#------------------------------------------------------------------------------ #$Date: 2013-03-10 17:00:37 +0200 (Sun, 10 Mar 2013) $ #$Revision: 75609 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/72/2237234.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_2237234_Fobs loop_ _publ_author_name 'Shrestha, Sumi' 'Bhadbhade, Mohan' 'Gimbert-Suri\~nach, Carolina' 'Colbran, Stephen B.' _publ_section_title ; A dimer of bis(N-heterocyclic carbene)rhodium(I) centres spanned by a dibenzo-18-crown-6 bridge from synchrotron radiation ; _journal_coeditor_code TK5170 _journal_issue 1 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m47 _journal_page_last m48 _journal_volume 69 _journal_year 2013 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 104.686 _cell_angle_beta 90.204 _cell_angle_gamma 109.581 _cell_length_a 10.5100 _cell_length_b 15.6300 _cell_length_c 23.2800 _exptl_crystal_F_000 1574.00 _reflns_d_resolution_high 0.8409 _[local]_cod_data_source_file tk5170Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' Sumi2a in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 275.19 _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 3 0 0 5692.16 4597.74 85.62 o 4 0 0 2128.27 3372.21 63.95 o 5 0 0 483.97 865.30 20.22 o 6 0 0 324.55 310.48 14.03 o 7 0 0 2514.94 2488.43 49.01 o 8 0 0 293.68 247.78 14.34 o 9 0 0 44.53 36.55 13.44 o 10 0 0 3018.78 2900.92 62.66 o 11 0 0 148.89 208.80 20.75 o -11 1 0 567.63 591.15 27.20 o -10 1 0 313.33 333.71 19.19 o -9 1 0 836.44 883.32 23.39 o -8 1 0 159.14 188.82 15.04 o -7 1 0 10213.83 10072.72 185.89 o -6 1 0 710.33 1065.35 27.69 o -5 1 0 4550.61 3840.79 72.77 o -4 1 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