#------------------------------------------------------------------------------ #$Date: 2012-01-03 14:54:16 +0200 (Tue, 03 Jan 2012) $ #$Revision: 31968 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/23/28/2232820.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_2232820_Fobs loop_ _publ_author_name 'Ogutu, Hezron' 'Meijboom, Reinout' _publ_section_title ; cis-Dichloridobis[diphenyl(4-vinylphenyl)phosphane-\kP]platinum(II) ; _journal_coeditor_code KP2359 _journal_issue 12 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1662 _journal_volume 67 _journal_year 2011 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 100.179 _cell_angle_beta 97.519 _cell_angle_gamma 108.465 _cell_length_a 10.0670 _cell_length_b 12.7080 _cell_length_c 14.4200 _exptl_crystal_F_000 832.00 _reflns_d_resolution_high 0.8436 _[local]_cod_data_source_file kp2359Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' cu_11ho_mse41RE_0m in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 224.10 _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 4055.57 4258.97 155.00 o 3 0 0 28857.08 31083.15 796.92 o 4 0 0 18620.31 19647.85 391.15 o 5 0 0 9257.47 9950.67 241.69 o 6 0 0 1449.57 1666.14 67.71 o 7 0 0 1499.89 1490.23 57.74 o 8 0 0 3586.13 3700.11 95.98 o 9 0 0 1940.76 2071.44 127.38 o 10 0 0 446.22 475.96 43.49 o 11 0 0 224.76 254.89 39.58 o -11 1 0 1014.39 1034.69 46.35 o -10 1 0 1893.85 2036.90 74.89 o -9 1 0 3352.26 3678.76 98.64 o -8 1 0 4823.15 5047.73 100.86 o -7 1 0 3383.38 3520.96 72.58 o -6 1 0 2693.85 2945.59 80.86 o -5 1 0 13206.40 12836.96 263.57 o -4 1 0 22244.75 22789.74 445.03 o -3 1 0 576.51 503.53 35.99 o -2 1 0 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3395.69 138.95 o -2 9 0 860.78 836.04 63.06 o -1 9 0 795.57 718.17 58.25 o 0 9 0 1684.99 1507.80 85.73 o 1 9 0 3724.84 3533.73 92.35 o 2 9 0 3569.39 3546.72 90.12 o 3 9 0 3103.39 3288.96 173.45 o 4 9 0 3724.78 3699.84 159.57 o 5 9 0 1994.90 2024.29 93.86 o 6 9 0 3018.96 3072.10 210.96 o -10 10 0 50.33 87.30 98.21 o -9 10 0 373.04 411.10 59.17 o -8 10 0 719.86 734.52 68.63 o -7 10 0 1561.48 1484.32 125.94 o -6 10 0 1200.40 1004.17 77.87 o -5 10 0 672.82 829.50 77.77 o -4 10 0 2045.16 2100.08 127.09 o -3 10 0 3091.92 3014.72 77.55 o -2 10 0 282.78 314.77 40.37 o -1 10 0 1745.37 1660.65 132.98 o 0 10 0 934.16 964.33 70.22 o 1 10 0 3025.07 3040.48 117.69 o 2 10 0 3648.59 3882.29 292.94 o 3 10 0 1453.01 1719.97 110.22 o 4 10 0 398.15 516.33 61.02 o 5 10 0 521.87 477.88 101.84 o -10 11 0 1340.12 1201.42 104.08 o -9 11 0 2822.57 2830.61 102.65 o -8 11 0 6412.16 6223.88 218.41 o -7 11 0 8360.59 7987.19 230.22 o -6 11 0 3085.97 2950.47 142.53 o -5 11 0 6229.71 6158.44 185.93 o -4 11 0 8249.05 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