#------------------------------------------------------------------------------ #$Date: 2020-08-15 08:01:07 +0300 (Sat, 15 Aug 2020) $ #$Revision: 255343 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/24/35/2243545.hkl $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2243545 _cell_angle_alpha 90.000 _cell_angle_beta 91.266 _cell_angle_gamma 90.000 _cell_length_a 9.3068 _cell_length_b 22.4747 _cell_length_c 13.5131 _exptl_crystal_F_000 1332.00 _reflns_d_resolution_high 0.7282 _cod_data_source_file zl27822-Dysup10.hkl _cod_data_source_block 2-Dy _shelx_title ' ctp36 in P2(1)/c' _shelx_refln_list_code 4 _shelx_f_calc_maximum 368.81 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, y+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_calc _refln_F_squared_meas _refln_F_squared_sigma _refln_observed_status 1 0 0 102166.27 112075.88 3372.12 o 2 0 0 13744.11 13330.66 242.54 o 3 0 0 3102.99 2672.87 101.71 o 4 0 0 7250.44 6650.05 187.06 o 5 0 0 1596.67 1601.98 67.72 o 6 0 0 874.83 598.05 52.80 o 7 0 0 15843.34 15443.08 334.13 o 8 0 0 6102.03 5777.96 190.91 o 9 0 0 17772.84 16825.80 381.37 o 10 0 0 19395.07 19713.31 445.97 o 11 0 0 6126.49 6444.05 224.49 o 12 0 0 2064.19 2459.96 195.52 o 1 1 0 3949.34 4115.43 56.69 o 2 1 0 13.91 12.83 7.84 o 3 1 0 74.57 60.14 10.36 o 4 1 0 4061.10 4056.73 72.30 o 5 1 0 980.48 909.27 33.51 o 6 1 0 7962.40 8238.91 139.96 o 7 1 0 1765.72 1642.12 58.17 o 8 1 0 595.47 594.28 44.18 o 9 1 0 90.73 42.99 29.16 o 10 1 0 16.59 -28.20 28.20 o 11 1 0 304.34 217.66 44.87 o 12 1 0 97.60 18.05 52.68 o 0 2 0 105311.41 119830.99 3021.45 o 1 2 0 57375.81 61253.21 649.42 o 2 2 0 3137.46 2746.71 49.43 o 3 2 0 4748.35 4089.00 63.71 o 4 2 0 9103.35 8721.45 121.02 o 5 2 0 654.76 729.65 31.46 o 6 2 0 1171.36 1088.24 45.35 o 7 2 0 5148.49 4727.38 101.80 o 8 2 0 8608.07 8244.62 154.65 o 9 2 0 12845.00 12447.62 216.13 o 10 2 0 11364.07 11556.54 213.09 o 11 2 0 5573.83 5955.41 150.05 o 12 2 0 2122.60 2445.39 134.59 o 1 3 0 6984.16 7753.05 120.35 o 2 3 0 22714.11 24130.38 263.92 o 3 3 0 17983.88 18332.46 207.82 o 4 3 0 20925.73 20696.75 255.75 o 5 3 0 10726.13 10484.96 146.89 o 6 3 0 12679.39 12498.57 193.46 o 7 3 0 4935.34 4641.29 105.15 o 8 3 0 2477.32 2396.73 76.40 o 9 3 0 24.03 11.20 26.79 o 10 3 0 1163.40 1245.32 82.87 o 11 3 0 362.38 336.67 48.74 o 12 3 0 1268.22 1073.66 98.99 o 0 4 0 199.84 270.57 36.67 o 1 4 0 46385.71 52646.08 626.02 o 2 4 0 14920.57 15008.23 170.58 o 3 4 0 5861.72 5504.03 79.01 o 4 4 0 233.77 144.49 12.71 o 5 4 0 268.85 323.72 23.05 o 6 4 0 1212.01 1235.75 49.97 o 7 4 0 3531.11 3241.52 93.93 o 8 4 0 5994.88 5642.61 121.81 o 9 4 0 4618.61 4575.10 130.69 o 10 4 0 3291.37 3325.48 124.10 o 11 4 0 4843.83 4869.49 167.56 o 12 4 0 2774.62 2999.54 175.86 o 1 5 0 415.88 407.24 20.00 o 2 5 0 1221.63 1169.20 28.27 o 3 5 0 8903.47 8750.97 158.79 o 4 5 0 17811.22 16667.41 197.17 o 5 5 0 30049.26 29472.81 335.37 o 6 5 0 18679.18 17793.48 236.99 o 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