#------------------------------------------------------------------------------ #$Date: 2016-04-03 01:16:46 +0300 (Sun, 03 Apr 2016) $ #$Revision: 181025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/21/05/2210506.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_2210506_Fobs loop_ _publ_author_name 'Li, Ming-Xue' 'Ma, Peng-Tao' 'Wang, Jing-Ping' _publ_section_title ; Tris[bis(\m-1,10-phenanthrolin-2-olato)dicopper(I)] monosodium trihydrogen \b-octamolybdate hemihydrate ; _journal_coeditor_code BI2061 _journal_issue 10 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m2661 _journal_page_last m2663 _journal_volume 62 _journal_year 2006 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 84.309 _cell_angle_beta 78.972 _cell_angle_gamma 82.091 _cell_length_a 9.6398 _cell_length_b 13.6514 _cell_length_c 15.9517 _exptl_crystal_F_000 1340.00 _reflns_d_resolution_high 0.8409 _cod_data_source_file bi2061Isup2.hkl _cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' NJY1 in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 732.36 _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' 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 9921.05 8545.07 297.39 o 3 0 0 52999.98 54114.02 1661.79 o 4 0 0 6284.04 5119.19 236.72 o 5 0 0 6020.85 8004.42 346.16 o 6 0 0 5369.57 6460.40 322.96 o 7 0 0 1880.82 1969.88 192.71 o 8 0 0 1816.93 2244.07 212.93 o 9 0 0 7.47 6.86 70.23 o 10 0 0 145.17 52.00 93.31 o 11 0 0 129.98 156.87 149.88 o -11 1 0 18.31 0.00 102.72 o -10 1 0 34.29 172.33 98.70 o -9 1 0 0.34 0.00 63.73 o -8 1 0 728.96 768.98 103.82 o -7 1 0 110.80 93.73 61.86 o -6 1 0 4688.60 4399.71 166.77 o -4 1 0 569.77 638.78 91.00 o -1 1 0 11969.20 10715.39 346.75 o 1 1 0 25103.06 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