data_2239996 _cell_angle_alpha 81.441 _cell_angle_beta 83.428 _cell_angle_gamma 86.977 _cell_length_a 8.9416 _cell_length_b 11.0128 _cell_length_c 18.4635 _exptl_crystal_F_000 1084.00 _reflns_d_resolution_high 0.8266 _[local]_cod_data_source_file wm5049Isup2.hkl _[local]_cod_data_source_block I _shelx_title ' ' _shelx_refln_list_code 4 _shelx_f_calc_maximum 297.58 _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 1 0 0 423.68 360.06 11.88 o 2 0 0 39127.85 42094.78 369.30 o 3 0 0 187.76 113.52 15.07 o 4 0 0 44359.11 45386.76 420.04 o 5 0 0 586.53 514.85 26.04 o 6 0 0 36513.96 35682.20 363.19 o 7 0 0 988.50 952.29 49.18 o 8 0 0 14867.57 15335.47 274.15 o 9 0 0 133.53 136.17 36.92 o 10 0 0 2172.03 2143.32 107.17 o -10 1 0 1890.36 1981.32 123.92 o -9 1 0 4438.70 4632.91 145.06 o -8 1 0 2194.52 2377.50 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