#------------------------------------------------------------------------------ #$Date: 2011-09-28 17:24:46 +0300 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/20/99/2209956.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_2209956_Fobs loop_ _publ_author_name 'Grigoriev, Mikhail S.' 'Den Auwer, Christophe' 'Meyer, Daniel' 'Moisy, Philippe' _publ_section_title ; Poly[bis(guanidinium) [diaquabis(\m~3~-hydrogencitrato)-\m~2~-oxalato-dineodymium(III)] heptahydrate] ; _journal_coeditor_code NG2034 _journal_issue 8 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first m1725 _journal_page_last m1727 _journal_volume 62 _journal_year 2006 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 87.892 _cell_angle_beta 89.505 _cell_angle_gamma 73.464 _cell_length_a 8.2017 _cell_length_b 10.0447 _cell_length_c 11.0222 _exptl_crystal_F_000 514.00 _reflns_d_resolution_high 0.8409 _[local]_cod_data_source_file ng2034Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' ncg in P-1' _shelx_refln_list_code 4 _shelx_f_calc_maximum 158.73 _shelx_f_squared_multiplier 1.000 #END Tags that were not found in dictionaries loop_ _symmetry_equiv_pos_as_xyz 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1854.65 74.86 o 1 8 0 5612.42 5610.42 121.26 o 2 8 0 10284.65 10254.39 361.15 o 3 8 0 2665.34 2882.67 191.09 o 4 8 0 877.16 779.94 85.39 o 5 8 0 3358.94 3566.47 245.72 o 6 8 0 2948.10 2981.77 102.18 o 7 8 0 1109.19 1071.40 62.30 o 8 8 0 2.70 55.65 37.81 o -4 9 0 956.01 825.26 108.42 o -3 9 0 142.86 124.87 41.30 o -2 9 0 681.89 748.36 55.12 o -1 9 0 1529.24 1520.15 79.70 o 0 9 0 3367.39 3584.74 113.82 o 1 9 0 639.36 695.63 153.00 o 2 9 0 203.26 153.61 53.18 o 3 9 0 262.67 189.16 68.31 o 4 9 0 2279.76 2309.39 207.83 o 5 9 0 2191.48 2309.29 146.20 o 6 9 0 591.51 590.23 124.74 o 7 9 0 25.32 36.88 22.01 o 8 9 0 470.03 241.53 133.11 o -2 10 0 1742.19 1632.23 98.84 o -1 10 0 1593.77 1700.71 85.18 o 0 10 0 704.56 681.20 41.90 o 1 10 0 292.55 328.48 77.78 o 2 10 0 1070.65 1077.60 105.36 o 3 10 0 1749.38 1742.84 148.81 o 4 10 0 1136.32 1089.35 102.70 o 5 10 0 8.89 -47.18 120.14 o 6 10 0 469.23 497.11 88.06 o 7 10 0 1516.48 1686.12 232.32 o -1 11 0 40.08 89.16 80.37 o 0 11 0 179.12 226.46 97.95 o 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