#------------------------------------------------------------------------------ #$Date: 2021-09-11 04:56:19 +0300 (Sat, 11 Sep 2021) $ #$Revision: 269097 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/02/24/2022444.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_2022444 _cell_angle_alpha 79.871 _cell_angle_beta 83.011 _cell_angle_gamma 74.410 _cell_length_a 7.5014 _cell_length_b 9.1065 _cell_length_c 11.8534 _exptl_crystal_F_000 556.00 _reflns_d_resolution_high 0.7983 _cod_data_source_file vp30217sup8.hkl _cod_data_source_block 7 _shelx_title ' mo_D8_4093_18Feb20_AJP3_0m_a.res in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 218.99 _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 5.81 11.56 0.78 o 3 0 0 3675.50 3767.14 44.90 o 4 0 0 47955.71 47731.11 1166.57 o 5 0 0 2332.46 2305.33 31.39 o 6 0 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