| Line | |
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| 1 | #/* |
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| 2 | # van Langevelde, A., Peschar, R. & Schenk, H. (2001). Acta Cryst. B57, 372-377 |
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| 3 | # _cell_length_a 12.0053(7) |
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| 4 | # _cell_length_b 51.902(2) |
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| 5 | # _cell_length_c 5.4450(3) |
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| 6 | # _cell_angle_alpha 73.752(5) |
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| 7 | # _cell_angle_beta 100.256(6) |
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| 8 | # _cell_angle_gamma 117.691(5) |
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| 9 | # _cell_volume 2879.6(3) |
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| 10 | # |
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| 11 | #P-1 0 2882.611 34.83 0.0028 5.4461 12.0112 44.8178 87.655 90.854 100.246 === 19 23 33 11 17 20 |
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| 12 | #*/ |
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| 13 | # |
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| 14 | #index_lam .650515 |
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| 15 | #index_zero_error |
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| 16 | #/* |
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| 17 | #try_space_groups 2 |
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| 18 | #*/ |
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| 19 | #Bravais_Cubic_sgs |
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| 20 | #Bravais_Trigonal_Hexagonal_sgs |
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| 21 | #Bravais_Tetragonal_sgs |
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| 22 | #Bravais_Orthorhombic_sgs |
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| 23 | #Bravais_Monoclinic_sgs |
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| 24 | #Bravais_Triclinic_sgs |
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| 25 | # |
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| 26 | #'Index_x0_from_d(22.34175, 2) |
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| 27 | # |
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| 28 | #load index_d index_I { |
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| 29 | 4.121799 637.9198 |
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| 30 | 4.228878 1064.344 |
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| 31 | 4.25249 323.641 |
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| 32 | 4.318998 208.1025 |
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| 33 | 4.337445 401.1985 |
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| 34 | 4.366647 404.7261 |
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| 35 | 4.390572 268.8189 |
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| 36 | 4.479994 3060.441 |
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| 37 | 4.55473 15327.89 |
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| 38 | 4.581423 13899.51 |
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| 39 | 4.704245 46.24569 |
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| 40 | 4.791354 290.1386 |
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| 41 | 4.818118 848.084 |
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| 42 | 4.843434 491.0786 |
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| 43 | 4.907142 68.71451 |
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| 44 | 4.982293 135.6902 |
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| 45 | 5.030066 662.6854 |
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| 46 | 5.053859 223.0072 |
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| 47 | 5.07659 310.0317 |
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| 48 | 5.131312 607.6667 |
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| 49 | 5.200391 1736.694 |
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| 50 | 5.217864 1074.933 |
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| 51 | 5.240796 572.5371 |
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| 52 | 5.316574 1315.162 |
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| 53 | 5.355795 1519.181 |
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| 54 | 5.417448 65.6584 |
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| 55 | 5.53077 35.15236 |
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| 56 | 5.59437 331.9515 |
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| 57 | 5.651844 26.98467 |
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| 58 | 5.716024 52.30497 |
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| 59 | 7.268071 30.73424 |
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| 60 | 7.458782 352.4417 |
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| 61 | 7.964829 59.16835 |
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| 62 | 8.280228 37.6522 |
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| 63 | 8.949042 339.9407 |
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| 64 | 10.61297 109.5668 |
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| 65 | 11.52145 38.93581 |
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| 66 | 11.80009 48.09089 |
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| 67 | 14.91353 4867.617 |
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| 68 | 22.34175 1329.933 |
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| 69 | #} |
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| 70 | |
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