] ,4478 "p 6 c c": [' Space Group P 6 c c', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z ', '( 7) Y-X, Y ,1/2+Z ( 8) -X , Y-X,1/2+Z ( 9) -Y , -X ,1/2+Z ', '(10) X-Y, -Y ,1/2+Z (11) X , X-Y,1/2+Z (12) Y , X ,1/2+Z'] ,4479 "r 3 2 r": [' Space Group R 3 2 r', 'The lattice is noncentrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3mR', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) -Y , -X , -Z ( 5) -Z , -Y , -X ( 6) -X , -Z , -Y'] ,4480 "p 62 2 2": [' Space Group P 62 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/3+Z ( 3) -Y , X-Y,2/3+Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X ,1/3+Z ( 6) Y , Y-X,2/3+Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y,1/3-Z ( 9) Y , X ,2/3-Z ', '(10) Y-X, Y , -Z (11) -X , Y-X,1/3-Z (12) -Y , -X ,2/3-Z'] ,4481 "i 41 c d": [' Space Group I 41 c d', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y ,1/2+X ,1/4+Z ', '( 3) 1/2-X ,1/2-Y ,1/2+Z ( 4) 1/2+Y , -X ,3/4+Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y ,1/2-X ,3/4+Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2+Y , X ,1/4+Z'] ,4482 "f m m 2": [' Space Group F m m 2', 'The lattice is noncentrosymmetric F-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4483 "p m m 2": [' Space Group P m m 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4484 "p m": [' Space Group P m', 'The lattice is noncentrosymmetric primitive monoclinic', 'Multiplicity of a general site is 2', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in x z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X , -Y , Z'] ,4485 "i 4 2 2": [' Space Group I 4 2 2', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , -Z ( 6) -Y , -X , -Z ', '( 7) X , -Y , -Z ( 8) Y , X , -Z'] ,4486 "p 31 2 1": [' Space Group P 31 2 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3m1', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,1/3+Z ( 3) Y-X, -X ,2/3+Z ', '( 4) Y , X , -Z ( 5) -X , Y-X,1/3-Z ( 6) X-Y, -Y ,2/3-Z'] ,4487 "i -4": [' Space Group I -4', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z'] ,4488 "p 2": [' Space Group P 2', 'The lattice is noncentrosymmetric primitive monoclinic', 'Multiplicity of a general site is 2', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in y', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4489 "p 21 21 2": [' Space Group P 21 21 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2+X ,1/2-Y , -Z ', '( 3) 1/2-X ,1/2+Y , -Z ( 4) -X , -Y , Z'] ,4490 "c 1 2/c 1": [' Space Group C 1 2/c 1', 'The lattice is centrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 8', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2-Z'] ,4491 "i b a 2": [' Space Group I b a 2', 'The lattice is noncentrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4492 "p b a m": [' Space Group P b a m', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4493 "p b a n": [' Space Group P b a n', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y , Z ', '( 3) 1/2+X , -Y , Z ( 4) 1/2-X ,1/2-Y , Z'] ,4494 "p m -3 n": [' Space Group P m -3 n', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z ', '(13) 1/2+Y ,1/2+X ,1/2+Z (14) 1/2+Z ,1/2+Y ,1/2+X (15) 1/2+X ,1/2+Z ,1/2+Y ', '(16) 1/2+Y ,1/2+X ,1/2-Z (17) 1/2-Z ,1/2+Y ,1/2+X (18) 1/2+X ,1/2-Z ,1/2+Y ', '(19) 1/2-Z ,1/2+Y ,1/2-X (20) 1/2-X ,1/2-Z ,1/2+Y (21) 1/2+X ,1/2-Z ,1/2-Y ', '(22) 1/2-Y ,1/2+X ,1/2-Z (23) 1/2-Z ,1/2-Y ,1/2+X (24) 1/2+Y ,1/2-X ,1/2-Z'] ,4495 "i b c a": [' Space Group I b c a', 'The lattice is centrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4496 "p 42 21 2": [' Space Group P 42 21 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) 1/2+Y ,1/2-X ,1/2+Z ', '( 5) 1/2-X ,1/2+Y ,1/2-Z ( 6) -Y , -X , -Z ', '( 7) 1/2+X ,1/2-Y ,1/2-Z ( 8) Y , X , -Z'] ,4497 "f m m m": [' Space Group F m m m', 'The lattice is centrosymmetric F-centered orthorhombic', 'Multiplicity of a general site is 32', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4498 "i 41": [' Space Group I 41', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y ,1/2+X ,1/4+Z ', '( 3) 1/2-X ,1/2-Y ,1/2+Z ( 4) 1/2+Y , -X ,3/4+Z'] ,4499 "p 6": [' Space Group P 6', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z'] ,4500 "p 3": [' Space Group P 3', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 3', 'The Laue symmetry is 3', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z'] ,4501 "p m m n": [' Space Group P m m n', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y , Z ', '( 3) X ,1/2-Y , Z ( 4) 1/2-X ,1/2-Y , Z'] ,4502 "p m m m": [' Space Group P m m m', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4503 "r 3 m h": [' Space Group R 3 m h', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3m1', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y , Z ( 5) -Y , -X , Z ( 6) X , X-Y, Z'] ,4504 "c m c 21": [' Space Group C m c 21', 'The lattice is noncentrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y ,1/2+Z'] ,4505 "p 1": [' Space Group P 1', 'The lattice is noncentrosymmetric primitive triclinic', 'Multiplicity of a general site is 1', 'The Laue symmetry is -1', 'The location of the origin is arbitrary in xyz', '\nThe equivalent positions are:', '', '( 1) X , Y , Z'] ,4506 "i 4": [' Space Group I 4', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z'] ,4507 "p 4": [' Space Group P 4', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 4', 'The Laue symmetry is 4/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z'] ,4508 "p 42 b c": [' Space Group P 42 b c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) 1/2-X ,1/2+Y , Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4509 "p m m a": [' Space Group P m m a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y , Z ', '( 3) X , -Y , Z ( 4) 1/2-X , -Y , Z'] ,4510 "i -4 m 2": [' Space Group I -4 m 2', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y , Z ( 6) Y , X , -Z ', '( 7) X , -Y , Z ( 8) -Y , -X , -Z'] ,4511 "p -4 21 c": [' Space Group P -4 21 c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) 1/2-X ,1/2+Y ,1/2-Z ( 6) 1/2+Y ,1/2+X ,1/2+Z ', '( 7) 1/2+X ,1/2-Y ,1/2-Z ( 8) 1/2-Y ,1/2-X ,1/2+Z'] ,4512 "p 4 2 2": [' Space Group P 4 2 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , -Z ( 6) -Y , -X , -Z ', '( 7) X , -Y , -Z ( 8) Y , X , -Z'] ,4513 "p 4/m c c": [' Space Group P 4/m c c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X ,1/2+Z'] ,4514 "p -6 2 m": [' Space Group P -6 2 m', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y-X, -X , -Z ( 3) -Y , X-Y, Z ', '( 4) X , Y , -Z ( 5) Y-X, -X , Z ( 6) -Y , X-Y, -Z ', '( 7) X-Y, -Y , -Z ( 8) -X , Y-X, Z ( 9) Y , X , -Z ', '(10) X-Y, -Y , Z (11) -X , Y-X, -Z (12) Y , X , Z'] ,4515 "p 1 2/m 1": [' Space Group P 1 2/m 1', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4516 "p -6 2 c": [' Space Group P -6 2 c', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y-X, -X ,1/2-Z ( 3) -Y , X-Y, Z ', '( 4) X , Y ,1/2-Z ( 5) Y-X, -X , Z ( 6) -Y , X-Y,1/2-Z ', '( 7) X-Y, -Y , -Z ( 8) -X , Y-X,1/2+Z ( 9) Y , X , -Z ', '(10) X-Y, -Y ,1/2+Z (11) -X , Y-X, -Z (12) Y , X ,1/2+Z'] ,4517 "p 6 m m": [' Space Group P 6 m m', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z ', '( 7) Y-X, Y , Z ( 8) -X , Y-X, Z ( 9) -Y , -X , Z ', '(10) X-Y, -Y , Z (11) X , X-Y, Z (12) Y , X , Z'] ,4518 "c c": [' Space Group C c', 'The lattice is noncentrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in x z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) X , -Y ,1/2+Z'] ,4519 "p 43 3 2": [' Space Group P 43 3 2', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 3/4-Y ,1/4+X ,3/4+Z ( 5) 3/4+Z ,3/4-Y ,1/4+X ( 6) 1/4+X ,3/4+Z ,3/4-Y ', '( 7) 1/2-X , -Y ,1/2+Z ( 8) -Z ,1/2+X ,1/2-Y ( 9) 1/2-Y , -Z ,1/2+X ', '(10) 1/2+X ,1/2-Y , -Z (11) 1/2+Z ,1/2-X , -Y (12) -Y ,1/2+Z ,1/2-X ', '(13) 3/4+Y ,3/4-X ,1/4+Z (14) 1/4+Z ,3/4+Y ,3/4-X (15) 3/4-X ,1/4+Z ,3/4+Y ', '(16) 1/4-X ,1/4-Z ,1/4-Y (17) 1/4-Y ,1/4-X ,1/4-Z (18) 1/4-Z ,1/4-Y ,1/4-X ', '(19) 1/2+Y ,1/2-Z , -X (20) 1/4+Y ,3/4+X ,3/4-Z (21) 3/4-Z ,1/4+Y ,3/4+X ', '(22) 3/4+X ,3/4-Z ,1/4+Y (23) -X ,1/2+Y ,1/2-Z (24) 1/2-Z , -X ,1/2+Y'] ,4520 "a 2 2 2": [' Space Group A 2 2 2', 'The lattice is noncentrosymmetric A-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y , -Z ( 4) -X , -Y , Z'] ,4521 "p -3": [' Space Group P -3', 'The lattice is centrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z'] ,4522 "p -1": [' Space Group P -1', 'The lattice is centrosymmetric primitive triclinic', 'Multiplicity of a general site is 2', 'The Laue symmetry is -1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z'] ,4523 "f d d 2": [' Space Group F d d 2', 'The lattice is noncentrosymmetric F-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) 1/4-X ,1/4+Y ,1/4+Z ', '( 3) 1/4+X ,1/4-Y ,1/4+Z ( 4) -X ,1/2-Y ,1/2+Z'] ,4524 "p 62": [' Space Group P 62', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/3+Z ( 3) -Y , X-Y,2/3+Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X ,1/3+Z ( 6) Y , Y-X,2/3+Z'] ,4525 "c m m a": [' Space Group C m m a', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X ,1/2-Y , Z ( 4) -X ,1/2-Y , Z'] ,4526 "p -3 c 1": [' Space Group P -3 c 1', 'The lattice is centrosymmetric primitive trigonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 3m1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y ,1/2+Z ( 5) -Y , -X ,1/2+Z ( 6) X , X-Y,1/2+Z'] ,4527 "c m c m": [' Space Group C m c m', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y ,1/2+Z'] ,4528 "c m m m": [' Space Group C m m m', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4529 "c m c a": [' Space Group C m c a', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) -X ,1/2-Y ,1/2+Z'] ,4530 "i a -3": [' Space Group I a -3', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X , Y ,1/2-Z ( 5) 1/2-Z ,1/2+X , Y ( 6) Y ,1/2-Z ,1/2+X ', '( 7) -Z ,1/2+X ,1/2-Y ( 8) 1/2-Y , -Z ,1/2+X ( 9) 1/2+Y ,1/2-Z , -X ', '(10) -X ,1/2+Y ,1/2-Z (11) 1/2-Z , -X ,1/2+Y (12) 1/2+X ,1/2-Y , -Z'] ,4531 "i m a 2": [' Space Group I m a 2', 'The lattice is noncentrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X , Y , Z ', '( 3) 1/2+X , -Y , Z ( 4) -X , -Y , Z'] ,4532 "p 63/m m c": [' Space Group P 63/m m c', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 24', 'The Laue symmetry is 6/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z ', '( 7) Y-X, Y , Z ( 8) -X , Y-X,1/2+Z ( 9) -Y , -X , Z ', '(10) X-Y, -Y ,1/2+Z (11) X , X-Y, Z (12) Y , X ,1/2+Z'] ,4533 "p 4 3 2": [' Space Group P 4 3 2', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) -Y , X , Z ( 5) Z , -Y , X ( 6) X , Z , -Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) Y , -X , Z (14) Z , Y , -X (15) -X , Z , Y ', '(16) -X , -Z , -Y (17) -Y , -X , -Z (18) -Z , -Y , -X ', '(19) Y , -Z , -X (20) Y , X , -Z (21) -Z , Y , X ', '(22) X , -Z , Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4534 "i 41/a c d": [' Space Group I 41/a c d', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 32', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/4-Y ,3/4+X ,1/4+Z ', '( 3) 1/2-X , -Y ,1/2+Z ( 4) 1/4+Y ,1/4-X ,3/4+Z ', '( 5) -X , Y ,1/2+Z ( 6) 1/4-Y ,3/4-X ,3/4+Z ', '( 7) 1/2+X , -Y , Z ( 8) 1/4+Y ,1/4+X ,1/4+Z'] ,4535 "p -4 2 c": [' Space Group P -4 2 c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y ,1/2-Z ( 6) Y , X ,1/2+Z ', '( 7) X , -Y ,1/2-Z ( 8) -Y , -X ,1/2+Z'] ,4536 "p 4 n c": [' Space Group P 4 n c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) 1/2-X ,1/2+Y ,1/2+Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4537 "p 4/m": [' Space Group P 4/m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z'] ,4538 "p 4/n": [' Space Group P 4/n', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X , Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X , Z'] ,4539 "p 21/c": [' Space Group P 21/c', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y ,1/2-Z'] ,4540 "r -3 c": [' Space Group R -3 c', 'The lattice is centrosymmetric R-centered trigonal', 'Multiplicity of a general site is 36', 'The Laue symmetry is 3m1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y ,1/2+Z ( 5) -Y , -X ,1/2+Z ( 6) X , X-Y,1/2+Z'] ,4541 "p 4/n m m": [' Space Group P 4/n m m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X , Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X , Z ', '( 5) 1/2-X , Y , Z ( 6) 1/2-Y ,1/2-X , Z ', '( 7) X ,1/2-Y , Z ( 8) Y , X , Z'] ,4542 "i 4/m": [' Space Group I 4/m', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z'] ,4543 "p 3 m 1": [' Space Group P 3 m 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3m1', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y , Z ( 5) -Y , -X , Z ( 6) X , X-Y, Z'] ,4544 "p 63/m": [' Space Group P 63/m', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z'] ,4545 "p 6 2 2": [' Space Group P 6 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y, -Z ( 9) Y , X , -Z ', '(10) Y-X, Y , -Z (11) -X , Y-X, -Z (12) -Y , -X , -Z'] ,4546 "p 2/m": [' Space Group P 2/m', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4547 "f d 3": [' Space Group F d 3', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4+X ,1/4+Y , -Z ( 5) -Z ,1/4+X ,1/4+Y ( 6) 1/4+Y , -Z ,1/4+X ', '( 7) 1/4-Z ,1/2+X ,3/4-Y ( 8) 3/4-Y ,1/4-Z ,1/2+X ( 9) 1/2+Y ,1/4-Z ,3/4-X ', '(10) 3/4-X ,1/2+Y ,1/4-Z (11) 1/4-Z ,3/4-X ,1/2+Y (12) 1/2+X ,3/4-Y ,1/4-Z'] ,4548 "i 41/a m d": [' Space Group I 41/a m d', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 32', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/4-Y ,3/4+X ,1/4+Z ', '( 3) 1/2-X , -Y ,1/2+Z ( 4) 1/4+Y ,1/4-X ,3/4+Z ', '( 5) -X , Y , Z ( 6) 1/4-Y ,3/4-X ,1/4+Z ', '( 7) 1/2+X , -Y ,1/2+Z ( 8) 1/4+Y ,1/4+X ,3/4+Z'] ,4549 "p 4/n c c": [' Space Group P 4/n c c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X , Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X , Z ', '( 5) 1/2-X , Y ,1/2+Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) X ,1/2-Y ,1/2+Z ( 8) Y , X ,1/2+Z'] ,4550 "i m m a": [' Space Group I m m a', 'The lattice is centrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X ,1/2-Y , Z ( 4) -X ,1/2-Y , Z'] ,4551 "p 4 b m": [' Space Group P 4 b m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) 1/2-X ,1/2+Y , Z ( 6) 1/2-Y ,1/2-X , Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2+Y ,1/2+X , Z'] ,4552 "p 2/c": [' Space Group P 2/c', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2-Z'] ,4553 "p -6 m 2": [' Space Group P -6 m 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y-X, -X , -Z ( 3) -Y , X-Y, Z ', '( 4) X , Y , -Z ( 5) Y-X, -X , Z ( 6) -Y , X-Y, -Z ', '( 7) Y-X, Y , Z ( 8) X , X-Y, -Z ( 9) -Y , -X , Z ', '(10) Y-X, Y , -Z (11) X , X-Y, Z (12) -Y , -X , -Z'] ,4554 "p n n 2": [' Space Group P n n 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y ,1/2+Z ', '( 3) 1/2+X ,1/2-Y ,1/2+Z ( 4) -X , -Y , Z'] ,4555 "p 31 1 2": [' Space Group P 31 1 2', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 31m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,1/3+Z ( 3) Y-X, -X ,2/3+Z ', '( 4) X , X-Y, -Z ( 5) Y-X, Y ,1/3-Z ( 6) -Y , -X ,2/3-Z'] ,4556 "f -4 3 c": [' Space Group F -4 3 c', 'The lattice is noncentrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+Y ,1/2-X ,1/2-Z ( 5) 1/2-Z ,1/2+Y ,1/2-X ( 6) 1/2-X ,1/2-Z ,1/2+Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) 1/2-Y ,1/2+X ,1/2-Z (14) 1/2-Z ,1/2-Y ,1/2+X (15) 1/2+X ,1/2-Z ,1/2-Y ', '(16) 1/2+X ,1/2+Z ,1/2+Y (17) 1/2+Y ,1/2+X ,1/2+Z (18) 1/2+Z ,1/2+Y ,1/2+X ', '(19) Y , -Z , -X (20) 1/2-Y ,1/2-X ,1/2+Z (21) 1/2+Z ,1/2-Y ,1/2-X ', '(22) 1/2-X ,1/2+Z ,1/2-Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4557 "i m -3": [' Space Group I m -3', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4558 "f -4 3 m": [' Space Group F -4 3 m', 'The lattice is noncentrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) Y , -X , -Z ( 5) -Z , Y , -X ( 6) -X , -Z , Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) -Y , X , -Z (14) -Z , -Y , X (15) X , -Z , -Y ', '(16) X , Z , Y (17) Y , X , Z (18) Z , Y , X ', '(19) Y , -Z , -X (20) -Y , -X , Z (21) Z , -Y , -X ', '(22) -X , Z , -Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4559 "i 21 3": [' Space Group I 21 3', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X ,1/2-Y , -Z ( 5) -Z ,1/2+X ,1/2-Y ( 6) 1/2-Y , -Z ,1/2+X ', '( 7) 1/2-Z , -X ,1/2+Y ( 8) 1/2+Y ,1/2-Z , -X ( 9) -Y ,1/2+Z ,1/2-X ', '(10) 1/2-X , -Y ,1/2+Z (11) 1/2+Z ,1/2-X , -Y (12) -X ,1/2+Y ,1/2-Z'] ,4560 "p 42/m m c": [' Space Group P 42/m m c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) -X , Y , Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y , Z ( 8) Y , X ,1/2+Z'] ,4561 "p 65 2 2": [' Space Group P 65 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,5/6+Z ( 3) -Y , X-Y,2/3+Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X ,1/3+Z ( 6) Y , Y-X,1/6+Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y,5/6-Z ( 9) Y , X ,2/3-Z ', '(10) Y-X, Y ,1/2-Z (11) -X , Y-X,1/3-Z (12) -Y , -X ,1/6-Z'] ,4562 "p 4/m n c": [' Space Group P 4/m n c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) 1/2-X ,1/2+Y ,1/2+Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4563 "c 2/m": [' Space Group C 2/m', 'The lattice is centrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 8', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4564 "f d d d": [' Space Group F d d d', 'The lattice is centrosymmetric F-centered orthorhombic', 'Multiplicity of a general site is 32', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X ,1/4+Y ,1/4+Z ', '( 3) 1/4+X , -Y ,1/4+Z ( 4) 3/4-X ,1/4-Y ,1/2+Z'] ,4565 "c m m 2": [' Space Group C m m 2', 'The lattice is noncentrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4566 "p 43 21 2": [' Space Group P 43 21 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X ,3/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) 1/2+Y ,1/2-X ,1/4+Z ', '( 5) 1/2-X ,1/2+Y ,3/4-Z ( 6) -Y , -X ,1/2-Z ', '( 7) 1/2+X ,1/2-Y ,1/4-Z ( 8) Y , X , -Z'] ,4567 "p -3 1 m": [' Space Group P -3 1 m', 'The lattice is centrosymmetric primitive trigonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 31m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X , Z ( 5) -X , Y-X, Z ( 6) X-Y, -Y , Z'] ,4568 "i 2 2 2": [' Space Group I 2 2 2', 'The lattice is noncentrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y , -Z ( 4) -X , -Y , Z'] ,4569 "p 42/n b c": [' Space Group P 42/n b c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X ,1/2+Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X ,1/2+Z ', '( 5) -X ,1/2+Y , Z ( 6) -Y , -X ,1/2+Z ', '( 7) 1/2+X , -Y , Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4570 "i 4 3 2": [' Space Group I 4 3 2', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) -Y , X , Z ( 5) Z , -Y , X ( 6) X , Z , -Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) Y , -X , Z (14) Z , Y , -X (15) -X , Z , Y ', '(16) -X , -Z , -Y (17) -Y , -X , -Z (18) -Z , -Y , -X ', '(19) Y , -Z , -X (20) Y , X , -Z (21) -Z , Y , X ', '(22) X , -Z , Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4571 "p 41 3 2": [' Space Group P 41 3 2', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4-Y ,3/4+X ,1/4+Z ( 5) 1/4+Z ,1/4-Y ,3/4+X ( 6) 3/4+X ,1/4+Z ,1/4-Y ', '( 7) 1/2-X , -Y ,1/2+Z ( 8) -Z ,1/2+X ,1/2-Y ( 9) 1/2-Y , -Z ,1/2+X ', '(10) 1/2+X ,1/2-Y , -Z (11) 1/2+Z ,1/2-X , -Y (12) -Y ,1/2+Z ,1/2-X ', '(13) 1/4+Y ,1/4-X ,3/4+Z (14) 3/4+Z ,1/4+Y ,1/4-X (15) 1/4-X ,3/4+Z ,1/4+Y ', '(16) 3/4-X ,3/4-Z ,3/4-Y (17) 3/4-Y ,3/4-X ,3/4-Z (18) 3/4-Z ,3/4-Y ,3/4-X ', '(19) 1/2+Y ,1/2-Z , -X (20) 3/4+Y ,1/4+X ,1/4-Z (21) 1/4-Z ,3/4+Y ,1/4+X ', '(22) 1/4+X ,1/4-Z ,3/4+Y (23) -X ,1/2+Y ,1/2-Z (24) 1/2-Z , -X ,1/2+Y'] ,4572 "p 42/n m c": [' Space Group P 42/n m c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X ,1/2+Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X ,1/2+Z ', '( 5) 1/2-X , Y , Z ( 6) 1/2-Y ,1/2-X ,1/2+Z ', '( 7) X ,1/2-Y , Z ( 8) Y , X ,1/2+Z'] ,4573 "p 64 2 2": [' Space Group P 64 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,2/3+Z ( 3) -Y , X-Y,1/3+Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X ,2/3+Z ( 6) Y , Y-X,1/3+Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y,2/3-Z ( 9) Y , X ,1/3-Z ', '(10) Y-X, Y , -Z (11) -X , Y-X,2/3-Z (12) -Y , -X ,1/3-Z'] ,4574 "p c a 21": [' Space Group P c a 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y ,1/2+Z ', '( 3) 1/2+X , -Y , Z ( 4) -X , -Y ,1/2+Z'] ,4575 "f d -3 c": [' Space Group F d -3 c', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 192', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4+X ,1/4+Y , -Z ( 5) -Z ,1/4+X ,1/4+Y ( 6) 1/4+Y , -Z ,1/4+X ', '( 7) 1/4-Z ,1/2+X ,3/4-Y ( 8) 3/4-Y ,1/4-Z ,1/2+X ( 9) 1/2+Y ,1/4-Z ,3/4-X ', '(10) 3/4-X ,1/2+Y ,1/4-Z (11) 1/4-Z ,3/4-X ,1/2+Y (12) 1/2+X ,3/4-Y ,1/4-Z ', '(13) Y , X ,1/2+Z (14) 1/2+Z , Y , X (15) X ,1/2+Z , Y ', '(16) 1/4+Y ,1/4+X ,1/2-Z (17) 1/2-Z ,1/4+Y ,1/4+X (18) 1/4+X ,1/2-Z ,1/4+Y ', '(19) 3/4-Z ,1/2+Y ,3/4-X (20) 3/4-X ,3/4-Z ,1/2+Y (21) 1/2+X ,3/4-Z ,3/4-Y ', '(22) 3/4-Y ,1/2+X ,3/4-Z (23) 3/4-Z ,3/4-Y ,1/2+X (24) 1/2+Y ,3/4-X ,3/4-Z'] ,4576 "p n a 21": [' Space Group P n a 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y ,1/2+Z ', '( 3) 1/2+X ,1/2-Y , Z ( 4) -X , -Y ,1/2+Z'] ,4577 "p -4 n 2": [' Space Group P -4 n 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) 1/2-X ,1/2+Y ,1/2+Z ( 6) 1/2+Y ,1/2+X ,1/2-Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) 1/2-Y ,1/2-X ,1/2-Z'] ,4578 "p 42/n n m": [' Space Group P 42/n n m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X ,1/2+Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X ,1/2+Z ', '( 5) -X ,1/2+Y ,1/2+Z ( 6) -Y , -X , Z ', '( 7) 1/2+X , -Y ,1/2+Z ( 8) 1/2+Y ,1/2+X , Z'] ,4579 "f d -3 m": [' Space Group F d -3 m', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 192', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4+X ,1/4+Y , -Z ( 5) -Z ,1/4+X ,1/4+Y ( 6) 1/4+Y , -Z ,1/4+X ', '( 7) 1/4-Z ,1/2+X ,3/4-Y ( 8) 3/4-Y ,1/4-Z ,1/2+X ( 9) 1/2+Y ,1/4-Z ,3/4-X ', '(10) 3/4-X ,1/2+Y ,1/4-Z (11) 1/4-Z ,3/4-X ,1/2+Y (12) 1/2+X ,3/4-Y ,1/4-Z ', '(13) Y , X , Z (14) Z , Y , X (15) X , Z , Y ', '(16) 1/4+Y ,1/4+X , -Z (17) -Z ,1/4+Y ,1/4+X (18) 1/4+X , -Z ,1/4+Y ', '(19) 1/4-Z ,1/2+Y ,3/4-X (20) 3/4-X ,1/4-Z ,1/2+Y (21) 1/2+X ,1/4-Z ,3/4-Y ', '(22) 3/4-Y ,1/2+X ,1/4-Z (23) 1/4-Z ,3/4-Y ,1/2+X (24) 1/2+Y ,3/4-X ,1/4-Z'] ,4580 "r -3 c r": [' Space Group R -3 c r', 'The lattice is centrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 12', 'The Laue symmetry is 3mR', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+Y ,1/2+X ,1/2+Z ( 5) 1/2+Z ,1/2+Y ,1/2+X ( 6) 1/2+X ,1/2+Z ,1/2+Y'] ,4581 "p 63 m c": [' Space Group P 63 m c', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z ', '( 7) Y-X, Y , Z ( 8) -X , Y-X,1/2+Z ( 9) -Y , -X , Z ', '(10) X-Y, -Y ,1/2+Z (11) X , X-Y, Z (12) Y , X ,1/2+Z'] ,4582 "p 4/m b m": [' Space Group P 4/m b m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) 1/2-X ,1/2+Y , Z ( 6) 1/2-Y ,1/2-X , Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2+Y ,1/2+X , Z'] ,4583 "p 2 2 2": [' Space Group P 2 2 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y , -Z ( 4) -X , -Y , Z'] ,4584 "p 63 2 2": [' Space Group P 63 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y,1/2-Z ( 9) Y , X , -Z ', '(10) Y-X, Y ,1/2-Z (11) -X , Y-X, -Z (12) -Y , -X ,1/2-Z'] ,4585 "p 6/m m m": [' Space Group P 6/m m m', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 24', 'The Laue symmetry is 6/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z ', '( 7) Y-X, Y , Z ( 8) -X , Y-X, Z ( 9) -Y , -X , Z ', '(10) X-Y, -Y , Z (11) X , X-Y, Z (12) Y , X , Z'] ,4586 "p c c n": [' Space Group P c c n', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y ,1/2+Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) 1/2-X ,1/2-Y , Z'] ,4587 "p c c m": [' Space Group P c c m', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y , Z'] ,4588 "p m n a": [' Space Group P m n a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) 1/2+X , -Y ,1/2+Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4589 "f 41 3 2": [' Space Group F 41 3 2', 'The lattice is noncentrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 3/4-Y ,3/4+X ,1/4+Z ( 5) 1/4+Z ,3/4-Y ,3/4+X ( 6) 3/4+X ,1/4+Z ,3/4-Y ', '( 7) -X ,1/2-Y ,1/2+Z ( 8) 1/2-Z ,1/2+X , -Y ( 9) -Y ,1/2-Z ,1/2+X ', '(10) 1/2+X , -Y ,1/2-Z (11) 1/2+Z , -X ,1/2-Y (12) 1/2-Y ,1/2+Z , -X ', '(13) 1/4+Y ,3/4-X ,3/4+Z (14) 3/4+Z ,1/4+Y ,3/4-X (15) 3/4-X ,3/4+Z ,1/4+Y ', '(16) 1/4-X ,1/4-Z ,1/4-Y (17) 1/4-Y ,1/4-X ,1/4-Z (18) 1/4-Z ,1/4-Y ,1/4-X ', '(19) 1/2+Y , -Z ,1/2-X (20) 3/4+Y ,1/4+X ,3/4-Z (21) 3/4-Z ,3/4+Y ,1/4+X ', '(22) 1/4+X ,3/4-Z ,3/4+Y (23) 1/2-X ,1/2+Y , -Z (24) -Z ,1/2-X ,1/2+Y'] ,4590 "r -3 r": [' Space Group R -3 r', 'The lattice is centrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3R', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X'] ,4591 "p 1 1 2/m": [' Space Group P 1 1 2/m', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is c', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , -Y , Z'] ,4592 "p 64": [' Space Group P 64', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,2/3+Z ( 3) -Y , X-Y,1/3+Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X ,2/3+Z ( 6) Y , Y-X,1/3+Z'] ,4593 "p c c a": [' Space Group P c c a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) 1/2-X , -Y , Z'] ,4594 "f m -3": [' Space Group F m -3', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4595 "p -6": [' Space Group P -6', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y-X, -X , -Z ( 3) -Y , X-Y, Z ', '( 4) X , Y , -Z ( 5) Y-X, -X , Z ( 6) -Y , X-Y, -Z'] ,4596 "i m m m": [' Space Group I m m m', 'The lattice is centrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4597 "p -4 2 m": [' Space Group P -4 2 m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y , -Z ( 6) Y , X , Z ', '( 7) X , -Y , -Z ( 8) -Y , -X , Z'] ,4598 "p 21 3": [' Space Group P 21 3', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 12', 'The Laue symmetry is m3', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X ,1/2-Y , -Z ( 5) -Z ,1/2+X ,1/2-Y ( 6) 1/2-Y , -Z ,1/2+X ', '( 7) 1/2-Z , -X ,1/2+Y ( 8) 1/2+Y ,1/2-Z , -X ( 9) -Y ,1/2+Z ,1/2-X ', '(10) 1/2-X , -Y ,1/2+Z (11) 1/2+Z ,1/2-X , -Y (12) -X ,1/2+Y ,1/2-Z'] ,4599 "p 4 m m": [' Space Group P 4 m m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , Z ( 6) -Y , -X , Z ', '( 7) X , -Y , Z ( 8) Y , X , Z'] ,4600 "p -4 m 2": [' Space Group P -4 m 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y , Z ( 6) Y , X , -Z ', '( 7) X , -Y , Z ( 8) -Y , -X , -Z'] ,4601 "c 2/c": [' Space Group C 2/c', 'The lattice is centrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 8', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2-Z'] ,4602 "p 42 3 2": [' Space Group P 42 3 2', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2-Y ,1/2+X ,1/2+Z ( 5) 1/2+Z ,1/2-Y ,1/2+X ( 6) 1/2+X ,1/2+Z ,1/2-Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) 1/2+Y ,1/2-X ,1/2+Z (14) 1/2+Z ,1/2+Y ,1/2-X (15) 1/2-X ,1/2+Z ,1/2+Y ', '(16) 1/2-X ,1/2-Z ,1/2-Y (17) 1/2-Y ,1/2-X ,1/2-Z (18) 1/2-Z ,1/2-Y ,1/2-X ', '(19) Y , -Z , -X (20) 1/2+Y ,1/2+X ,1/2-Z (21) 1/2-Z ,1/2+Y ,1/2+X ', '(22) 1/2+X ,1/2-Z ,1/2+Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4603 "p 6/m c c": [' Space Group P 6/m c c', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 24', 'The Laue symmetry is 6/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z ', '( 7) Y-X, Y ,1/2+Z ( 8) -X , Y-X,1/2+Z ( 9) -Y , -X ,1/2+Z ', '(10) X-Y, -Y ,1/2+Z (11) X , X-Y,1/2+Z (12) Y , X ,1/2+Z'] ,4604 "f m 3": [' Space Group F m 3', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4605 "p n n a": [' Space Group P n n a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y ,1/2+Z ', '( 3) 1/2+X ,1/2-Y ,1/2+Z ( 4) 1/2-X , -Y , Z'] ,4606 "i -4 3 d": [' Space Group I -4 3 d', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 3/4+Y ,1/4-X ,3/4-Z ( 5) 3/4-Z ,3/4+Y ,1/4-X ( 6) 1/4-X ,3/4-Z ,3/4+Y ', '( 7) -X ,1/2-Y , Z ( 8) 1/2-Z , X , -Y ( 9) -Y ,1/2-Z , X ', '(10) X , -Y ,1/2-Z (11) Z , -X ,1/2-Y (12) 1/2-Y , Z , -X ', '(13) 1/4-Y ,1/4+X ,3/4-Z (14) 3/4-Z ,1/4-Y ,1/4+X (15) 1/4+X ,3/4-Z ,1/4-Y ', '(16) 3/4+X ,3/4+Z ,3/4+Y (17) 3/4+Y ,3/4+X ,3/4+Z (18) 3/4+Z ,3/4+Y ,3/4+X ', '(19) 1/2+Y ,1/2-Z , -X (20) 3/4-Y ,1/4-X ,1/4+Z (21) 1/4+Z ,3/4-Y ,1/4-X ', '(22) 1/4-X ,1/4+Z ,3/4-Y (23) -X ,1/2+Y ,1/2-Z (24) 1/2-Z , -X ,1/2+Y'] ,4607 "p n n n": [' Space Group P n n n', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y ,1/2+Z ', '( 3) 1/2+X , -Y ,1/2+Z ( 4) 1/2-X ,1/2-Y , Z'] ,4608 "p n n m": [' Space Group P n n m', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y ,1/2+Z ', '( 3) 1/2+X ,1/2-Y ,1/2+Z ( 4) -X , -Y , Z'] ,4609 "p -4": [' Space Group P -4', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 4', 'The Laue symmetry is 4/m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z'] ,4610 "i -4 3 m": [' Space Group I -4 3 m', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) Y , -X , -Z ( 5) -Z , Y , -X ( 6) -X , -Z , Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) -Y , X , -Z (14) -Z , -Y , X (15) X , -Z , -Y ', '(16) X , Z , Y (17) Y , X , Z (18) Z , Y , X ', '(19) Y , -Z , -X (20) -Y , -X , Z (21) Z , -Y , -X ', '(22) -X , Z , -Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4611 "p 65": [' Space Group P 65', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,5/6+Z ( 3) -Y , X-Y,2/3+Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X ,1/3+Z ( 6) Y , Y-X,1/6+Z'] ,4612 "r 3 r": [' Space Group R 3 r', 'The lattice is noncentrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 3', 'The Laue symmetry is 3R', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X'] ,4613 "p 2/m 1 1": [' Space Group P 2/m 1 1', 'The lattice is centrosymmetric primitive monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is a', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X , -Y , -Z'] ,4614 "i 41/a": [' Space Group I 41/a', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 3/4-Y ,1/4+X ,1/4+Z ', '( 3) 1/2-X , -Y ,1/2+Z ( 4) 3/4+Y ,3/4-X ,3/4+Z'] ,4615 "p 63 c m": [' Space Group P 63 c m', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z ', '( 7) Y-X, Y ,1/2+Z ( 8) -X , Y-X, Z ( 9) -Y , -X ,1/2+Z ', '(10) X-Y, -Y , Z (11) X , X-Y,1/2+Z (12) Y , X , Z'] ,4616 "c 1 2 1": [' Space Group C 1 2 1', 'The lattice is noncentrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in y', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y , -Z'] ,4617 "p b c n": [' Space Group P b c n', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) X , -Y ,1/2+Z ( 4) 1/2-X ,1/2-Y ,1/2+Z'] ,4618 "p b c m": [' Space Group P b c m', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y , Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) -X , -Y ,1/2+Z'] ,4619 "a m m 2": [' Space Group A m m 2', 'The lattice is noncentrosymmetric A-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4620 "i m -3 m": [' Space Group I m -3 m', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z ', '(13) Y , X , Z (14) Z , Y , X (15) X , Z , Y ', '(16) Y , X , -Z (17) -Z , Y , X (18) X , -Z , Y ', '(19) -Z , Y , -X (20) -X , -Z , Y (21) X , -Z , -Y ', '(22) -Y , X , -Z (23) -Z , -Y , X (24) Y , -X , -Z'] ,4621 "i 4 m m": [' Space Group I 4 m m', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , Z ( 6) -Y , -X , Z ', '( 7) X , -Y , Z ( 8) Y , X , Z'] ,4622 "p 61 2 2": [' Space Group P 61 2 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/6+Z ( 3) -Y , X-Y,1/3+Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X ,2/3+Z ( 6) Y , Y-X,5/6+Z ', '( 7) X-Y, -Y , -Z ( 8) X , X-Y,1/6-Z ( 9) Y , X ,1/3-Z ', '(10) Y-X, Y ,1/2-Z (11) -X , Y-X,2/3-Z (12) -Y , -X ,5/6-Z'] ,4623 "i m m 2": [' Space Group I m m 2', 'The lattice is noncentrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y , Z ( 4) -X , -Y , Z'] ,4624 "p 42/n c m": [' Space Group P 42/n c m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X ,1/2+Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X ,1/2+Z ', '( 5) 1/2-X , Y ,1/2+Z ( 6) 1/2-Y ,1/2-X , Z ', '( 7) X ,1/2-Y ,1/2+Z ( 8) Y , X , Z'] ,4625 "p b c a": [' Space Group P b c a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y , Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4626 "p 4 21 2": [' Space Group P 4 21 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X , Z ', '( 3) -X , -Y , Z ( 4) 1/2+Y ,1/2-X , Z ', '( 5) 1/2-X ,1/2+Y , -Z ( 6) -Y , -X , -Z ', '( 7) 1/2+X ,1/2-Y , -Z ( 8) Y , X , -Z'] ,4627 "p 4/n n c": [' Space Group P 4/n n c', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y , X , Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) Y ,1/2-X , Z ', '( 5) -X ,1/2+Y ,1/2+Z ( 6) -Y , -X ,1/2+Z ', '( 7) 1/2+X , -Y ,1/2+Z ( 8) 1/2+Y ,1/2+X ,1/2+Z'] ,4628 "f m -3 m": [' Space Group F m -3 m', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 192', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z ', '(13) Y , X , Z (14) Z , Y , X (15) X , Z , Y ', '(16) Y , X , -Z (17) -Z , Y , X (18) X , -Z , Y ', '(19) -Z , Y , -X (20) -X , -Z , Y (21) X , -Z , -Y ', '(22) -Y , X , -Z (23) -Z , -Y , X (24) Y , -X , -Z'] ,4629 "p 4/m m m": [' Space Group P 4/m m m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , Z ( 6) -Y , -X , Z ', '( 7) X , -Y , Z ( 8) Y , X , Z'] ,4630 "f m -3 c": [' Space Group F m -3 c', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 192', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z ', '(13) Y , X ,1/2+Z (14) 1/2+Z , Y , X (15) X ,1/2+Z , Y ', '(16) Y , X ,1/2-Z (17) 1/2-Z , Y , X (18) X ,1/2-Z , Y ', '(19) 1/2-Z , Y , -X (20) -X ,1/2-Z , Y (21) X ,1/2-Z , -Y ', '(22) -Y , X ,1/2-Z (23) 1/2-Z , -Y , X (24) Y , -X ,1/2-Z'] ,4631 "p n -3": [' Space Group P n -3', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X ,1/2+Y , -Z ( 5) -Z ,1/2+X ,1/2+Y ( 6) 1/2+Y , -Z ,1/2+X ', '( 7) 1/2-Z , X ,1/2-Y ( 8) 1/2-Y ,1/2-Z , X ( 9) Y ,1/2-Z ,1/2-X ', '(10) 1/2-X , Y ,1/2-Z (11) 1/2-Z ,1/2-X , Y (12) X ,1/2-Y ,1/2-Z'] ,4632 "p c c 2": [' Space Group P c c 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y , Z'] ,4633 "i 41 3 2": [' Space Group I 41 3 2', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4-Y ,3/4+X ,1/4+Z ( 5) 1/4+Z ,1/4-Y ,3/4+X ( 6) 3/4+X ,1/4+Z ,1/4-Y ', '( 7) 1/2-X , -Y ,1/2+Z ( 8) -Z ,1/2+X ,1/2-Y ( 9) 1/2-Y , -Z ,1/2+X ', '(10) 1/2+X ,1/2-Y , -Z (11) 1/2+Z ,1/2-X , -Y (12) -Y ,1/2+Z ,1/2-X ', '(13) 1/4+Y ,1/4-X ,3/4+Z (14) 3/4+Z ,1/4+Y ,1/4-X (15) 1/4-X ,3/4+Z ,1/4+Y ', '(16) 3/4-X ,3/4-Z ,3/4-Y (17) 3/4-Y ,3/4-X ,3/4-Z (18) 3/4-Z ,3/4-Y ,3/4-X ', '(19) 1/2+Y ,1/2-Z , -X (20) 3/4+Y ,1/4+X ,1/4-Z (21) 1/4-Z ,3/4+Y ,1/4+X ', '(22) 1/4+X ,1/4-Z ,3/4+Y (23) -X ,1/2+Y ,1/2-Z (24) 1/2-Z , -X ,1/2+Y'] ,4634 "p 42 m c": [' Space Group P 42 m c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) -X , Y , Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y , Z ( 8) Y , X ,1/2+Z'] ,4635 "p 4 c c": [' Space Group P 4 c c', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X ,1/2+Z'] ,4636 "p m -3 m": [' Space Group P m -3 m', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z ', '(13) Y , X , Z (14) Z , Y , X (15) X , Z , Y ', '(16) Y , X , -Z (17) -Z , Y , X (18) X , -Z , Y ', '(19) -Z , Y , -X (20) -X , -Z , Y (21) X , -Z , -Y ', '(22) -Y , X , -Z (23) -Z , -Y , X (24) Y , -X , -Z'] ,4637 "p 32 1 2": [' Space Group P 32 1 2', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 31m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,2/3+Z ( 3) Y-X, -X ,1/3+Z ', '( 4) X , X-Y, -Z ( 5) Y-X, Y ,2/3-Z ( 6) -Y , -X ,1/3-Z'] ,4638 "p 32 1 1": [' Space Group P 32 1 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 3', 'The Laue symmetry is 3', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,2/3+Z ( 3) Y-X, -X ,1/3+Z'] ,4639 "r -3 m r": [' Space Group R -3 m r', 'The lattice is centrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 12', 'The Laue symmetry is 3mR', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) Y , X , Z ( 5) Z , Y , X ( 6) X , Z , Y'] ,4640 "p 3 c 1": [' Space Group P 3 c 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3m1', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y ,1/2+Z ( 5) -Y , -X ,1/2+Z ( 6) X , X-Y,1/2+Z'] ,4641 "p 2 2 21": [' Space Group P 2 2 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y ,1/2-Z ( 4) -X , -Y ,1/2+Z'] ,4642 "p 63": [' Space Group P 63', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/2+Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X , Z ( 6) Y , Y-X,1/2+Z'] ,4643 "p m 3": [' Space Group P m 3', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4644 "p 42/m": [' Space Group P 42/m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z'] ,4645 "p m c 21": [' Space Group P m c 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X , Y , Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y ,1/2+Z'] ,4646 "p 42/n": [' Space Group P 42/n', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y ,1/2+X ,1/2+Z ', '( 3) 1/2-X ,1/2-Y , Z ( 4) 1/2+Y , -X ,1/2+Z'] ,4647 "a m a 2": [' Space Group A m a 2', 'The lattice is noncentrosymmetric A-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2-X , Y , Z ', '( 3) 1/2+X , -Y , Z ( 4) -X , -Y , Z'] ,4648 "p 6/m": [' Space Group P 6/m', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z'] ,4649 "p -6 c 2": [' Space Group P -6 c 2', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y-X, -X ,1/2-Z ( 3) -Y , X-Y, Z ', '( 4) X , Y ,1/2-Z ( 5) Y-X, -X , Z ( 6) -Y , X-Y,1/2-Z ', '( 7) Y-X, Y ,1/2+Z ( 8) X , X-Y, -Z ( 9) -Y , -X ,1/2+Z ', '(10) Y-X, Y , -Z (11) X , X-Y,1/2+Z (12) -Y , -X , -Z'] ,4650 "i -4 c 2": [' Space Group I -4 c 2', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y ,1/2+Z ( 6) Y , X ,1/2-Z ', '( 7) X , -Y ,1/2+Z ( 8) -Y , -X ,1/2-Z'] ,4651 "F -1": [' Space Group F -1', 'The lattice is centrosymmetric F-centered triclinic', 'Multiplicity of a general site is 8', 'The Laue symmetry is -1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z'] ,4652 "p 3 1 m": [' Space Group P 3 1 m', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 31m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X , Z ( 5) -X , Y-X, Z ( 6) X-Y, -Y , Z'] ,4653 "c c c 2": [' Space Group C c c 2', 'The lattice is noncentrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y , Z'] ,4654 "i m 3": [' Space Group I m 3', 'The lattice is centrosymmetric I-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , Y , -Z ( 5) -Z , X , Y ( 6) Y , -Z , X ', '( 7) -Z , X , -Y ( 8) -Y , -Z , X ( 9) Y , -Z , -X ', '(10) -X , Y , -Z (11) -Z , -X , Y (12) X , -Y , -Z'] ,4655 "p -4 3 m": [' Space Group P -4 3 m', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) Y , -X , -Z ( 5) -Z , Y , -X ( 6) -X , -Z , Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) -Y , X , -Z (14) -Z , -Y , X (15) X , -Z , -Y ', '(16) X , Z , Y (17) Y , X , Z (18) Z , Y , X ', '(19) Y , -Z , -X (20) -Y , -X , Z (21) Z , -Y , -X ', '(22) -X , Z , -Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4656 "p -4 3 n": [' Space Group P -4 3 n', 'The lattice is noncentrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+Y ,1/2-X ,1/2-Z ( 5) 1/2-Z ,1/2+Y ,1/2-X ( 6) 1/2-X ,1/2-Z ,1/2+Y ', '( 7) -X , -Y , Z ( 8) -Z , X , -Y ( 9) -Y , -Z , X ', '(10) X , -Y , -Z (11) Z , -X , -Y (12) -Y , Z , -X ', '(13) 1/2-Y ,1/2+X ,1/2-Z (14) 1/2-Z ,1/2-Y ,1/2+X (15) 1/2+X ,1/2-Z ,1/2-Y ', '(16) 1/2+X ,1/2+Z ,1/2+Y (17) 1/2+Y ,1/2+X ,1/2+Z (18) 1/2+Z ,1/2+Y ,1/2+X ', '(19) Y , -Z , -X (20) 1/2-Y ,1/2-X ,1/2+Z (21) 1/2+Z ,1/2-Y ,1/2-X ', '(22) 1/2-X ,1/2+Z ,1/2-Y (23) -X , Y , -Z (24) -Z , -X , Y'] ,4657 "p -3 1 c": [' Space Group P -3 1 c', 'The lattice is centrosymmetric primitive trigonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 31m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X ,1/2+Z ( 5) -X , Y-X,1/2+Z ( 6) X-Y, -Y ,1/2+Z'] ,4658 "r 3 m": [' Space Group R 3 m', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3m1', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y , Z ( 5) -Y , -X , Z ( 6) X , X-Y, Z'] ,4659 "p 21": [' Space Group P 21', 'The lattice is noncentrosymmetric primitive monoclinic', 'Multiplicity of a general site is 2', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in y', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y , -Z'] ,4660 "r -3": [' Space Group R -3', 'The lattice is centrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z'] ,4661 "c m": [' Space Group C m', 'The lattice is noncentrosymmetric C-centered monoclinic', 'Multiplicity of a general site is 4', 'The Laue symmetry is 2/m', 'The unique monoclinic axis is b', 'The location of the origin is arbitrary in x z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) X , -Y , Z'] ,4662 "p 32 2 1": [' Space Group P 32 2 1', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3m1', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,2/3+Z ( 3) Y-X, -X ,1/3+Z ', '( 4) Y , X , -Z ( 5) -X , Y-X,2/3-Z ( 6) X-Y, -Y ,1/3-Z'] ,4663 "i 21 21 21": [' Space Group I 21 21 21', 'The lattice is noncentrosymmetric I-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) 1/2+X ,1/2-Y , -Z ', '( 3) -X ,1/2+Y ,1/2-Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4664 "p 42 2 2": [' Space Group P 42 2 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) -X , Y , -Z ( 6) -Y , -X ,1/2-Z ', '( 7) X , -Y , -Z ( 8) Y , X ,1/2-Z'] ,4665 "i -4 2 m": [' Space Group I -4 2 m', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) -X , Y , -Z ( 6) Y , X , Z ', '( 7) X , -Y , -Z ( 8) -Y , -X , Z'] ,4666 "p 65 1 1": [' Space Group P 65 1 1', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,5/6+Z ( 3) -Y , X-Y,2/3+Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X ,1/3+Z ( 6) Y , Y-X,1/6+Z'] ,4667 "p 61": [' Space Group P 61', 'The lattice is noncentrosymmetric primitive hexagonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 6/m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X ,1/6+Z ( 3) -Y , X-Y,1/3+Z ', '( 4) -X , -Y ,1/2+Z ( 5) Y-X, -X ,2/3+Z ( 6) Y , Y-X,5/6+Z'] ,4668 "i 2 3": [' Space Group I 2 3', 'The lattice is noncentrosymmetric I-centered cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , -Y , -Z ( 5) -Z , X , -Y ( 6) -Y , -Z , X ', '( 7) -Z , -X , Y ( 8) Y , -Z , -X ( 9) -Y , Z , -X ', '(10) -X , -Y , Z (11) Z , -X , -Y (12) -X , Y , -Z'] ,4669 "i -4 2 d": [' Space Group I -4 2 d', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) 1/2-X , Y ,3/4-Z ( 6) Y ,1/2+X ,1/4+Z ', '( 7) 1/2+X , -Y ,3/4-Z ( 8) -Y ,1/2-X ,1/4+Z'] ,4670 "p a 3": [' Space Group P a 3', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 24', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X , Y ,1/2-Z ( 5) 1/2-Z ,1/2+X , Y ( 6) Y ,1/2-Z ,1/2+X ', '( 7) -Z ,1/2+X ,1/2-Y ( 8) 1/2-Y , -Z ,1/2+X ( 9) 1/2+Y ,1/2-Z , -X ', '(10) -X ,1/2+Y ,1/2-Z (11) 1/2-Z , -X ,1/2+Y (12) 1/2+X ,1/2-Y , -Z'] ,4671 "f 2 3": [' Space Group F 2 3', 'The lattice is noncentrosymmetric F-centered cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) X , -Y , -Z ( 5) -Z , X , -Y ( 6) -Y , -Z , X ', '( 7) -Z , -X , Y ( 8) Y , -Z , -X ( 9) -Y , Z , -X ', '(10) -X , -Y , Z (11) Z , -X , -Y (12) -X , Y , -Z'] ,4672 "i 4 c m": [' Space Group I 4 c m', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X ,1/2+Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X ,1/2+Z'] ,4673 "r 3 c": [' Space Group R 3 c', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3m1', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y ,1/2+Z ( 5) -Y , -X ,1/2+Z ( 6) X , X-Y,1/2+Z'] ,4674 "p n m a": [' Space Group P n m a', 'The lattice is centrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X ,1/2+Y ,1/2+Z ', '( 3) X ,1/2-Y , Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4675 "r 3 c r": [' Space Group R 3 c r', 'The lattice is noncentrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3mR', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+Y ,1/2+X ,1/2+Z ( 5) 1/2+Z ,1/2+Y ,1/2+X ( 6) 1/2+X ,1/2+Z ,1/2+Y'] ,4676 "p n c 2": [' Space Group P n c 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y ,1/2+Z ', '( 3) X ,1/2-Y ,1/2+Z ( 4) -X , -Y , Z'] ,4677 "c 2 2 21": [' Space Group C 2 2 21', 'The lattice is noncentrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y ,1/2-Z ( 4) -X , -Y ,1/2+Z'] ,4678 "r 3 m r": [' Space Group R 3 m r', 'The lattice is noncentrosymmetric primitive rhombohedral', 'Multiplicity of a general site is 6', 'The Laue symmetry is 3mR', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) Y , X , Z ( 5) Z , Y , X ( 6) X , Z , Y'] ,4679 "p 43 2 2": [' Space Group P 43 2 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,3/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) Y , -X ,1/4+Z ', '( 5) -X , Y , -Z ( 6) -Y , -X ,3/4-Z ', '( 7) X , -Y ,1/2-Z ( 8) Y , X ,1/4-Z'] ,4680 "r 3 2": [' Space Group R 3 2', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 18', 'The Laue symmetry is 3m1', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X , -Z ( 5) -X , Y-X, -Z ( 6) X-Y, -Y , -Z'] ,4681 "p m a 2": [' Space Group P m a 2', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-X , Y , Z ', '( 3) 1/2+X , -Y , Z ( 4) -X , -Y , Z'] ,4682 "i 4/m m m": [' Space Group I 4/m m m', 'The lattice is centrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 32', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y , X , Z ', '( 3) -X , -Y , Z ( 4) Y , -X , Z ', '( 5) -X , Y , Z ( 6) -Y , -X , Z ', '( 7) X , -Y , Z ( 8) Y , X , Z'] ,4683 "c c c a": [' Space Group C c c a', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) 1/2-X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) 1/2-X , -Y , Z'] ,4684 "i 41 m d": [' Space Group I 41 m d', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y ,1/2+X ,1/4+Z ', '( 3) 1/2-X ,1/2-Y ,1/2+Z ( 4) 1/2+Y , -X ,3/4+Z ', '( 5) -X , Y , Z ( 6) -Y ,1/2-X ,1/4+Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) 1/2+Y , X ,3/4+Z'] ,4685 "c c c m": [' Space Group C c c m', 'The lattice is centrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 16', 'The Laue symmetry is mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) -X , Y ,1/2+Z ', '( 3) X , -Y ,1/2+Z ( 4) -X , -Y , Z'] ,4686 "p 41 21 2": [' Space Group P 41 21 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X ,1/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) 1/2+Y ,1/2-X ,3/4+Z ', '( 5) 1/2-X ,1/2+Y ,1/4-Z ( 6) -Y , -X ,1/2-Z ', '( 7) 1/2+X ,1/2-Y ,3/4-Z ( 8) Y , X , -Z'] ,4687 "p 31": [' Space Group P 31', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 3', 'The Laue symmetry is 3', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,1/3+Z ( 3) Y-X, -X ,2/3+Z'] ,4688 "p 32": [' Space Group P 32', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 3', 'The Laue symmetry is 3', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y,2/3+Z ( 3) Y-X, -X ,1/3+Z'] ,4689 "p 42/m n m": [' Space Group P 42/m n m', 'The lattice is centrosymmetric primitive tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2-Y ,1/2+X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) 1/2+Y ,1/2-X ,1/2+Z ', '( 5) 1/2-X ,1/2+Y ,1/2+Z ( 6) -Y , -X , Z ', '( 7) 1/2+X ,1/2-Y ,1/2+Z ( 8) Y , X , Z'] ,4690 "p 3 1 2": [' Space Group P 3 1 2', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 31m', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) X , X-Y, -Z ( 5) Y-X, Y , -Z ( 6) -Y , -X , -Z'] ,4691 "i 41 2 2": [' Space Group I 41 2 2', 'The lattice is noncentrosymmetric I-centered tetragonal', 'Multiplicity of a general site is 16', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -Y ,1/2+X ,1/4+Z ', '( 3) 1/2-X ,1/2-Y ,1/2+Z ( 4) 1/2+Y , -X ,3/4+Z ', '( 5) 1/2-X , Y ,3/4-Z ( 6) -Y , -X , -Z ', '( 7) X ,1/2-Y ,1/4-Z ( 8) 1/2+Y ,1/2+X ,1/2-Z'] ,4692 "p -3 m 1": [' Space Group P -3 m 1', 'The lattice is centrosymmetric primitive trigonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 3m1', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y-X, Y , Z ( 5) -Y , -X , Z ( 6) X , X-Y, Z'] ,4693 "a b m 2": [' Space Group A b m 2', 'The lattice is noncentrosymmetric A-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', '', '( 1) X , Y , Z ( 2) -X ,1/2+Y , Z ', '( 3) X ,1/2-Y , Z ( 4) -X , -Y , Z'] ,4694 "p n -3 n": [' Space Group P n -3 n', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X ,1/2+Y , -Z ( 5) -Z ,1/2+X ,1/2+Y ( 6) 1/2+Y , -Z ,1/2+X ', '( 7) 1/2-Z , X ,1/2-Y ( 8) 1/2-Y ,1/2-Z , X ( 9) Y ,1/2-Z ,1/2-X ', '(10) 1/2-X , Y ,1/2-Z (11) 1/2-Z ,1/2-X , Y (12) X ,1/2-Y ,1/2-Z ', '(13) 1/2+Y ,1/2+X ,1/2+Z (14) 1/2+Z ,1/2+Y ,1/2+X (15) 1/2+X ,1/2+Z ,1/2+Y ', '(16) Y , X ,1/2-Z (17) 1/2-Z , Y , X (18) X ,1/2-Z , Y ', '(19) -Z ,1/2+Y , -X (20) -X , -Z ,1/2+Y (21) 1/2+X , -Z , -Y ', '(22) -Y ,1/2+X , -Z (23) -Z , -Y ,1/2+X (24) 1/2+Y , -X , -Z'] ,4695 "r 3": [' Space Group R 3', 'The lattice is noncentrosymmetric R-centered trigonal', 'Multiplicity of a general site is 9', 'The Laue symmetry is 3', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z'] ,4696 "c 2 2 2": [' Space Group C 2 2 2', 'The lattice is noncentrosymmetric C-centered orthorhombic', 'Multiplicity of a general site is 8', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) X , -Y , -Z ', '( 3) -X , Y , -Z ( 4) -X , -Y , Z'] ,4697 "p n -3 m": [' Space Group P n -3 m', 'The lattice is centrosymmetric primitive cubic', 'Multiplicity of a general site is 48', 'The Laue symmetry is m3m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/2+X ,1/2+Y , -Z ( 5) -Z ,1/2+X ,1/2+Y ( 6) 1/2+Y , -Z ,1/2+X ', '( 7) 1/2-Z , X ,1/2-Y ( 8) 1/2-Y ,1/2-Z , X ( 9) Y ,1/2-Z ,1/2-X ', '(10) 1/2-X , Y ,1/2-Z (11) 1/2-Z ,1/2-X , Y (12) X ,1/2-Y ,1/2-Z ', '(13) Y , X , Z (14) Z , Y , X (15) X , Z , Y ', '(16) 1/2+Y ,1/2+X , -Z (17) -Z ,1/2+Y ,1/2+X (18) 1/2+X , -Z ,1/2+Y ', '(19) 1/2-Z , Y ,1/2-X (20) 1/2-X ,1/2-Z , Y (21) X ,1/2-Z ,1/2-Y ', '(22) 1/2-Y , X ,1/2-Z (23) 1/2-Z ,1/2-Y , X (24) Y ,1/2-X ,1/2-Z'] ,4698 "p 42 c m": [' Space Group P 42 c m', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/2+Z ', '( 3) -X , -Y , Z ( 4) Y , -X ,1/2+Z ', '( 5) -X , Y ,1/2+Z ( 6) -Y , -X , Z ', '( 7) X , -Y ,1/2+Z ( 8) Y , X , Z'] ,4699 "p 6/m 1 1": [' Space Group P 6/m 1 1', 'The lattice is centrosymmetric primitive hexagonal', 'Multiplicity of a general site is 12', 'The Laue symmetry is 6/m', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) X-Y, X , Z ( 3) -Y , X-Y, Z ', '( 4) -X , -Y , Z ( 5) Y-X, -X , Z ( 6) Y , Y-X, Z'] ,4700 "p 21 21 21": [' Space Group P 21 21 21', 'The lattice is noncentrosymmetric primitive orthorhombic', 'Multiplicity of a general site is 4', 'The Laue symmetry is mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) 1/2+X ,1/2-Y , -Z ', '( 3) -X ,1/2+Y ,1/2-Z ( 4) 1/2-X , -Y ,1/2+Z'] ,4701 "f d -3": [' Space Group F d -3', 'The lattice is centrosymmetric F-centered cubic', 'Multiplicity of a general site is 96', 'The Laue symmetry is m3', 'The inversion center is located at 0,0,0', '\nThe equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', '', '( 1) X , Y , Z ( 2) Z , X , Y ( 3) Y , Z , X ', '( 4) 1/4+X ,1/4+Y , -Z ( 5) -Z ,1/4+X ,1/4+Y ( 6) 1/4+Y , -Z ,1/4+X ', '( 7) 1/4-Z ,1/2+X ,3/4-Y ( 8) 3/4-Y ,1/4-Z ,1/2+X ( 9) 1/2+Y ,1/4-Z ,3/4-X ', '(10) 3/4-X ,1/2+Y ,1/4-Z (11) 1/4-Z ,3/4-X ,1/2+Y (12) 1/2+X ,3/4-Y ,1/4-Z'] ,4702 "p -4 b 2": [' Space Group P -4 b 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) Y , -X , -Z ', '( 3) -X , -Y , Z ( 4) -Y , X , -Z ', '( 5) 1/2-X ,1/2+Y , Z ( 6) 1/2+Y ,1/2+X , -Z ', '( 7) 1/2+X ,1/2-Y , Z ( 8) 1/2-Y ,1/2-X , -Z'] ,4703 "p 3 1 c": [' Space Group P 3 1 c', 'The lattice is noncentrosymmetric primitive trigonal', 'Multiplicity of a general site is 6', 'The Laue symmetry is 31m', 'The location of the origin is arbitrary in z', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X-Y, Z ( 3) Y-X, -X , Z ', '( 4) Y , X ,1/2+Z ( 5) -X , Y-X,1/2+Z ( 6) X-Y, -Y ,1/2+Z'] ,4704 "p 41 2 2": [' Space Group P 41 2 2', 'The lattice is noncentrosymmetric primitive tetragonal', 'Multiplicity of a general site is 8', 'The Laue symmetry is 4/mmm', '\nThe equivalent positions are:', '', '( 1) X , Y , Z ( 2) -Y , X ,1/4+Z ', '( 3) -X , -Y ,1/2+Z ( 4) Y , -X ,3/4+Z ', '( 5) -X , Y , -Z ( 6) -Y , -X ,1/4-Z ', '( 7) X , -Y ,1/2-Z ( 8) Y , X ,3/4-Z'] ,4450 "p 4/n b m": [' Space Group: P 4/n b m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X , Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X , Z \t', ' ( 5) -X ,1/2+Y , Z \t( 6) -Y , -X , Z \t', ' ( 7) 1/2+X , -Y , Z \t( 8) 1/2+Y ,1/2+X , Z \t'] , 4451 "p -4 c 2": [' Space Group: P -4 c 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) Y , X ,1/2-Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) -Y , -X ,1/2-Z \t'] , 4452 "r -3 m": [' Space Group: R -3 m', ' The lattice is centrosymmetric R-centered trigonal', ' Multiplicity of a general site is 36', ' The Laue symmetry is 3m1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y , Z \t( 5) -Y , -X , Z \t( 6) X , X-Y, Z \t'] , 4453 "p 42 n m": [' Space Group: P 42 n m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) 1/2+Y ,1/2-X ,1/2+Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2+Z \t( 6) -Y , -X , Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) Y , X , Z \t'] , 4454 "a b a 2": [' Space Group: A b a 2', ' The lattice is noncentrosymmetric A-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4455 "p 42/m b c": [' Space Group: P 42/m b c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) 1/2-X ,1/2+Y , Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4456 "p m n 21": [' Space Group: P m n 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) 1/2+X , -Y ,1/2+Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4457 "i 4/m c m ": [' Space Group: I 4/m c m', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 32', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X ,1/2+Z \t'] , 4458 "p 42/m c m": [' Space Group: P 42/m c m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X , Z \t'] , 4459 "p m -3": [' Space Group: P m -3', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4460 "p b a 2": [' Space Group: P b a 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4461 "i b a m": [' Space Group: I b a m', ' The lattice is centrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4462 "p 21/m": [' Space Group: P 21/m', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y , -Z \t'] , 4463 "p 41": [' Space Group: P 41', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 4', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) Y , -X ,3/4+Z \t'] , 4464 "p 42": [' Space Group: P 42', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 4', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t'] , 4465 "p 43": [' Space Group: P 43', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 4', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,3/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) Y , -X ,1/4+Z \t'] , 4466 "f 4 3 2": [' Space Group: F 4 3 2', ' The lattice is noncentrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) -Y , X , Z \t( 5) Z , -Y , X \t( 6) X , Z , -Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) Y , -X , Z \t(14) Z , Y , -X \t(15) -X , Z , Y \t', ' (16) -X , -Z , -Y \t(17) -Y , -X , -Z \t(18) -Z , -Y , -X \t', ' (19) Y , -Z , -X \t(20) Y , X , -Z \t(21) -Z , Y , X \t', ' (22) X , -Z , Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4467 "p -4 21 m": [' Space Group: P -4 21 m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) 1/2-X ,1/2+Y , -Z \t( 6) 1/2+Y ,1/2+X , Z \t', ' ( 7) 1/2+X ,1/2-Y , -Z \t( 8) 1/2-Y ,1/2-X , Z \t'] , 4468 "p 63/m c m": [' Space Group: P 63/m c m', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 24', ' The Laue symmetry is 6/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t', ' ( 7) Y-X, Y ,1/2+Z \t( 8) -X , Y-X, Z \t( 9) -Y , -X ,1/2+Z \t', ' (10) X-Y, -Y , Z \t(11) X , X-Y,1/2+Z \t(12) Y , X , Z \t'] , 4469 "p 2 3": [' Space Group: P 2 3', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 12', ' The Laue symmetry is m3', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , -Y , -Z \t( 5) -Z , X , -Y \t( 6) -Y , -Z , X \t', ' ( 7) -Z , -X , Y \t( 8) Y , -Z , -X \t( 9) -Y , Z , -X \t', ' (10) -X , -Y , Z \t(11) Z , -X , -Y \t(12) -X , Y , -Z \t'] , 4470 "i a 3": [' Space Group: I a 3', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X , Y ,1/2-Z \t( 5) 1/2-Z ,1/2+X , Y \t( 6) Y ,1/2-Z ,1/2+X \t', ' ( 7) -Z ,1/2+X ,1/2-Y \t( 8) 1/2-Y , -Z ,1/2+X \t( 9) 1/2+Y ,1/2-Z , -X \t', ' (10) -X ,1/2+Y ,1/2-Z \t(11) 1/2-Z , -X ,1/2+Y \t(12) 1/2+X ,1/2-Y , -Z \t'] , 4471 "p 3 2 1": [' Space Group: P 3 2 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3m1', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X , -Z \t( 5) -X , Y-X, -Z \t( 6) X-Y, -Y , -Z \t'] , 4472 "i a -3 d": [' Space Group: I a -3 d', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X , Y ,1/2-Z \t( 5) 1/2-Z ,1/2+X , Y \t( 6) Y ,1/2-Z ,1/2+X \t', ' ( 7) -Z ,1/2+X ,1/2-Y \t( 8) 1/2-Y , -Z ,1/2+X \t( 9) 1/2+Y ,1/2-Z , -X \t', ' (10) -X ,1/2+Y ,1/2-Z \t(11) 1/2-Z , -X ,1/2+Y \t(12) 1/2+X ,1/2-Y , -Z \t', ' (13) 1/4+Y ,1/4+X ,1/4+Z \t(14) 1/4+Z ,1/4+Y ,1/4+X \t(15) 1/4+X ,1/4+Z ,1/4+Y \t', ' (16) 3/4+Y ,1/4+X ,1/4-Z \t(17) 1/4-Z ,3/4+Y ,1/4+X \t(18) 1/4+X ,1/4-Z ,3/4+Y \t', ' (19) 3/4-Z ,3/4+Y ,1/4-X \t(20) 1/4-X ,3/4-Z ,3/4+Y \t(21) 3/4+X ,1/4-Z ,3/4-Y \t', ' (22) 3/4-Y ,3/4+X ,1/4-Z \t(23) 1/4-Z ,3/4-Y ,3/4+X \t(24) 3/4+Y ,1/4-X ,3/4-Z \t'] , 4473 "p a -3": [' Space Group: P a -3', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X , Y ,1/2-Z \t( 5) 1/2-Z ,1/2+X , Y \t( 6) Y ,1/2-Z ,1/2+X \t', ' ( 7) -Z ,1/2+X ,1/2-Y \t( 8) 1/2-Y , -Z ,1/2+X \t( 9) 1/2+Y ,1/2-Z , -X \t', ' (10) -X ,1/2+Y ,1/2-Z \t(11) 1/2-Z , -X ,1/2+Y \t(12) 1/2+X ,1/2-Y , -Z \t'] , 4474 "c 2": [' Space Group: C 2', ' The lattice is noncentrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in y', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4475 "r 3 2 h": [' Space Group: R 3 2 h', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3m1', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X , -Z \t( 5) -X , Y-X, -Z \t( 6) X-Y, -Y , -Z \t'] , 4476 "p c": [' Space Group: P c', ' The lattice is noncentrosymmetric primitive monoclinic', ' Multiplicity of a general site is 2', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in x z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y ,1/2+Z \t'] , 4477 "f 2 2 2": [' Space Group: F 2 2 2', ' The lattice is noncentrosymmetric F-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y , -Z \t( 4) -X , -Y , Z \t'] , 4478 "p 6 c c": [' Space Group: P 6 c c', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t', ' ( 7) Y-X, Y ,1/2+Z \t( 8) -X , Y-X,1/2+Z \t( 9) -Y , -X ,1/2+Z \t', ' (10) X-Y, -Y ,1/2+Z \t(11) X , X-Y,1/2+Z \t(12) Y , X ,1/2+Z \t'] , 4479 "r 3 2 r": [' Space Group: R 3 2 r', ' The lattice is noncentrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3mR', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) -Y , -X , -Z \t( 5) -Z , -Y , -X \t( 6) -X , -Z , -Y \t'] , 4480 "p 62 2 2": [' Space Group: P 62 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/3+Z \t( 3) -Y , X-Y,2/3+Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X ,1/3+Z \t( 6) Y , Y-X,2/3+Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y,1/3-Z \t( 9) Y , X ,2/3-Z \t', ' (10) Y-X, Y , -Z \t(11) -X , Y-X,1/3-Z \t(12) -Y , -X ,2/3-Z \t'] , 4481 "i 41 c d": [' Space Group: I 41 c d', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y ,1/2+X ,1/4+Z \t', ' ( 3) 1/2-X ,1/2-Y ,1/2+Z \t( 4) 1/2+Y , -X ,3/4+Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y ,1/2-X ,3/4+Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2+Y , X ,1/4+Z \t'] , 4482 "f m m 2": [' Space Group: F m m 2', ' The lattice is noncentrosymmetric F-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4483 "p m m 2": [' Space Group: P m m 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4484 "p m": [' Space Group: P m', ' The lattice is noncentrosymmetric primitive monoclinic', ' Multiplicity of a general site is 2', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in x z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , Z \t'] , 4485 "i 4 2 2": [' Space Group: I 4 2 2', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , -Z \t( 6) -Y , -X , -Z \t', ' ( 7) X , -Y , -Z \t( 8) Y , X , -Z \t'] , 4486 "p 31 2 1": [' Space Group: P 31 2 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3m1', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,1/3+Z \t( 3) Y-X, -X ,2/3+Z \t', ' ( 4) Y , X , -Z \t( 5) -X , Y-X,1/3-Z \t( 6) X-Y, -Y ,2/3-Z \t'] , 4487 "i -4": [' Space Group: I -4', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t'] , 4488 "p 2": [' Space Group: P 2', ' The lattice is noncentrosymmetric primitive monoclinic', ' Multiplicity of a general site is 2', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in y', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4489 "p 21 21 2": [' Space Group: P 21 21 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2+X ,1/2-Y , -Z \t', ' ( 3) 1/2-X ,1/2+Y , -Z \t( 4) -X , -Y , Z \t'] , 4490 "c 1 2/c 1": [' Space Group: C 1 2/c 1', ' The lattice is centrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 8', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2-Z \t'] , 4491 "i b a 2": [' Space Group: I b a 2', ' The lattice is noncentrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4492 "p b a m": [' Space Group: P b a m', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4493 "p b a n": [' Space Group: P b a n', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y , Z \t', ' ( 3) 1/2+X , -Y , Z \t( 4) 1/2-X ,1/2-Y , Z \t'] , 4494 "p m -3 n": [' Space Group: P m -3 n', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t', ' (13) 1/2+Y ,1/2+X ,1/2+Z \t(14) 1/2+Z ,1/2+Y ,1/2+X \t(15) 1/2+X ,1/2+Z ,1/2+Y \t', ' (16) 1/2+Y ,1/2+X ,1/2-Z \t(17) 1/2-Z ,1/2+Y ,1/2+X \t(18) 1/2+X ,1/2-Z ,1/2+Y \t', ' (19) 1/2-Z ,1/2+Y ,1/2-X \t(20) 1/2-X ,1/2-Z ,1/2+Y \t(21) 1/2+X ,1/2-Z ,1/2-Y \t', ' (22) 1/2-Y ,1/2+X ,1/2-Z \t(23) 1/2-Z ,1/2-Y ,1/2+X \t(24) 1/2+Y ,1/2-X ,1/2-Z \t'] , 4495 "i b c a": [' Space Group: I b c a', ' The lattice is centrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4496 "p 42 21 2": [' Space Group: P 42 21 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) 1/2+Y ,1/2-X ,1/2+Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2-Z \t( 6) -Y , -X , -Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2-Z \t( 8) Y , X , -Z \t'] , 4497 "f m m m": [' Space Group: F m m m', ' The lattice is centrosymmetric F-centered orthorhombic', ' Multiplicity of a general site is 32', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4498 "i 41": [' Space Group: I 41', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y ,1/2+X ,1/4+Z \t', ' ( 3) 1/2-X ,1/2-Y ,1/2+Z \t( 4) 1/2+Y , -X ,3/4+Z \t'] , 4499 "p 6": [' Space Group: P 6', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t'] , 4500 "p 3": [' Space Group: P 3', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 3', ' The Laue symmetry is 3', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t'] , 4501 "p m m n": [' Space Group: P m m n', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y , Z \t', ' ( 3) X ,1/2-Y , Z \t( 4) 1/2-X ,1/2-Y , Z \t'] , 4502 "p m m m": [' Space Group: P m m m', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4503 "r 3 m h": [' Space Group: R 3 m h', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3m1', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y , Z \t( 5) -Y , -X , Z \t( 6) X , X-Y, Z \t'] , 4504 "c m c 21": [' Space Group: C m c 21', ' The lattice is noncentrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y ,1/2+Z \t'] , 4505 "p 1": [' Space Group: P 1', ' The lattice is noncentrosymmetric primitive triclinic', ' Multiplicity of a general site is 1', ' The Laue symmetry is -1', ' The location of the origin is arbitrary in xyz', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t'] , 4506 "i 4": [' Space Group: I 4', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t'] , 4507 "p 4": [' Space Group: P 4', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 4', ' The Laue symmetry is 4/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t'] , 4508 "p 42 b c": [' Space Group: P 42 b c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) 1/2-X ,1/2+Y , Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4509 "p m m a": [' Space Group: P m m a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) 1/2-X , -Y , Z \t'] , 4510 "i -4 m 2": [' Space Group: I -4 m 2', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y , Z \t( 6) Y , X , -Z \t', ' ( 7) X , -Y , Z \t( 8) -Y , -X , -Z \t'] , 4511 "p -4 21 c": [' Space Group: P -4 21 c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2-Z \t( 6) 1/2+Y ,1/2+X ,1/2+Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2-Z \t( 8) 1/2-Y ,1/2-X ,1/2+Z \t'] , 4512 "p 4 2 2": [' Space Group: P 4 2 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , -Z \t( 6) -Y , -X , -Z \t', ' ( 7) X , -Y , -Z \t( 8) Y , X , -Z \t'] , 4513 "p 4/m c c": [' Space Group: P 4/m c c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X ,1/2+Z \t'] , 4514 "p -6 2 m": [' Space Group: P -6 2 m', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y-X, -X , -Z \t( 3) -Y , X-Y, Z \t', ' ( 4) X , Y , -Z \t( 5) Y-X, -X , Z \t( 6) -Y , X-Y, -Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) -X , Y-X, Z \t( 9) Y , X , -Z \t', ' (10) X-Y, -Y , Z \t(11) -X , Y-X, -Z \t(12) Y , X , Z \t'] , 4515 "p 1 2/m 1": [' Space Group: P 1 2/m 1', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4516 "p -6 2 c": [' Space Group: P -6 2 c', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y-X, -X ,1/2-Z \t( 3) -Y , X-Y, Z \t', ' ( 4) X , Y ,1/2-Z \t( 5) Y-X, -X , Z \t( 6) -Y , X-Y,1/2-Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) -X , Y-X,1/2+Z \t( 9) Y , X , -Z \t', ' (10) X-Y, -Y ,1/2+Z \t(11) -X , Y-X, -Z \t(12) Y , X ,1/2+Z \t'] , 4517 "p 6 m m": [' Space Group: P 6 m m', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t', ' ( 7) Y-X, Y , Z \t( 8) -X , Y-X, Z \t( 9) -Y , -X , Z \t', ' (10) X-Y, -Y , Z \t(11) X , X-Y, Z \t(12) Y , X , Z \t'] , 4518 "c c": [' Space Group: C c', ' The lattice is noncentrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in x z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y ,1/2+Z \t'] , 4519 "p 43 3 2": [' Space Group: P 43 3 2', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 3/4-Y ,1/4+X ,3/4+Z \t( 5) 3/4+Z ,3/4-Y ,1/4+X \t( 6) 1/4+X ,3/4+Z ,3/4-Y \t', ' ( 7) 1/2-X , -Y ,1/2+Z \t( 8) -Z ,1/2+X ,1/2-Y \t( 9) 1/2-Y , -Z ,1/2+X \t', ' (10) 1/2+X ,1/2-Y , -Z \t(11) 1/2+Z ,1/2-X , -Y \t(12) -Y ,1/2+Z ,1/2-X \t', ' (13) 3/4+Y ,3/4-X ,1/4+Z \t(14) 1/4+Z ,3/4+Y ,3/4-X \t(15) 3/4-X ,1/4+Z ,3/4+Y \t', ' (16) 1/4-X ,1/4-Z ,1/4-Y \t(17) 1/4-Y ,1/4-X ,1/4-Z \t(18) 1/4-Z ,1/4-Y ,1/4-X \t', ' (19) 1/2+Y ,1/2-Z , -X \t(20) 1/4+Y ,3/4+X ,3/4-Z \t(21) 3/4-Z ,1/4+Y ,3/4+X \t', ' (22) 3/4+X ,3/4-Z ,1/4+Y \t(23) -X ,1/2+Y ,1/2-Z \t(24) 1/2-Z , -X ,1/2+Y \t'] , 4520 "a 2 2 2": [' Space Group: A 2 2 2', ' The lattice is noncentrosymmetric A-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y , -Z \t( 4) -X , -Y , Z \t'] , 4521 "p -3": [' Space Group: P -3', ' The lattice is centrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t'] , 4522 "p -1": [' Space Group: P -1', ' The lattice is centrosymmetric primitive triclinic', ' Multiplicity of a general site is 2', ' The Laue symmetry is -1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t'] , 4523 "f d d 2": [' Space Group: F d d 2', ' The lattice is noncentrosymmetric F-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/4-X ,1/4+Y ,1/4+Z \t', ' ( 3) 1/4+X ,1/4-Y ,1/4+Z \t( 4) -X ,1/2-Y ,1/2+Z \t'] , 4524 "p 62": [' Space Group: P 62', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/3+Z \t( 3) -Y , X-Y,2/3+Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X ,1/3+Z \t( 6) Y , Y-X,2/3+Z \t'] , 4525 "c m m a": [' Space Group: C m m a', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X ,1/2-Y , Z \t( 4) -X ,1/2-Y , Z \t'] , 4526 "p -3 c 1": [' Space Group: P -3 c 1', ' The lattice is centrosymmetric primitive trigonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 3m1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y ,1/2+Z \t( 5) -Y , -X ,1/2+Z \t( 6) X , X-Y,1/2+Z \t'] , 4527 "c m c m": [' Space Group: C m c m', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y ,1/2+Z \t'] , 4528 "c m m m": [' Space Group: C m m m', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4529 "c m c a": [' Space Group: C m c a', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) -X ,1/2-Y ,1/2+Z \t'] , 4530 "i a -3": [' Space Group: I a -3', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X , Y ,1/2-Z \t( 5) 1/2-Z ,1/2+X , Y \t( 6) Y ,1/2-Z ,1/2+X \t', ' ( 7) -Z ,1/2+X ,1/2-Y \t( 8) 1/2-Y , -Z ,1/2+X \t( 9) 1/2+Y ,1/2-Z , -X \t', ' (10) -X ,1/2+Y ,1/2-Z \t(11) 1/2-Z , -X ,1/2+Y \t(12) 1/2+X ,1/2-Y , -Z \t'] , 4531 "i m a 2": [' Space Group: I m a 2', ' The lattice is noncentrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y , Z \t', ' ( 3) 1/2+X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4532 "p 63/m m c": [' Space Group: P 63/m m c', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 24', ' The Laue symmetry is 6/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t', ' ( 7) Y-X, Y , Z \t( 8) -X , Y-X,1/2+Z \t( 9) -Y , -X , Z \t', ' (10) X-Y, -Y ,1/2+Z \t(11) X , X-Y, Z \t(12) Y , X ,1/2+Z \t'] , 4533 "p 4 3 2": [' Space Group: P 4 3 2', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) -Y , X , Z \t( 5) Z , -Y , X \t( 6) X , Z , -Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) Y , -X , Z \t(14) Z , Y , -X \t(15) -X , Z , Y \t', ' (16) -X , -Z , -Y \t(17) -Y , -X , -Z \t(18) -Z , -Y , -X \t', ' (19) Y , -Z , -X \t(20) Y , X , -Z \t(21) -Z , Y , X \t', ' (22) X , -Z , Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4534 "i 41/a c d": [' Space Group: I 41/a c d', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 32', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/4-Y ,3/4+X ,1/4+Z \t', ' ( 3) 1/2-X , -Y ,1/2+Z \t( 4) 1/4+Y ,1/4-X ,3/4+Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) 1/4-Y ,3/4-X ,3/4+Z \t', ' ( 7) 1/2+X , -Y , Z \t( 8) 1/4+Y ,1/4+X ,1/4+Z \t'] , 4535 "p -4 2 c": [' Space Group: P -4 2 c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y ,1/2-Z \t( 6) Y , X ,1/2+Z \t', ' ( 7) X , -Y ,1/2-Z \t( 8) -Y , -X ,1/2+Z \t'] , 4536 "p 4 n c": [' Space Group: P 4 n c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2+Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4537 "p 4/m": [' Space Group: P 4/m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t'] , 4538 "p 4/n": [' Space Group: P 4/n', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X , Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X , Z \t'] , 4539 "p 21/c": [' Space Group: P 21/c', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y ,1/2-Z \t'] , 4540 "r -3 c": [' Space Group: R -3 c', ' The lattice is centrosymmetric R-centered trigonal', ' Multiplicity of a general site is 36', ' The Laue symmetry is 3m1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y ,1/2+Z \t( 5) -Y , -X ,1/2+Z \t( 6) X , X-Y,1/2+Z \t'] , 4541 "p 4/n m m": [' Space Group: P 4/n m m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X , Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X , Z \t', ' ( 5) 1/2-X , Y , Z \t( 6) 1/2-Y ,1/2-X , Z \t', ' ( 7) X ,1/2-Y , Z \t( 8) Y , X , Z \t'] , 4542 "i 4/m": [' Space Group: I 4/m', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t'] , 4543 "p 3 m 1": [' Space Group: P 3 m 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3m1', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y , Z \t( 5) -Y , -X , Z \t( 6) X , X-Y, Z \t'] , 4544 "p 63/m": [' Space Group: P 63/m', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t'] , 4545 "p 6 2 2": [' Space Group: P 6 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y, -Z \t( 9) Y , X , -Z \t', ' (10) Y-X, Y , -Z \t(11) -X , Y-X, -Z \t(12) -Y , -X , -Z \t'] , 4546 "p 2/m": [' Space Group: P 2/m', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4547 "f d 3": [' Space Group: F d 3', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4+X ,1/4+Y , -Z \t( 5) -Z ,1/4+X ,1/4+Y \t( 6) 1/4+Y , -Z ,1/4+X \t', ' ( 7) 1/4-Z ,1/2+X ,3/4-Y \t( 8) 3/4-Y ,1/4-Z ,1/2+X \t( 9) 1/2+Y ,1/4-Z ,3/4-X \t', ' (10) 3/4-X ,1/2+Y ,1/4-Z \t(11) 1/4-Z ,3/4-X ,1/2+Y \t(12) 1/2+X ,3/4-Y ,1/4-Z \t'] , 4548 "i 41/a m d": [' Space Group: I 41/a m d', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 32', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/4-Y ,3/4+X ,1/4+Z \t', ' ( 3) 1/2-X , -Y ,1/2+Z \t( 4) 1/4+Y ,1/4-X ,3/4+Z \t', ' ( 5) -X , Y , Z \t( 6) 1/4-Y ,3/4-X ,1/4+Z \t', ' ( 7) 1/2+X , -Y ,1/2+Z \t( 8) 1/4+Y ,1/4+X ,3/4+Z \t'] , 4549 "p 4/n c c": [' Space Group: P 4/n c c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X , Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X , Z \t', ' ( 5) 1/2-X , Y ,1/2+Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) X ,1/2-Y ,1/2+Z \t( 8) Y , X ,1/2+Z \t'] , 4550 "i m m a": [' Space Group: I m m a', ' The lattice is centrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X ,1/2-Y , Z \t( 4) -X ,1/2-Y , Z \t'] , 4551 "p 4 b m": [' Space Group: P 4 b m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) 1/2-X ,1/2+Y , Z \t( 6) 1/2-Y ,1/2-X , Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2+Y ,1/2+X , Z \t'] , 4552 "p 2/c": [' Space Group: P 2/c', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2-Z \t'] , 4553 "p -6 m 2": [' Space Group: P -6 m 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y-X, -X , -Z \t( 3) -Y , X-Y, Z \t', ' ( 4) X , Y , -Z \t( 5) Y-X, -X , Z \t( 6) -Y , X-Y, -Z \t', ' ( 7) Y-X, Y , Z \t( 8) X , X-Y, -Z \t( 9) -Y , -X , Z \t', ' (10) Y-X, Y , -Z \t(11) X , X-Y, Z \t(12) -Y , -X , -Z \t'] , 4554 "p n n 2": [' Space Group: P n n 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y ,1/2+Z \t', ' ( 3) 1/2+X ,1/2-Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4555 "p 31 1 2": [' Space Group: P 31 1 2', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 31m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,1/3+Z \t( 3) Y-X, -X ,2/3+Z \t', ' ( 4) X , X-Y, -Z \t( 5) Y-X, Y ,1/3-Z \t( 6) -Y , -X ,2/3-Z \t'] , 4556 "f -4 3 c": [' Space Group: F -4 3 c', ' The lattice is noncentrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+Y ,1/2-X ,1/2-Z \t( 5) 1/2-Z ,1/2+Y ,1/2-X \t( 6) 1/2-X ,1/2-Z ,1/2+Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) 1/2-Y ,1/2+X ,1/2-Z \t(14) 1/2-Z ,1/2-Y ,1/2+X \t(15) 1/2+X ,1/2-Z ,1/2-Y \t', ' (16) 1/2+X ,1/2+Z ,1/2+Y \t(17) 1/2+Y ,1/2+X ,1/2+Z \t(18) 1/2+Z ,1/2+Y ,1/2+X \t', ' (19) Y , -Z , -X \t(20) 1/2-Y ,1/2-X ,1/2+Z \t(21) 1/2+Z ,1/2-Y ,1/2-X \t', ' (22) 1/2-X ,1/2+Z ,1/2-Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4557 "i m -3": [' Space Group: I m -3', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4558 "f -4 3 m": [' Space Group: F -4 3 m', ' The lattice is noncentrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) Y , -X , -Z \t( 5) -Z , Y , -X \t( 6) -X , -Z , Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) -Y , X , -Z \t(14) -Z , -Y , X \t(15) X , -Z , -Y \t', ' (16) X , Z , Y \t(17) Y , X , Z \t(18) Z , Y , X \t', ' (19) Y , -Z , -X \t(20) -Y , -X , Z \t(21) Z , -Y , -X \t', ' (22) -X , Z , -Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4559 "i 21 3": [' Space Group: I 21 3', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X ,1/2-Y , -Z \t( 5) -Z ,1/2+X ,1/2-Y \t( 6) 1/2-Y , -Z ,1/2+X \t', ' ( 7) 1/2-Z , -X ,1/2+Y \t( 8) 1/2+Y ,1/2-Z , -X \t( 9) -Y ,1/2+Z ,1/2-X \t', ' (10) 1/2-X , -Y ,1/2+Z \t(11) 1/2+Z ,1/2-X , -Y \t(12) -X ,1/2+Y ,1/2-Z \t'] , 4560 "p 42/m m c": [' Space Group: P 42/m m c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X ,1/2+Z \t'] , 4561 "p 65 2 2": [' Space Group: P 65 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,5/6+Z \t( 3) -Y , X-Y,2/3+Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X ,1/3+Z \t( 6) Y , Y-X,1/6+Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y,5/6-Z \t( 9) Y , X ,2/3-Z \t', ' (10) Y-X, Y ,1/2-Z \t(11) -X , Y-X,1/3-Z \t(12) -Y , -X ,1/6-Z \t'] , 4562 "p 4/m n c": [' Space Group: P 4/m n c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2+Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4563 "c 2/m": [' Space Group: C 2/m', ' The lattice is centrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 8', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4564 "f d d d": [' Space Group: F d d d', ' The lattice is centrosymmetric F-centered orthorhombic', ' Multiplicity of a general site is 32', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/4+Y ,1/4+Z \t', ' ( 3) 1/4+X , -Y ,1/4+Z \t( 4) 3/4-X ,1/4-Y ,1/2+Z \t'] , 4565 "c m m 2": [' Space Group: C m m 2', ' The lattice is noncentrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4566 "p 43 21 2": [' Space Group: P 43 21 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X ,3/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) 1/2+Y ,1/2-X ,1/4+Z \t', ' ( 5) 1/2-X ,1/2+Y ,3/4-Z \t( 6) -Y , -X ,1/2-Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/4-Z \t( 8) Y , X , -Z \t'] , 4567 "p -3 1 m": [' Space Group: P -3 1 m', ' The lattice is centrosymmetric primitive trigonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 31m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X , Z \t( 5) -X , Y-X, Z \t( 6) X-Y, -Y , Z \t'] , 4568 "i 2 2 2": [' Space Group: I 2 2 2', ' The lattice is noncentrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y , -Z \t( 4) -X , -Y , Z \t'] , 4569 "p 42/n b c": [' Space Group: P 42/n b c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X ,1/2+Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X ,1/2+Z \t', ' ( 5) -X ,1/2+Y , Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) 1/2+X , -Y , Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4570 "i 4 3 2": [' Space Group: I 4 3 2', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) -Y , X , Z \t( 5) Z , -Y , X \t( 6) X , Z , -Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) Y , -X , Z \t(14) Z , Y , -X \t(15) -X , Z , Y \t', ' (16) -X , -Z , -Y \t(17) -Y , -X , -Z \t(18) -Z , -Y , -X \t', ' (19) Y , -Z , -X \t(20) Y , X , -Z \t(21) -Z , Y , X \t', ' (22) X , -Z , Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4571 "p 41 3 2": [' Space Group: P 41 3 2', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4-Y ,3/4+X ,1/4+Z \t( 5) 1/4+Z ,1/4-Y ,3/4+X \t( 6) 3/4+X ,1/4+Z ,1/4-Y \t', ' ( 7) 1/2-X , -Y ,1/2+Z \t( 8) -Z ,1/2+X ,1/2-Y \t( 9) 1/2-Y , -Z ,1/2+X \t', ' (10) 1/2+X ,1/2-Y , -Z \t(11) 1/2+Z ,1/2-X , -Y \t(12) -Y ,1/2+Z ,1/2-X \t', ' (13) 1/4+Y ,1/4-X ,3/4+Z \t(14) 3/4+Z ,1/4+Y ,1/4-X \t(15) 1/4-X ,3/4+Z ,1/4+Y \t', ' (16) 3/4-X ,3/4-Z ,3/4-Y \t(17) 3/4-Y ,3/4-X ,3/4-Z \t(18) 3/4-Z ,3/4-Y ,3/4-X \t', ' (19) 1/2+Y ,1/2-Z , -X \t(20) 3/4+Y ,1/4+X ,1/4-Z \t(21) 1/4-Z ,3/4+Y ,1/4+X \t', ' (22) 1/4+X ,1/4-Z ,3/4+Y \t(23) -X ,1/2+Y ,1/2-Z \t(24) 1/2-Z , -X ,1/2+Y \t'] , 4572 "p 42/n m c": [' Space Group: P 42/n m c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X ,1/2+Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X ,1/2+Z \t', ' ( 5) 1/2-X , Y , Z \t( 6) 1/2-Y ,1/2-X ,1/2+Z \t', ' ( 7) X ,1/2-Y , Z \t( 8) Y , X ,1/2+Z \t'] , 4573 "p 64 2 2": [' Space Group: P 64 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,2/3+Z \t( 3) -Y , X-Y,1/3+Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X ,2/3+Z \t( 6) Y , Y-X,1/3+Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y,2/3-Z \t( 9) Y , X ,1/3-Z \t', ' (10) Y-X, Y , -Z \t(11) -X , Y-X,2/3-Z \t(12) -Y , -X ,1/3-Z \t'] , 4574 "p c a 21": [' Space Group: P c a 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y ,1/2+Z \t', ' ( 3) 1/2+X , -Y , Z \t( 4) -X , -Y ,1/2+Z \t'] , 4575 "f d -3 c": [' Space Group: F d -3 c', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 192', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4+X ,1/4+Y , -Z \t( 5) -Z ,1/4+X ,1/4+Y \t( 6) 1/4+Y , -Z ,1/4+X \t', ' ( 7) 1/4-Z ,1/2+X ,3/4-Y \t( 8) 3/4-Y ,1/4-Z ,1/2+X \t( 9) 1/2+Y ,1/4-Z ,3/4-X \t', ' (10) 3/4-X ,1/2+Y ,1/4-Z \t(11) 1/4-Z ,3/4-X ,1/2+Y \t(12) 1/2+X ,3/4-Y ,1/4-Z \t', ' (13) Y , X ,1/2+Z \t(14) 1/2+Z , Y , X \t(15) X ,1/2+Z , Y \t', ' (16) 1/4+Y ,1/4+X ,1/2-Z \t(17) 1/2-Z ,1/4+Y ,1/4+X \t(18) 1/4+X ,1/2-Z ,1/4+Y \t', ' (19) 3/4-Z ,1/2+Y ,3/4-X \t(20) 3/4-X ,3/4-Z ,1/2+Y \t(21) 1/2+X ,3/4-Z ,3/4-Y \t', ' (22) 3/4-Y ,1/2+X ,3/4-Z \t(23) 3/4-Z ,3/4-Y ,1/2+X \t(24) 1/2+Y ,3/4-X ,3/4-Z \t'] , 4576 "p n a 21": [' Space Group: P n a 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y ,1/2+Z \t', ' ( 3) 1/2+X ,1/2-Y , Z \t( 4) -X , -Y ,1/2+Z \t'] , 4577 "p -4 n 2": [' Space Group: P -4 n 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2+Z \t( 6) 1/2+Y ,1/2+X ,1/2-Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) 1/2-Y ,1/2-X ,1/2-Z \t'] , 4578 "p 42/n n m": [' Space Group: P 42/n n m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X ,1/2+Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X ,1/2+Z \t', ' ( 5) -X ,1/2+Y ,1/2+Z \t( 6) -Y , -X , Z \t', ' ( 7) 1/2+X , -Y ,1/2+Z \t( 8) 1/2+Y ,1/2+X , Z \t'] , 4579 "f d -3 m": [' Space Group: F d -3 m', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 192', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4+X ,1/4+Y , -Z \t( 5) -Z ,1/4+X ,1/4+Y \t( 6) 1/4+Y , -Z ,1/4+X \t', ' ( 7) 1/4-Z ,1/2+X ,3/4-Y \t( 8) 3/4-Y ,1/4-Z ,1/2+X \t( 9) 1/2+Y ,1/4-Z ,3/4-X \t', ' (10) 3/4-X ,1/2+Y ,1/4-Z \t(11) 1/4-Z ,3/4-X ,1/2+Y \t(12) 1/2+X ,3/4-Y ,1/4-Z \t', ' (13) Y , X , Z \t(14) Z , Y , X \t(15) X , Z , Y \t', ' (16) 1/4+Y ,1/4+X , -Z \t(17) -Z ,1/4+Y ,1/4+X \t(18) 1/4+X , -Z ,1/4+Y \t', ' (19) 1/4-Z ,1/2+Y ,3/4-X \t(20) 3/4-X ,1/4-Z ,1/2+Y \t(21) 1/2+X ,1/4-Z ,3/4-Y \t', ' (22) 3/4-Y ,1/2+X ,1/4-Z \t(23) 1/4-Z ,3/4-Y ,1/2+X \t(24) 1/2+Y ,3/4-X ,1/4-Z \t'] , 4580 "r -3 c r": [' Space Group: R -3 c r', ' The lattice is centrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 12', ' The Laue symmetry is 3mR', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+Y ,1/2+X ,1/2+Z \t( 5) 1/2+Z ,1/2+Y ,1/2+X \t( 6) 1/2+X ,1/2+Z ,1/2+Y \t'] , 4581 "p 63 m c": [' Space Group: P 63 m c', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t', ' ( 7) Y-X, Y , Z \t( 8) -X , Y-X,1/2+Z \t( 9) -Y , -X , Z \t', ' (10) X-Y, -Y ,1/2+Z \t(11) X , X-Y, Z \t(12) Y , X ,1/2+Z \t'] , 4582 "p 4/m b m": [' Space Group: P 4/m b m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) 1/2-X ,1/2+Y , Z \t( 6) 1/2-Y ,1/2-X , Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2+Y ,1/2+X , Z \t'] , 4583 "p 2 2 2": [' Space Group: P 2 2 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y , -Z \t( 4) -X , -Y , Z \t'] , 4584 "p 63 2 2": [' Space Group: P 63 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y,1/2-Z \t( 9) Y , X , -Z \t', ' (10) Y-X, Y ,1/2-Z \t(11) -X , Y-X, -Z \t(12) -Y , -X ,1/2-Z \t'] , 4585 "p 6/m m m": [' Space Group: P 6/m m m', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 24', ' The Laue symmetry is 6/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t', ' ( 7) Y-X, Y , Z \t( 8) -X , Y-X, Z \t( 9) -Y , -X , Z \t', ' (10) X-Y, -Y , Z \t(11) X , X-Y, Z \t(12) Y , X , Z \t'] , 4586 "p c c n": [' Space Group: P c c n', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y ,1/2+Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) 1/2-X ,1/2-Y , Z \t'] , 4587 "p c c m": [' Space Group: P c c m', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4588 "p m n a": [' Space Group: P m n a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) 1/2+X , -Y ,1/2+Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4589 "f 41 3 2": [' Space Group: F 41 3 2', ' The lattice is noncentrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 3/4-Y ,3/4+X ,1/4+Z \t( 5) 1/4+Z ,3/4-Y ,3/4+X \t( 6) 3/4+X ,1/4+Z ,3/4-Y \t', ' ( 7) -X ,1/2-Y ,1/2+Z \t( 8) 1/2-Z ,1/2+X , -Y \t( 9) -Y ,1/2-Z ,1/2+X \t', ' (10) 1/2+X , -Y ,1/2-Z \t(11) 1/2+Z , -X ,1/2-Y \t(12) 1/2-Y ,1/2+Z , -X \t', ' (13) 1/4+Y ,3/4-X ,3/4+Z \t(14) 3/4+Z ,1/4+Y ,3/4-X \t(15) 3/4-X ,3/4+Z ,1/4+Y \t', ' (16) 1/4-X ,1/4-Z ,1/4-Y \t(17) 1/4-Y ,1/4-X ,1/4-Z \t(18) 1/4-Z ,1/4-Y ,1/4-X \t', ' (19) 1/2+Y , -Z ,1/2-X \t(20) 3/4+Y ,1/4+X ,3/4-Z \t(21) 3/4-Z ,3/4+Y ,1/4+X \t', ' (22) 1/4+X ,3/4-Z ,3/4+Y \t(23) 1/2-X ,1/2+Y , -Z \t(24) -Z ,1/2-X ,1/2+Y \t'] , 4590 "r -3 r": [' Space Group: R -3 r', ' The lattice is centrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3R', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t'] , 4591 "p 1 1 2/m": [' Space Group: P 1 1 2/m', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is c', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , -Y , Z \t'] , 4592 "p 64": [' Space Group: P 64', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,2/3+Z \t( 3) -Y , X-Y,1/3+Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X ,2/3+Z \t( 6) Y , Y-X,1/3+Z \t'] , 4593 "p c c a": [' Space Group: P c c a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) 1/2-X , -Y , Z \t'] , 4594 "f m -3": [' Space Group: F m -3', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4595 "p -6": [' Space Group: P -6', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y-X, -X , -Z \t( 3) -Y , X-Y, Z \t', ' ( 4) X , Y , -Z \t( 5) Y-X, -X , Z \t( 6) -Y , X-Y, -Z \t'] , 4596 "i m m m": [' Space Group: I m m m', ' The lattice is centrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4597 "p -4 2 m": [' Space Group: P -4 2 m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y , -Z \t( 6) Y , X , Z \t', ' ( 7) X , -Y , -Z \t( 8) -Y , -X , Z \t'] , 4598 "p 21 3": [' Space Group: P 21 3', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 12', ' The Laue symmetry is m3', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X ,1/2-Y , -Z \t( 5) -Z ,1/2+X ,1/2-Y \t( 6) 1/2-Y , -Z ,1/2+X \t', ' ( 7) 1/2-Z , -X ,1/2+Y \t( 8) 1/2+Y ,1/2-Z , -X \t( 9) -Y ,1/2+Z ,1/2-X \t', ' (10) 1/2-X , -Y ,1/2+Z \t(11) 1/2+Z ,1/2-X , -Y \t(12) -X ,1/2+Y ,1/2-Z \t'] , 4599 "p 4 m m": [' Space Group: P 4 m m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X , Z \t'] , 4600 "p -4 m 2": [' Space Group: P -4 m 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y , Z \t( 6) Y , X , -Z \t', ' ( 7) X , -Y , Z \t( 8) -Y , -X , -Z \t'] , 4601 "c 2/c": [' Space Group: C 2/c', ' The lattice is centrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 8', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2-Z \t'] , 4602 "p 42 3 2": [' Space Group: P 42 3 2', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2-Y ,1/2+X ,1/2+Z \t( 5) 1/2+Z ,1/2-Y ,1/2+X \t( 6) 1/2+X ,1/2+Z ,1/2-Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) 1/2+Y ,1/2-X ,1/2+Z \t(14) 1/2+Z ,1/2+Y ,1/2-X \t(15) 1/2-X ,1/2+Z ,1/2+Y \t', ' (16) 1/2-X ,1/2-Z ,1/2-Y \t(17) 1/2-Y ,1/2-X ,1/2-Z \t(18) 1/2-Z ,1/2-Y ,1/2-X \t', ' (19) Y , -Z , -X \t(20) 1/2+Y ,1/2+X ,1/2-Z \t(21) 1/2-Z ,1/2+Y ,1/2+X \t', ' (22) 1/2+X ,1/2-Z ,1/2+Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4603 "p 6/m c c": [' Space Group: P 6/m c c', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 24', ' The Laue symmetry is 6/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t', ' ( 7) Y-X, Y ,1/2+Z \t( 8) -X , Y-X,1/2+Z \t( 9) -Y , -X ,1/2+Z \t', ' (10) X-Y, -Y ,1/2+Z \t(11) X , X-Y,1/2+Z \t(12) Y , X ,1/2+Z \t'] , 4604 "f m 3": [' Space Group: F m 3', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4605 "p n n a": [' Space Group: P n n a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y ,1/2+Z \t', ' ( 3) 1/2+X ,1/2-Y ,1/2+Z \t( 4) 1/2-X , -Y , Z \t'] , 4606 "i -4 3 d": [' Space Group: I -4 3 d', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 3/4+Y ,1/4-X ,3/4-Z \t( 5) 3/4-Z ,3/4+Y ,1/4-X \t( 6) 1/4-X ,3/4-Z ,3/4+Y \t', ' ( 7) -X ,1/2-Y , Z \t( 8) 1/2-Z , X , -Y \t( 9) -Y ,1/2-Z , X \t', ' (10) X , -Y ,1/2-Z \t(11) Z , -X ,1/2-Y \t(12) 1/2-Y , Z , -X \t', ' (13) 1/4-Y ,1/4+X ,3/4-Z \t(14) 3/4-Z ,1/4-Y ,1/4+X \t(15) 1/4+X ,3/4-Z ,1/4-Y \t', ' (16) 3/4+X ,3/4+Z ,3/4+Y \t(17) 3/4+Y ,3/4+X ,3/4+Z \t(18) 3/4+Z ,3/4+Y ,3/4+X \t', ' (19) 1/2+Y ,1/2-Z , -X \t(20) 3/4-Y ,1/4-X ,1/4+Z \t(21) 1/4+Z ,3/4-Y ,1/4-X \t', ' (22) 1/4-X ,1/4+Z ,3/4-Y \t(23) -X ,1/2+Y ,1/2-Z \t(24) 1/2-Z , -X ,1/2+Y \t'] , 4607 "p n n n": [' Space Group: P n n n', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y ,1/2+Z \t', ' ( 3) 1/2+X , -Y ,1/2+Z \t( 4) 1/2-X ,1/2-Y , Z \t'] , 4608 "p n n m": [' Space Group: P n n m', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y ,1/2+Z \t', ' ( 3) 1/2+X ,1/2-Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4609 "p -4": [' Space Group: P -4', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 4', ' The Laue symmetry is 4/m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t'] , 4610 "i -4 3 m": [' Space Group: I -4 3 m', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) Y , -X , -Z \t( 5) -Z , Y , -X \t( 6) -X , -Z , Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) -Y , X , -Z \t(14) -Z , -Y , X \t(15) X , -Z , -Y \t', ' (16) X , Z , Y \t(17) Y , X , Z \t(18) Z , Y , X \t', ' (19) Y , -Z , -X \t(20) -Y , -X , Z \t(21) Z , -Y , -X \t', ' (22) -X , Z , -Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4611 "p 65": [' Space Group: P 65', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,5/6+Z \t( 3) -Y , X-Y,2/3+Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X ,1/3+Z \t( 6) Y , Y-X,1/6+Z \t'] , 4612 "r 3 r": [' Space Group: R 3 r', ' The lattice is noncentrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 3', ' The Laue symmetry is 3R', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t'] , 4613 "p 2/m 1 1": [' Space Group: P 2/m 1 1', ' The lattice is centrosymmetric primitive monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is a', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t'] , 4614 "i 41/a": [' Space Group: I 41/a', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 3/4-Y ,1/4+X ,1/4+Z \t', ' ( 3) 1/2-X , -Y ,1/2+Z \t( 4) 3/4+Y ,3/4-X ,3/4+Z \t'] , 4615 "p 63 c m": [' Space Group: P 63 c m', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t', ' ( 7) Y-X, Y ,1/2+Z \t( 8) -X , Y-X, Z \t( 9) -Y , -X ,1/2+Z \t', ' (10) X-Y, -Y , Z \t(11) X , X-Y,1/2+Z \t(12) Y , X , Z \t'] , 4616 "c 1 2 1": [' Space Group: C 1 2 1', ' The lattice is noncentrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in y', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , -Z \t'] , 4617 "p b c n": [' Space Group: P b c n', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) 1/2-X ,1/2-Y ,1/2+Z \t'] , 4618 "p b c m": [' Space Group: P b c m', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y , Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) -X , -Y ,1/2+Z \t'] , 4619 "a m m 2": [' Space Group: A m m 2', ' The lattice is noncentrosymmetric A-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4620 "i m -3 m": [' Space Group: I m -3 m', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t', ' (13) Y , X , Z \t(14) Z , Y , X \t(15) X , Z , Y \t', ' (16) Y , X , -Z \t(17) -Z , Y , X \t(18) X , -Z , Y \t', ' (19) -Z , Y , -X \t(20) -X , -Z , Y \t(21) X , -Z , -Y \t', ' (22) -Y , X , -Z \t(23) -Z , -Y , X \t(24) Y , -X , -Z \t'] , 4621 "i 4 m m": [' Space Group: I 4 m m', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X , Z \t'] , 4622 "p 61 2 2": [' Space Group: P 61 2 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/6+Z \t( 3) -Y , X-Y,1/3+Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X ,2/3+Z \t( 6) Y , Y-X,5/6+Z \t', ' ( 7) X-Y, -Y , -Z \t( 8) X , X-Y,1/6-Z \t( 9) Y , X ,1/3-Z \t', ' (10) Y-X, Y ,1/2-Z \t(11) -X , Y-X,2/3-Z \t(12) -Y , -X ,5/6-Z \t'] , 4623 "i m m 2": [' Space Group: I m m 2', ' The lattice is noncentrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4624 "p 42/n c m": [' Space Group: P 42/n c m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X ,1/2+Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X ,1/2+Z \t', ' ( 5) 1/2-X , Y ,1/2+Z \t( 6) 1/2-Y ,1/2-X , Z \t', ' ( 7) X ,1/2-Y ,1/2+Z \t( 8) Y , X , Z \t'] , 4625 "p b c a": [' Space Group: P b c a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y , Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4626 "p 4 21 2": [' Space Group: P 4 21 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X , Z \t', ' ( 3) -X , -Y , Z \t( 4) 1/2+Y ,1/2-X , Z \t', ' ( 5) 1/2-X ,1/2+Y , -Z \t( 6) -Y , -X , -Z \t', ' ( 7) 1/2+X ,1/2-Y , -Z \t( 8) Y , X , -Z \t'] , 4627 "p 4/n n c": [' Space Group: P 4/n n c', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y , X , Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) Y ,1/2-X , Z \t', ' ( 5) -X ,1/2+Y ,1/2+Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) 1/2+X , -Y ,1/2+Z \t( 8) 1/2+Y ,1/2+X ,1/2+Z \t'] , 4628 "f m -3 m": [' Space Group: F m -3 m', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 192', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t', ' (13) Y , X , Z \t(14) Z , Y , X \t(15) X , Z , Y \t', ' (16) Y , X , -Z \t(17) -Z , Y , X \t(18) X , -Z , Y \t', ' (19) -Z , Y , -X \t(20) -X , -Z , Y \t(21) X , -Z , -Y \t', ' (22) -Y , X , -Z \t(23) -Z , -Y , X \t(24) Y , -X , -Z \t'] , 4629 "p 4/m m m": [' Space Group: P 4/m m m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X , Z \t'] , 4630 "f m -3 c": [' Space Group: F m -3 c', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 192', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t', ' (13) Y , X ,1/2+Z \t(14) 1/2+Z , Y , X \t(15) X ,1/2+Z , Y \t', ' (16) Y , X ,1/2-Z \t(17) 1/2-Z , Y , X \t(18) X ,1/2-Z , Y \t', ' (19) 1/2-Z , Y , -X \t(20) -X ,1/2-Z , Y \t(21) X ,1/2-Z , -Y \t', ' (22) -Y , X ,1/2-Z \t(23) 1/2-Z , -Y , X \t(24) Y , -X ,1/2-Z \t'] , 4631 "p n -3": [' Space Group: P n -3', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X ,1/2+Y , -Z \t( 5) -Z ,1/2+X ,1/2+Y \t( 6) 1/2+Y , -Z ,1/2+X \t', ' ( 7) 1/2-Z , X ,1/2-Y \t( 8) 1/2-Y ,1/2-Z , X \t( 9) Y ,1/2-Z ,1/2-X \t', ' (10) 1/2-X , Y ,1/2-Z \t(11) 1/2-Z ,1/2-X , Y \t(12) X ,1/2-Y ,1/2-Z \t'] , 4632 "p c c 2": [' Space Group: P c c 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4633 "i 41 3 2": [' Space Group: I 41 3 2', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4-Y ,3/4+X ,1/4+Z \t( 5) 1/4+Z ,1/4-Y ,3/4+X \t( 6) 3/4+X ,1/4+Z ,1/4-Y \t', ' ( 7) 1/2-X , -Y ,1/2+Z \t( 8) -Z ,1/2+X ,1/2-Y \t( 9) 1/2-Y , -Z ,1/2+X \t', ' (10) 1/2+X ,1/2-Y , -Z \t(11) 1/2+Z ,1/2-X , -Y \t(12) -Y ,1/2+Z ,1/2-X \t', ' (13) 1/4+Y ,1/4-X ,3/4+Z \t(14) 3/4+Z ,1/4+Y ,1/4-X \t(15) 1/4-X ,3/4+Z ,1/4+Y \t', ' (16) 3/4-X ,3/4-Z ,3/4-Y \t(17) 3/4-Y ,3/4-X ,3/4-Z \t(18) 3/4-Z ,3/4-Y ,3/4-X \t', ' (19) 1/2+Y ,1/2-Z , -X \t(20) 3/4+Y ,1/4+X ,1/4-Z \t(21) 1/4-Z ,3/4+Y ,1/4+X \t', ' (22) 1/4+X ,1/4-Z ,3/4+Y \t(23) -X ,1/2+Y ,1/2-Z \t(24) 1/2-Z , -X ,1/2+Y \t'] , 4634 "p 42 m c": [' Space Group: P 42 m c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X ,1/2+Z \t'] , 4635 "p 4 c c": [' Space Group: P 4 c c', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X ,1/2+Z \t'] , 4636 "p m -3 m": [' Space Group: P m -3 m', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t', ' (13) Y , X , Z \t(14) Z , Y , X \t(15) X , Z , Y \t', ' (16) Y , X , -Z \t(17) -Z , Y , X \t(18) X , -Z , Y \t', ' (19) -Z , Y , -X \t(20) -X , -Z , Y \t(21) X , -Z , -Y \t', ' (22) -Y , X , -Z \t(23) -Z , -Y , X \t(24) Y , -X , -Z \t'] , 4637 "p 32 1 2": [' Space Group: P 32 1 2', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 31m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,2/3+Z \t( 3) Y-X, -X ,1/3+Z \t', ' ( 4) X , X-Y, -Z \t( 5) Y-X, Y ,2/3-Z \t( 6) -Y , -X ,1/3-Z \t'] , 4638 "p 32 1 1": [' Space Group: P 32 1 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 3', ' The Laue symmetry is 3', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,2/3+Z \t( 3) Y-X, -X ,1/3+Z \t'] , 4639 "r -3 m r": [' Space Group: R -3 m r', ' The lattice is centrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 12', ' The Laue symmetry is 3mR', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) Y , X , Z \t( 5) Z , Y , X \t( 6) X , Z , Y \t'] , 4640 "p 3 c 1": [' Space Group: P 3 c 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3m1', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y ,1/2+Z \t( 5) -Y , -X ,1/2+Z \t( 6) X , X-Y,1/2+Z \t'] , 4641 "p 2 2 21": [' Space Group: P 2 2 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y ,1/2-Z \t( 4) -X , -Y ,1/2+Z \t'] , 4642 "p 63": [' Space Group: P 63', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/2+Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X,1/2+Z \t'] , 4643 "p m 3": [' Space Group: P m 3', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4644 "p 42/m": [' Space Group: P 42/m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t'] , 4645 "p m c 21": [' Space Group: P m c 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y , Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y ,1/2+Z \t'] , 4646 "p 42/n": [' Space Group: P 42/n', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y ,1/2+X ,1/2+Z \t', ' ( 3) 1/2-X ,1/2-Y , Z \t( 4) 1/2+Y , -X ,1/2+Z \t'] , 4647 "a m a 2": [' Space Group: A m a 2', ' The lattice is noncentrosymmetric A-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y , Z \t', ' ( 3) 1/2+X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4648 "p 6/m": [' Space Group: P 6/m', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t'] , 4649 "p -6 c 2": [' Space Group: P -6 c 2', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y-X, -X ,1/2-Z \t( 3) -Y , X-Y, Z \t', ' ( 4) X , Y ,1/2-Z \t( 5) Y-X, -X , Z \t( 6) -Y , X-Y,1/2-Z \t', ' ( 7) Y-X, Y ,1/2+Z \t( 8) X , X-Y, -Z \t( 9) -Y , -X ,1/2+Z \t', ' (10) Y-X, Y , -Z \t(11) X , X-Y,1/2+Z \t(12) -Y , -X , -Z \t'] , 4650 "i -4 c 2": [' Space Group: I -4 c 2', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) Y , X ,1/2-Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) -Y , -X ,1/2-Z \t'] , 4651 "F -1": [' Space Group: F -1', ' The lattice is centrosymmetric F-centered triclinic', ' Multiplicity of a general site is 8', ' The Laue symmetry is -1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t'] , 4652 "p 3 1 m": [' Space Group: P 3 1 m', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 31m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X , Z \t( 5) -X , Y-X, Z \t( 6) X-Y, -Y , Z \t'] , 4653 "c c c 2": [' Space Group: C c c 2', ' The lattice is noncentrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4654 "i m 3": [' Space Group: I m 3', ' The lattice is centrosymmetric I-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , Y , -Z \t( 5) -Z , X , Y \t( 6) Y , -Z , X \t', ' ( 7) -Z , X , -Y \t( 8) -Y , -Z , X \t( 9) Y , -Z , -X \t', ' (10) -X , Y , -Z \t(11) -Z , -X , Y \t(12) X , -Y , -Z \t'] , 4655 "p -4 3 m": [' Space Group: P -4 3 m', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) Y , -X , -Z \t( 5) -Z , Y , -X \t( 6) -X , -Z , Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) -Y , X , -Z \t(14) -Z , -Y , X \t(15) X , -Z , -Y \t', ' (16) X , Z , Y \t(17) Y , X , Z \t(18) Z , Y , X \t', ' (19) Y , -Z , -X \t(20) -Y , -X , Z \t(21) Z , -Y , -X \t', ' (22) -X , Z , -Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4656 "p -4 3 n": [' Space Group: P -4 3 n', ' The lattice is noncentrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+Y ,1/2-X ,1/2-Z \t( 5) 1/2-Z ,1/2+Y ,1/2-X \t( 6) 1/2-X ,1/2-Z ,1/2+Y \t', ' ( 7) -X , -Y , Z \t( 8) -Z , X , -Y \t( 9) -Y , -Z , X \t', ' (10) X , -Y , -Z \t(11) Z , -X , -Y \t(12) -Y , Z , -X \t', ' (13) 1/2-Y ,1/2+X ,1/2-Z \t(14) 1/2-Z ,1/2-Y ,1/2+X \t(15) 1/2+X ,1/2-Z ,1/2-Y \t', ' (16) 1/2+X ,1/2+Z ,1/2+Y \t(17) 1/2+Y ,1/2+X ,1/2+Z \t(18) 1/2+Z ,1/2+Y ,1/2+X \t', ' (19) Y , -Z , -X \t(20) 1/2-Y ,1/2-X ,1/2+Z \t(21) 1/2+Z ,1/2-Y ,1/2-X \t', ' (22) 1/2-X ,1/2+Z ,1/2-Y \t(23) -X , Y , -Z \t(24) -Z , -X , Y \t'] , 4657 "p -3 1 c": [' Space Group: P -3 1 c', ' The lattice is centrosymmetric primitive trigonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 31m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X ,1/2+Z \t( 5) -X , Y-X,1/2+Z \t( 6) X-Y, -Y ,1/2+Z \t'] , 4658 "r 3 m": [' Space Group: R 3 m', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3m1', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y , Z \t( 5) -Y , -X , Z \t( 6) X , X-Y, Z \t'] , 4659 "p 21": [' Space Group: P 21', ' The lattice is noncentrosymmetric primitive monoclinic', ' Multiplicity of a general site is 2', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in y', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y , -Z \t'] , 4660 "r -3": [' Space Group: R -3', ' The lattice is centrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t'] , 4661 "c m": [' Space Group: C m', ' The lattice is noncentrosymmetric C-centered monoclinic', ' Multiplicity of a general site is 4', ' The Laue symmetry is 2/m', ' The unique monoclinic axis is b', ' The location of the origin is arbitrary in x z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , Z \t'] , 4662 "p 32 2 1": [' Space Group: P 32 2 1', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3m1', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,2/3+Z \t( 3) Y-X, -X ,1/3+Z \t', ' ( 4) Y , X , -Z \t( 5) -X , Y-X,2/3-Z \t( 6) X-Y, -Y ,1/3-Z \t'] , 4663 "i 21 21 21": [' Space Group: I 21 21 21', ' The lattice is noncentrosymmetric I-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2+X ,1/2-Y , -Z \t', ' ( 3) -X ,1/2+Y ,1/2-Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4664 "p 42 2 2": [' Space Group: P 42 2 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) -X , Y , -Z \t( 6) -Y , -X ,1/2-Z \t', ' ( 7) X , -Y , -Z \t( 8) Y , X ,1/2-Z \t'] , 4665 "i -4 2 m": [' Space Group: I -4 2 m', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) -X , Y , -Z \t( 6) Y , X , Z \t', ' ( 7) X , -Y , -Z \t( 8) -Y , -X , Z \t'] , 4666 "p 65 1 1": [' Space Group: P 65 1 1', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,5/6+Z \t( 3) -Y , X-Y,2/3+Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X ,1/3+Z \t( 6) Y , Y-X,1/6+Z \t'] , 4667 "p 61": [' Space Group: P 61', ' The lattice is noncentrosymmetric primitive hexagonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 6/m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X ,1/6+Z \t( 3) -Y , X-Y,1/3+Z \t', ' ( 4) -X , -Y ,1/2+Z \t( 5) Y-X, -X ,2/3+Z \t( 6) Y , Y-X,5/6+Z \t'] , 4668 "i 2 3": [' Space Group: I 2 3', ' The lattice is noncentrosymmetric I-centered cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , -Y , -Z \t( 5) -Z , X , -Y \t( 6) -Y , -Z , X \t', ' ( 7) -Z , -X , Y \t( 8) Y , -Z , -X \t( 9) -Y , Z , -X \t', ' (10) -X , -Y , Z \t(11) Z , -X , -Y \t(12) -X , Y , -Z \t'] , 4669 "i -4 2 d": [' Space Group: I -4 2 d', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) 1/2-X , Y ,3/4-Z \t( 6) Y ,1/2+X ,1/4+Z \t', ' ( 7) 1/2+X , -Y ,3/4-Z \t( 8) -Y ,1/2-X ,1/4+Z \t'] , 4670 "p a 3": [' Space Group: P a 3', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 24', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X , Y ,1/2-Z \t( 5) 1/2-Z ,1/2+X , Y \t( 6) Y ,1/2-Z ,1/2+X \t', ' ( 7) -Z ,1/2+X ,1/2-Y \t( 8) 1/2-Y , -Z ,1/2+X \t( 9) 1/2+Y ,1/2-Z , -X \t', ' (10) -X ,1/2+Y ,1/2-Z \t(11) 1/2-Z , -X ,1/2+Y \t(12) 1/2+X ,1/2-Y , -Z \t'] , 4671 "f 2 3": [' Space Group: F 2 3', ' The lattice is noncentrosymmetric F-centered cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) X , -Y , -Z \t( 5) -Z , X , -Y \t( 6) -Y , -Z , X \t', ' ( 7) -Z , -X , Y \t( 8) Y , -Z , -X \t( 9) -Y , Z , -X \t', ' (10) -X , -Y , Z \t(11) Z , -X , -Y \t(12) -X , Y , -Z \t'] , 4672 "i 4 c m": [' Space Group: I 4 c m', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X ,1/2+Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X ,1/2+Z \t'] , 4673 "r 3 c": [' Space Group: R 3 c', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3m1', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y ,1/2+Z \t( 5) -Y , -X ,1/2+Z \t( 6) X , X-Y,1/2+Z \t'] , 4674 "p n m a": [' Space Group: P n m a', ' The lattice is centrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X ,1/2+Y ,1/2+Z \t', ' ( 3) X ,1/2-Y , Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4675 "r 3 c r": [' Space Group: R 3 c r', ' The lattice is noncentrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3mR', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+Y ,1/2+X ,1/2+Z \t( 5) 1/2+Z ,1/2+Y ,1/2+X \t( 6) 1/2+X ,1/2+Z ,1/2+Y \t'] , 4676 "p n c 2": [' Space Group: P n c 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y ,1/2+Z \t', ' ( 3) X ,1/2-Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4677 "c 2 2 21": [' Space Group: C 2 2 21', ' The lattice is noncentrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y ,1/2-Z \t( 4) -X , -Y ,1/2+Z \t'] , 4678 "r 3 m r": [' Space Group: R 3 m r', ' The lattice is noncentrosymmetric primitive rhombohedral', ' Multiplicity of a general site is 6', ' The Laue symmetry is 3mR', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) Y , X , Z \t( 5) Z , Y , X \t( 6) X , Z , Y \t'] , 4679 "p 43 2 2": [' Space Group: P 43 2 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,3/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) Y , -X ,1/4+Z \t', ' ( 5) -X , Y , -Z \t( 6) -Y , -X ,3/4-Z \t', ' ( 7) X , -Y ,1/2-Z \t( 8) Y , X ,1/4-Z \t'] , 4680 "r 3 2": [' Space Group: R 3 2', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 18', ' The Laue symmetry is 3m1', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X , -Z \t( 5) -X , Y-X, -Z \t( 6) X-Y, -Y , -Z \t'] , 4681 "p m a 2": [' Space Group: P m a 2', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y , Z \t', ' ( 3) 1/2+X , -Y , Z \t( 4) -X , -Y , Z \t'] , 4682 "i 4/m m m": [' Space Group: I 4/m m m', ' The lattice is centrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 32', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X , Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X , Z \t', ' ( 5) -X , Y , Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y , Z \t( 8) Y , X , Z \t'] , 4683 "c c c a": [' Space Group: C c c a', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) 1/2-X , -Y , Z \t'] , 4684 "i 41 m d": [' Space Group: I 41 m d', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y ,1/2+X ,1/4+Z \t', ' ( 3) 1/2-X ,1/2-Y ,1/2+Z \t( 4) 1/2+Y , -X ,3/4+Z \t', ' ( 5) -X , Y , Z \t( 6) -Y ,1/2-X ,1/4+Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) 1/2+Y , X ,3/4+Z \t'] , 4685 "c c c m": [' Space Group: C c c m', ' The lattice is centrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 16', ' The Laue symmetry is mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) -X , Y ,1/2+Z \t', ' ( 3) X , -Y ,1/2+Z \t( 4) -X , -Y , Z \t'] , 4686 "p 41 21 2": [' Space Group: P 41 21 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X ,1/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) 1/2+Y ,1/2-X ,3/4+Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/4-Z \t( 6) -Y , -X ,1/2-Z \t', ' ( 7) 1/2+X ,1/2-Y ,3/4-Z \t( 8) Y , X , -Z \t'] , 4687 "p 31": [' Space Group: P 31', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 3', ' The Laue symmetry is 3', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,1/3+Z \t( 3) Y-X, -X ,2/3+Z \t'] , 4688 "p 32": [' Space Group: P 32', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 3', ' The Laue symmetry is 3', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y,2/3+Z \t( 3) Y-X, -X ,1/3+Z \t'] , 4689 "p 42/m n m": [' Space Group: P 42/m n m', ' The lattice is centrosymmetric primitive tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2-Y ,1/2+X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) 1/2+Y ,1/2-X ,1/2+Z \t', ' ( 5) 1/2-X ,1/2+Y ,1/2+Z \t( 6) -Y , -X , Z \t', ' ( 7) 1/2+X ,1/2-Y ,1/2+Z \t( 8) Y , X , Z \t'] , 4690 "p 3 1 2": [' Space Group: P 3 1 2', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 31m', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) X , X-Y, -Z \t( 5) Y-X, Y , -Z \t( 6) -Y , -X , -Z \t'] , 4691 "i 41 2 2": [' Space Group: I 41 2 2', ' The lattice is noncentrosymmetric I-centered tetragonal', ' Multiplicity of a general site is 16', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y ,1/2+X ,1/4+Z \t', ' ( 3) 1/2-X ,1/2-Y ,1/2+Z \t( 4) 1/2+Y , -X ,3/4+Z \t', ' ( 5) 1/2-X , Y ,3/4-Z \t( 6) -Y , -X , -Z \t', ' ( 7) X ,1/2-Y ,1/4-Z \t( 8) 1/2+Y ,1/2+X ,1/2-Z \t'] , 4692 "p -3 m 1": [' Space Group: P -3 m 1', ' The lattice is centrosymmetric primitive trigonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 3m1', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y-X, Y , Z \t( 5) -Y , -X , Z \t( 6) X , X-Y, Z \t'] , 4693 "a b m 2": [' Space Group: A b m 2', ' The lattice is noncentrosymmetric A-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2)+', ' ', ' ( 1) X , Y , Z \t( 2) -X ,1/2+Y , Z \t', ' ( 3) X ,1/2-Y , Z \t( 4) -X , -Y , Z \t'] , 4694 "p n -3 n": [' Space Group: P n -3 n', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X ,1/2+Y , -Z \t( 5) -Z ,1/2+X ,1/2+Y \t( 6) 1/2+Y , -Z ,1/2+X \t', ' ( 7) 1/2-Z , X ,1/2-Y \t( 8) 1/2-Y ,1/2-Z , X \t( 9) Y ,1/2-Z ,1/2-X \t', ' (10) 1/2-X , Y ,1/2-Z \t(11) 1/2-Z ,1/2-X , Y \t(12) X ,1/2-Y ,1/2-Z \t', ' (13) 1/2+Y ,1/2+X ,1/2+Z \t(14) 1/2+Z ,1/2+Y ,1/2+X \t(15) 1/2+X ,1/2+Z ,1/2+Y \t', ' (16) Y , X ,1/2-Z \t(17) 1/2-Z , Y , X \t(18) X ,1/2-Z , Y \t', ' (19) -Z ,1/2+Y , -X \t(20) -X , -Z ,1/2+Y \t(21) 1/2+X , -Z , -Y \t', ' (22) -Y ,1/2+X , -Z \t(23) -Z , -Y ,1/2+X \t(24) 1/2+Y , -X , -Z \t'] , 4695 "r 3": [' Space Group: R 3', ' The lattice is noncentrosymmetric R-centered trigonal', ' Multiplicity of a general site is 9', ' The Laue symmetry is 3', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', '\n (0,0,0; 1/3,2/3,2/3; 2/3,1/3,1/3)+', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t'] , 4696 "c 2 2 2": [' Space Group: C 2 2 2', ' The lattice is noncentrosymmetric C-centered orthorhombic', ' Multiplicity of a general site is 8', ' The Laue symmetry is mmm', '\n The equivalent positions are:', '\n (0,0,0; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) X , -Y , -Z \t', ' ( 3) -X , Y , -Z \t( 4) -X , -Y , Z \t'] , 4697 "p n -3 m": [' Space Group: P n -3 m', ' The lattice is centrosymmetric primitive cubic', ' Multiplicity of a general site is 48', ' The Laue symmetry is m3m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/2+X ,1/2+Y , -Z \t( 5) -Z ,1/2+X ,1/2+Y \t( 6) 1/2+Y , -Z ,1/2+X \t', ' ( 7) 1/2-Z , X ,1/2-Y \t( 8) 1/2-Y ,1/2-Z , X \t( 9) Y ,1/2-Z ,1/2-X \t', ' (10) 1/2-X , Y ,1/2-Z \t(11) 1/2-Z ,1/2-X , Y \t(12) X ,1/2-Y ,1/2-Z \t', ' (13) Y , X , Z \t(14) Z , Y , X \t(15) X , Z , Y \t', ' (16) 1/2+Y ,1/2+X , -Z \t(17) -Z ,1/2+Y ,1/2+X \t(18) 1/2+X , -Z ,1/2+Y \t', ' (19) 1/2-Z , Y ,1/2-X \t(20) 1/2-X ,1/2-Z , Y \t(21) X ,1/2-Z ,1/2-Y \t', ' (22) 1/2-Y , X ,1/2-Z \t(23) 1/2-Z ,1/2-Y , X \t(24) Y ,1/2-X ,1/2-Z \t'] , 4698 "p 42 c m": [' Space Group: P 42 c m', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/2+Z \t', ' ( 3) -X , -Y , Z \t( 4) Y , -X ,1/2+Z \t', ' ( 5) -X , Y ,1/2+Z \t( 6) -Y , -X , Z \t', ' ( 7) X , -Y ,1/2+Z \t( 8) Y , X , Z \t'] , 4699 "p 6/m 1 1": [' Space Group: P 6/m 1 1', ' The lattice is centrosymmetric primitive hexagonal', ' Multiplicity of a general site is 12', ' The Laue symmetry is 6/m', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) X-Y, X , Z \t( 3) -Y , X-Y, Z \t', ' ( 4) -X , -Y , Z \t( 5) Y-X, -X , Z \t( 6) Y , Y-X, Z \t'] , 4700 "p 21 21 21": [' Space Group: P 21 21 21', ' The lattice is noncentrosymmetric primitive orthorhombic', ' Multiplicity of a general site is 4', ' The Laue symmetry is mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) 1/2+X ,1/2-Y , -Z \t', ' ( 3) -X ,1/2+Y ,1/2-Z \t( 4) 1/2-X , -Y ,1/2+Z \t'] , 4701 "f d -3": [' Space Group: F d -3', ' The lattice is centrosymmetric F-centered cubic', ' Multiplicity of a general site is 96', ' The Laue symmetry is m3', ' The inversion center is located at 0,0,0', '\n The equivalent positions are:', '\n (0,0,0; 0,1/2,1/2; 1/2,0,1/2; 1/2,1/2,0)+', ' ', ' ( 1) X , Y , Z \t( 2) Z , X , Y \t( 3) Y , Z , X \t', ' ( 4) 1/4+X ,1/4+Y , -Z \t( 5) -Z ,1/4+X ,1/4+Y \t( 6) 1/4+Y , -Z ,1/4+X \t', ' ( 7) 1/4-Z ,1/2+X ,3/4-Y \t( 8) 3/4-Y ,1/4-Z ,1/2+X \t( 9) 1/2+Y ,1/4-Z ,3/4-X \t', ' (10) 3/4-X ,1/2+Y ,1/4-Z \t(11) 1/4-Z ,3/4-X ,1/2+Y \t(12) 1/2+X ,3/4-Y ,1/4-Z \t'] , 4702 "p -4 b 2": [' Space Group: P -4 b 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) Y , -X , -Z \t', ' ( 3) -X , -Y , Z \t( 4) -Y , X , -Z \t', ' ( 5) 1/2-X ,1/2+Y , Z \t( 6) 1/2+Y ,1/2+X , -Z \t', ' ( 7) 1/2+X ,1/2-Y , Z \t( 8) 1/2-Y ,1/2-X , -Z \t'] , 4703 "p 3 1 c": [' Space Group: P 3 1 c', ' The lattice is noncentrosymmetric primitive trigonal', ' Multiplicity of a general site is 6', ' The Laue symmetry is 31m', ' The location of the origin is arbitrary in z', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X-Y, Z \t( 3) Y-X, -X , Z \t', ' ( 4) Y , X ,1/2+Z \t( 5) -X , Y-X,1/2+Z \t( 6) X-Y, -Y ,1/2+Z \t'] , 4704 "p 41 2 2": [' Space Group: P 41 2 2', ' The lattice is noncentrosymmetric primitive tetragonal', ' Multiplicity of a general site is 8', ' The Laue symmetry is 4/mmm', '\n The equivalent positions are:', ' ', ' ( 1) X , Y , Z \t( 2) -Y , X ,1/4+Z \t', ' ( 3) -X , -Y ,1/2+Z \t( 4) Y , -X ,3/4+Z \t', ' ( 5) -X , Y , -Z \t( 6) -Y , -X ,1/4-Z \t', ' ( 7) X , -Y ,1/2-Z \t( 8) Y , X ,3/4-Z \t'] , 4705 4705 }
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