#------------------------------------------------------------------------------ #$Date: 2011-09-16 18:46:08 +0300 (Fri, 16 Sep 2011) $ #$Revision: 26025 $ #$URL: file:///home/coder/svn-repositories/cod/hkl/2/2203356.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_2203356_Fobs loop_ _publ_author_name 'Lee, Uk' 'Joo, Hea-Chung' _publ_section_title ; A novel protonated hexatungstoplatinate(IV), Na~5.5~[H~2.5~PtW~6~O~24~]·17H~2~O ; _journal_issue 3 _journal_name_full 'Acta Crystallographica Section E' _journal_page_first i33 _journal_page_last i36 _journal_volume 60 _journal_year 2004 _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 105.500 _cell_angle_beta 105.130 _cell_angle_gamma 97.430 _cell_length_a 10.7360 _cell_length_b 12.8030 _cell_length_c 14.8770 _exptl_crystal_F_000 1967.00 _reflns_d_resolution_high 0.7696 _[local]_cod_data_source_file wm6009Isup2.hkl _[local]_cod_data_source_block I #BEGIN Tags that were not found in dictionaries: _shelx_title ' NA5.5H2.5PTW6 POM' _shelx_refln_list_code 4 _shelx_f_calc_maximum 976.12 _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 185633.56 180391.48 838.99 o 2 0 0 54596.11 56950.90 548.54 o 3 0 0 18832.69 20202.74 420.11 o 4 0 0 5088.48 4580.91 269.92 o 5 0 0 23022.54 23179.25 540.40 o 6 0 0 19005.93 18561.26 531.98 o 7 0 0 47093.35 48085.41 920.26 o 8 0 0 3456.58 4994.04 392.91 o 9 0 0 72.37 37.00 264.62 o 10 0 0 10.69 88.37 277.97 o 11 0 0 3451.92 2931.58 407.62 o 12 0 0 5013.19 5869.25 523.74 o 13 0 0 6671.25 6408.54 605.97 o -13 1 0 34.42 846.76 329.35 o -12 1 0 9229.18 8659.96 589.27 o -11 1 0 1479.64 2435.15 345.01 o -10 1 0 7869.54 7622.61 489.67 o -9 1 0 14669.36 14476.47 582.52 o -8 1 0 46473.96 49780.09 961.32 o -7 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162444.16 164222.72 1598.94 o -4 7 0 3477.51 3641.71 295.23 o -3 7 0 32667.57 33035.49 637.71 o -2 7 0 7583.65 7657.51 329.47 o -1 7 0 18596.34 17407.50 457.46 o 0 7 0 3794.70 3930.11 262.39 o 1 7 0 187343.63 200691.06 1635.40 o 2 7 0 395576.59 443742.34 2716.91 o 3 7 0 21273.75 21375.09 574.32 o 4 7 0 7907.60 8972.21 413.20 o 5 7 0 42.01 -218.88 218.88 o 6 7 0 2243.28 2079.96 294.78 o 7 7 0 2874.10 3055.09 345.80 o 8 7 0 26.19 -11.30 269.75 o 9 7 0 243.78 793.40 279.03 o 10 7 0 1999.19 2346.54 352.26 o -12 8 0 14405.54 15552.74 709.46 o -11 8 0 1976.39 2780.71 356.91 o -10 8 0 6853.95 7214.24 492.36 o -9 8 0 8.29 428.00 278.99 o -8 8 0 7238.61 6455.13 422.02 o -7 8 0 3886.48 3841.51 341.46 o -6 8 0 64077.37 66261.42 1055.74 o -5 8 0 60977.85 62107.18 981.90 o -4 8 0 58.85 400.78 189.60 o -3 8 0 8292.24 8089.08 373.30 o -2 8 0 36623.47 35424.99 676.19 o -1 8 0 7593.69 6178.81 331.29 o 0 8 0 344.60 -77.09 179.88 o 1 8 0 2249.71 3193.41 285.63 o 2 8 0 2394.54 2142.53 249.10 o 3 8 0 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