#------------------------------------------------------------------------------ #$Date: 2016-04-06 16:33:17 +0300 (Wed, 06 Apr 2016) $ #$Revision: 181867 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/97/2019794.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_2019794 _audit_creation_date 14-09-10 _audit_creation_method CRYSTALS _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 9.1478(3) _cell_length_b 6.9826(3) _cell_length_c 17.6799(4) _cod_data_source_file ps50392sup3.hkl _cod_data_source_block 2 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,y,z+1/2 x+1/2,-y,z -x,-y,z+1/2 loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_F_squared_sigma _refln_observed_status 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7.19 o 0.7063E-02 4 5 8 43.92 40.63 7.53 o 0.1041E-01 5 5 8 31.82 44.14 6.38 o 0.1288E-01 6 5 8 41.33 29.06 6.81 o 0.1300E-01 2 0 9 522.62 525.28 13.98 o 0.1175E-02 4 0 9 125.08 134.38 8.45 o 0.4992E-02 1 1 9 251.07 232.51 4.09 o 0.3636E-02 2 1 9 173.48 194.37 3.11 o 0.5154E-02 3 1 9 315.58 316.09 8.17 o 0.2418E-02 4 1 9 198.34 190.11 6.00 o 0.4226E-02 5 1 9 58.92 59.49 4.39 o 0.1358E-01 6 1 9 34.64 34.33 4.20 o 0.1995E-01 1 2 9 333.95 343.80 10.10 o 0.2060E-02 2 2 9 83.16 89.56 3.67 o 0.1002E-01 3 2 9 69.76 70.36 3.52 o 0.1317E-01 4 2 9 39.66 39.58 2.60 o 0.2350E-01 5 2 9 305.99 304.11 7.26 o 0.2595E-02 6 2 9 139.66 136.11 6.33 o 0.5703E-02 7 2 9 99.30 84.27 5.66 o 0.8483E-02 8 2 9 30.89 14.72 7.81 o 0.1267E-01 1 3 9 221.01 212.88 11.20 o 0.2910E-02 2 3 9 296.64 315.71 8.08 o 0.2457E-02 3 3 9 294.51 305.02 8.22 o 0.2467E-02 4 3 9 90.37 86.39 4.58 o 0.9557E-02 5 3 9 64.81 61.09 3.64 o 0.1391E-01 6 3 9 99.09 87.60 4.51 o 0.9170E-02 7 3 9 58.94 68.24 4.15 o 0.1292E-01 8 3 9 23.80 28.86 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