#------------------------------------------------------------------------------ #$Date: 2021-01-07 08:04:47 +0200 (Thu, 07 Jan 2021) $ #$Revision: 260728 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/23/2022307.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_2022307 _cell_angle_alpha 83.432 _cell_angle_beta 86.303 _cell_angle_gamma 83.762 _cell_length_a 11.9501 _cell_length_b 12.4427 _cell_length_c 13.0597 _exptl_crystal_F_000 976.00 _reflns_d_resolution_high 0.8401 _cod_data_source_file ky3202CuL3sup2.hkl _cod_data_source_block CuL3 _shelx_title ' a in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 286.25 _shelx_f_squared_multiplier 1.000 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' 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 2 0 0 42.45 102.06 22.91 o 3 0 0 129.65 103.38 23.81 o 4 0 0 10071.43 10619.35 328.07 o 5 0 0 13947.92 15701.80 406.24 o 6 0 0 5124.73 4917.14 144.65 o 7 0 0 409.01 404.77 37.15 o 8 0 0 3346.66 3198.54 104.58 o 9 0 0 11856.93 12126.99 338.29 o 10 0 0 3875.20 3842.52 153.37 o 11 0 0 13.60 -37.43 37.43 o 12 0 0 121.76 82.29 33.73 o 13 0 0 493.46 696.92 106.09 o 14 0 0 1393.95 1324.25 131.18 o -13 1 0 46.45 0.84 30.64 o -12 1 0 746.97 912.42 88.65 o -11 1 0 4626.85 4513.73 128.90 o -10 1 0 1544.29 1695.23 74.20 o -9 1 0 27.03 23.64 33.78 o -8 1 0 192.70 212.29 43.73 o -7 1 0 5748.53 5820.98 142.21 o -6 1 0 19269.10 20845.94 637.85 o -5 1 0 26329.72 26813.92 803.48 o -4 1 0 11119.42 12211.79 592.59 o -3 1 0 1562.07 1503.17 89.57 o -2 1 0 184.40 208.29 41.31 o 2 1 0 12148.43 12473.26 219.95 o 3 1 0 22999.18 26648.18 815.64 o 4 1 0 35211.59 42088.20 1191.63 o 5 1 0 2438.75 2286.35 56.42 o 6 1 0 30.71 56.58 19.34 o 7 1 0 301.29 302.77 31.09 o 8 1 0 4809.76 5081.98 142.21 o 9 1 0 4863.93 4779.61 150.96 o 10 1 0 3772.40 3849.81 203.14 o 11 1 0 244.40 302.44 50.67 o 12 1 0 605.00 542.51 100.75 o 13 1 0 1049.93 1076.50 147.61 o 14 1 0 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