#------------------------------------------------------------------------------ #$Date: 2016-01-09 14:29:34 +0200 (Sat, 09 Jan 2016) $ #$Revision: 174073 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/54/20/1542099.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_1542099 loop_ _publ_author_name 'Voronova, A.A.' 'Vainshtein, B.K.' _publ_section_title ; An electron-diffraction study of the crystal structure of Pb C O3 Pb O (H2 O)2 ; _journal_name_full Kristallografiya _journal_page_first 197 _journal_page_last 203 _journal_volume 9 _journal_year 1964 _chemical_formula_sum 'C H4 O6 Pb2' _chemical_name_systematic 'Pb2 O (C O3) (H2 O)2' _space_group_IT_number 160 _symmetry_space_group_name_Hall 'R 3 -2"' _symmetry_space_group_name_H-M 'R 3 m :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 3 _cell_length_a 5.23 _cell_length_b 5.23 _cell_length_c 23.81999 _cell_volume 564.255 _citation_journal_id_ASTM KRISAJ _cod_data_source_file Voronova_KRISAJ_1964_1677.cif _cod_data_source_block C1H4O6Pb2 _cod_original_cell_volume 564.2552 _cod_chemical_formula_sum_orig 'C1 H4 O6 Pb2' _cod_database_code 1542099 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z -y,-x,z x,x-y,z -x+y,y,z x+2/3,y+1/3,z+1/3 -y+2/3,x-y+1/3,z+1/3 -x+y+2/3,-x+1/3,z+1/3 -y+2/3,-x+1/3,z+1/3 x+2/3,x-y+1/3,z+1/3 -x+y+2/3,y+1/3,z+1/3 x+1/3,y+2/3,z+2/3 -y+1/3,x-y+2/3,z+2/3 -x+y+1/3,-x+2/3,z+2/3 -y+1/3,-x+2/3,z+2/3 x+1/3,x-y+2/3,z+2/3 -x+y+1/3,y+2/3,z+2/3 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 O4 O-2 0 0 -0.6 1 0.0 O3 O-2 0 0 -0.928 1 0.0 C1 C+4 0 0 -0.434 1 0.0 O1 O-2 0.15 -0.15 -0.434 1 0.0 Pb1 Pb+2 0 0 -0.216 1 0.0 O2 O-2 0 0 -0.307 1 0.0 Pb2 Pb+2 0 0 0.215 1 0.0