#------------------------------------------------------------------------------ #$Date: 2016-04-02 22:24:05 +0300 (Sat, 02 Apr 2016) $ #$Revision: 180860 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/01/91/2019151.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_2019151_Fobs loop_ _publ_author_name 'Fujisawa, Kiyoshi' 'Noguchi, Naoto' 'Noguchi, Yuki' 'Lehnert, Nicolai' _publ_section_title ; [Bis(3,5-diisopropylpyrazol-1-yl-\kN^2^)dihydroborato](triphenylphosphane-\kP)copper(I) ; _journal_coeditor_code YP3032 _journal_issue 9 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 943 _journal_page_last 946 _journal_volume 69 _journal_year 2013 _space_group_IT_number 9 _symmetry_space_group_name_Hall 'C -2yc' _symmetry_space_group_name_H-M 'C 1 c 1' _audit_creation_date 2013-04-18 _audit_creation_method 'by CrystalStructure 4.0' _audit_update_record ? _cell_angle_alpha 90.0000 _cell_angle_beta 97.6540(8) _cell_angle_gamma 90.0000 _cell_formula_units_Z 4 _cell_length_a 13.3372(5) _cell_length_b 14.3257(5) _cell_length_c 18.4712(10) _cell_volume 3497.8(3) _exptl_crystal_F_000 1360.00 _reflns_d_resolution_high 0.7700 _cod_data_source_file yp3032Isup2.hkl _cod_data_source_block I loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 +X,+Y,+Z 2 +X,-Y,1/2+Z 3 1/2+X,1/2+Y,+Z 4 1/2+X,1/2-Y,1/2+Z loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_sigma _refln_F_squared_calc _refln_observed_status 1 1 -23 604.20 48.30 504.45 o 3 1 -23 221.44 36.80 225.00 o 5 1 -23 159.80 33.22 165.38 o 7 1 -23 509.97 44.51 589.52 o -2 2 -23 39.93 17.25 64.48 o 0 2 -23 363.80 38.73 344.84 o 2 2 -23 1240.28 66.47 1111.56 o 4 2 -23 237.27 35.70 154.50 o 6 2 -23 825.32 55.94 759.00 o -1 3 -23 195.33 35.98 255.68 o 1 3 -23 610.97 49.60 579.85 o 3 3 -23 200.03 37.59 211.12 o 5 3 -23 749.91 53.65 720.39 o 0 4 -23 365.63 39.63 312.23 o 4 4 -23 103.28 28.04 102.21 o 1 5 -23 154.18 30.93 184.96 o 3 5 -23 392.49 44.61 382.98 o -4 0 -22 1075.17 60.51 847.39 o 0 0 -22 750.40 51.37 738.75 o 2 0 -22 1742.21 83.51 1570.54 o 4 0 -22 54.98 18.73 51.55 o 6 0 -22 1255.47 69.41 1166.91 o 8 0 -22 1124.09 71.49 1139.74 o -3 1 -22 47.75 15.60 76.21 o -1 1 -22 42.03 21.30 21.07 o 1 1 -22 1364.18 71.47 1171.69 o 3 1 -22 174.39 30.92 146.17 o 5 1 -22 982.47 58.60 929.03 o 7 1 -22 496.04 42.97 495.95 o -4 2 -22 176.68 34.53 198.25 o -2 2 -22 43.91 22.05 37.45 o 0 2 -22 636.47 47.16 659.98 o 2 2 -22 236.07 37.99 282.24 o 6 2 -22 142.12 28.12 206.21 o 8 2 -22 52.83 19.54 60.53 o -3 3 -22 69.67 20.74 59.75 o -1 3 -22 183.01 31.83 208.51 o 1 3 -22 171.24 31.34 174.50 o 3 3 -22 754.66 55.13 694.85 o 5 3 -22 152.78 29.75 137.83 o 7 3 -22 66.61 19.79 109.41 o -2 4 -22 293.11 39.37 302.76 o 0 4 -22 273.71 34.88 332.70 o 2 4 -22 1074.39 59.12 978.44 o 4 4 -22 494.84 50.75 490.18 o 6 4 -22 916.05 57.12 803.16 o -1 5 -22 220.91 31.96 175.03 o 1 5 -22 1280.36 68.60 1179.92 o 3 5 -22 131.85 29.76 140.66 o 5 5 -22 336.87 40.01 359.86 o 7 5 -22 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41.34 199.09 o 2 10 -20 302.18 40.70 324.72 o 4 10 -20 314.45 41.73 349.32 o -7 1 -19 222.77 30.67 217.27 o -5 1 -19 829.62 51.61 865.54 o -3 1 -19 285.90 32.82 299.98 o -1 1 -19 933.12 54.37 936.36 o 1 1 -19 271.34 33.94 258.89 o 3 1 -19 172.18 30.09 145.93 o 5 1 -19 362.66 36.06 421.48 o 7 1 -19 282.58 33.73 276.89 o 9 1 -19 402.25 40.37 423.12 o 11 1 -19 330.76 34.98 380.25 o -8 2 -19 628.96 48.38 589.52 o -6 2 -19 1173.27 62.40 1112.22 o -4 2 -19 1321.93 65.36 1338.83 o -2 2 -19 398.30 36.95 427.25 o 0 2 -19 1885.39 81.69 1824.14 o 2 2 -19 801.64 50.56 780.64 o 4 2 -19 980.97 54.06 1087.02 o 6 2 -19 719.16 50.13 647.19 o 8 2 -19 1590.36 74.55 1489.96 o 10 2 -19 515.11 42.02 496.40 o 12 2 -19 685.45 49.26 650.25 o -7 3 -19 1226.02 66.71 1224.30 o -5 3 -19 1239.44 63.50 1175.80 o -3 3 -19 68.97 22.97 71.40 o -1 3 -19 1341.99 69.14 1298.88 o 1 3 -19 1820.09 78.23 1624.09 o 3 3 -19 468.37 39.29 518.93 o 5 3 -19 994.87 54.07 1002.36 o 7 3 -19 1223.09 62.04 1177.18 o 9 3 -19 211.94 29.82 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