#------------------------------------------------------------------------------ #$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176428 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/01/1530156.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1530156 loop_ _publ_author_name 'Khodashova, T.S.' 'Porai-Koshits, M.A.' 'Vetrova, I.V.' _publ_section_title ; Structure of a rhodium(III) complex with unusual fluorotin ligands, Cs4 (Rh (Sn F2 (H2 O)2)2 (Sn4 F15)) (H2 O)4 ; _journal_name_full ; Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) ; _journal_page_first 754 _journal_page_last 761 _journal_volume 5 _journal_year 1979 _chemical_formula_sum 'Cs4 F19 H16 O8 Rh Sn6' _chemical_name_systematic 'Cs4 (Rh (Sn F2 (H2 O)2)2 (Sn4 F15)) (H2 O)4' _space_group_IT_number 15 _symmetry_space_group_name_Hall '-B 2b' _symmetry_space_group_name_H-M 'B 1 1 2/b' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 107.9 _cell_formula_units_Z 4 _cell_length_a 19.267 _cell_length_b 17.513 _cell_length_c 9.284 _cell_volume 2980.998 _citation_journal_id_ASTM KOKHDC _cod_data_source_file Khodashova_KOKHDC_1979_541.cif _cod_data_source_block H16Cs4F19O8Rh1Sn6 _cod_original_sg_symbol_Hall '-C 2yc (-x,z,y)' _cod_chemical_formula_sum_orig 'H16 Cs4 F19 O8 Rh1 Sn6' _cod_database_code 1530156 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y+1/2,z -x,-y,-z x,y-1/2,-z x+1/2,y,z+1/2 -x+1/2,-y+1/2,z+1/2 -x+1/2,-y,-z+1/2 x+1/2,y-1/2,-z+1/2 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv F2 F-1 0.1887 0.2398 0.5126 1 0.0 F10 F-1 0.1778 0.4382 0.3728 1 0.0 Sn3 Sn+2 0.0777 0.39537 0.3027 1 0.0 F5 F-1 0.1392 0.2654 -0.0764 1 0.0 O2 O-2 0.1137 0.3171 0.6628 1 0.0 O3 O-2 0.2366 0.1065 0.1696 1 0.0 Cs1 Cs+1 0.20186 0.14053 0.81905 1 0.0 F8 F-1 0.0506 0.4556 0.4663 1 0.0 Sn2 Sn+2 0.08267 0.23626 0.10289 1 0.0 Rh1 Rh+3 0 0.25 0.31389 1 0.0 F3 F-1 0 0.25 -0.0444 1 0.0 Cs2 Cs+1 0.4388 0.04341 0.33913 1 0.0 F9 F-1 0.0773 0.4862 0.1842 1 0.0 O1 O-2 0.101 0.0997 0.4254 1 0.0 F4 F-1 0.0605 0.1232 0.0414 1 0.0 F7 F-1 0.1338 0.3687 0.1146 1 0.0 O4 O-2 0.2342 0.0718 0.4609 1 0.0 F1 F-1 0.0595 0.1551 0.6761 1 0.0 Sn1 Sn+2 0.08368 0.21458 0.49715 1 0.0 F6 F-1 0.1736 0.2279 0.1914 1 0.0