#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/63/2206371.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_2206371_Fobs loop_ _publ_author_name 'Yuan, Yu-Zhou' 'Zhou, Jian' 'Li, Dong-Qing' 'Liu, Xing' 'Chen, Zhen-Feng' 'Yu, Kai-Bei' _publ_section_title ; The two-dimensional network polymer of (ethanol)(\m~3~-N-salicyclideneglycinato)nickel(II) ; _journal_issue 8 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1444 _journal_page_last m1446 _journal_volume 61 _journal_year 2005 _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90.000 _cell_angle_beta 109.090 _cell_angle_gamma 90.000 _cell_length_a 11.6560 _cell_length_b 7.3260 _cell_length_c 14.0120 _exptl_crystal_F_000 584.00 _reflns_d_resolution_high 0.8255 _[local]_cod_data_source_file cf6439Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' C:\XSCANS\Y1983 in P2(1)/c' _shelx_refln_list_code 4 _shelx_f_calc_maximum 189.10 _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+1/2, -z+1/2' '-x, -y, -z' 'x, -y-1/2, z-1/2' 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 35760.01 32844.11 387.52 o 2 0 0 7165.03 7385.24 44.64 o 3 0 0 5655.14 6161.93 49.76 o 4 0 0 5623.49 5996.56 57.02 o 5 0 0 560.21 539.42 20.66 o 6 0 0 285.27 228.51 17.01 o 7 0 0 1035.14 1070.53 34.73 o 8 0 0 235.13 200.74 21.21 o 9 0 0 516.82 491.39 31.34 o 10 0 0 26.08 11.80 18.22 o 11 0 0 117.06 134.13 23.02 o 12 0 0 308.05 343.78 33.60 o 13 0 0 303.95 290.00 36.46 o 1 1 0 300.71 319.78 8.32 o 2 1 0 8509.48 8898.47 50.09 o 3 1 0 1406.11 1360.60 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