#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/66/2206676.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_2206676_Fobs loop_ _publ_author_name 'Asma, Maliha' 'Kaminsky, Werner' 'Badshah, Amin' _publ_section_title ; trans-Dichloro(2-chloroaniline-\kN)(triphenylphosphine-\kP)palladium(II) dichloromethane solvate ; _journal_coeditor_code CV6568 _journal_issue 9 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1797 _journal_page_last m1798 _journal_volume 61 _journal_year 2005 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 104.619 _cell_angle_beta 89.923 _cell_angle_gamma 112.754 _cell_length_a 10.0120 _cell_length_b 10.3890 _cell_length_c 14.2220 _exptl_crystal_F_000 652.00 _reflns_d_resolution_high 0.7110 _[local]_cod_data_source_file cv6568Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' mal8' _shelx_refln_list_code 4 _shelx_f_calc_maximum 164.39 _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 1 0 0 15025.05 14619.62 400.41 o 2 0 0 929.28 818.07 22.91 o 3 0 0 6139.86 5842.61 155.43 o 4 0 0 479.13 489.94 30.40 o 5 0 0 773.89 681.11 23.70 o 6 0 0 249.20 282.53 25.85 o 7 0 0 191.49 187.41 15.22 o 8 0 0 829.76 893.54 34.89 o 9 0 0 287.97 266.92 26.30 o 10 0 0 65.12 96.99 41.44 o 11 0 0 150.44 124.30 29.49 o 12 0 0 5.91 -9.90 28.52 o -13 1 0 124.81 97.04 42.79 o -12 1 0 180.16 233.59 30.20 o -11 1 0 143.52 117.66 20.76 o -10 1 0 126.33 133.03 18.47 o -9 1 0 342.86 346.95 17.36 o -8 1 0 0.15 17.73 8.83 o -7 1 0 218.40 228.32 12.90 o -6 1 0 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