#------------------------------------------------------------------------------ #$Date: 2010-10-08 09:13:40 +0300 (Fri, 08 Oct 2010) $ #$Revision: 1452 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2017708.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_2017708_Fobs loop_ _publ_author_name 'Meng, Gao-Xiang' 'Yang, He-Lin' 'Cheng, Cui-Xia' 'Huang, Xin-Tang' _publ_section_title ; Two-dimensional networks in 2-methylanilinium picrate and 2,5-dichloroanilinium picrate ; _journal_coeditor_code GD3342 _journal_issue 7 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first o337 _journal_page_last o340 _journal_volume 66 _journal_year 2010 _space_group_IT_number 9 _symmetry_space_group_name_Hall 'C -2yc' _symmetry_space_group_name_H-M 'C 1 c 1' _cell_angle_alpha 90.000 _cell_angle_beta 94.606 _cell_angle_gamma 90.000 _cell_length_a 4.3288 _cell_length_b 23.3722 _cell_length_c 15.2922 _exptl_crystal_F_000 792.00 _reflns_d_resolution_high 0.8107 _[local]_cod_data_source_file gd3342IIsup3.hkl _[local]_cod_data_source_block II #BEGIN Tags that were not found in dictionaries: _shelx_title ' II in Cc' _shelx_refln_list_code 4 _shelx_f_calc_maximum 285.77 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' 'x, -y, z+1/2' 'x+1/2, y+1/2, z' 'x+1/2, -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 0 0 -18 57.26 105.60 60.07 o -1 1 -18 104.60 118.85 44.93 o 1 1 -18 3.10 0.00 34.00 o 0 2 -18 92.82 86.15 41.53 o -1 3 -18 383.76 475.41 64.01 o 1 3 -18 253.30 257.14 50.34 o 0 4 -18 148.11 161.23 45.68 o 1 5 -18 1.16 11.47 55.11 o 0 6 -18 752.41 824.96 95.50 o 1 7 -18 1220.59 1361.81 127.85 o 0 8 -18 769.62 823.72 113.30 o -1 1 -17 1487.83 1459.01 87.04 o 1 1 -17 1397.20 1246.42 75.20 o 0 2 -17 18.15 44.29 34.14 o 2 2 -17 1476.55 1452.68 116.21 o -1 3 -17 720.16 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