#------------------------------------------------------------------------------ #$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009288.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_9009288 loop_ _publ_author_name 'Rodek E' 'Bartl H' 'Sterzel W' 'Platte C' _publ_section_title ; Kristallstrukturuntersuchung an Cs2PtCl4 ; _journal_name_full 'Neues Jahrbuch fur Mineralogie, Monatshefte' _journal_page_first 81 _journal_page_last 85 _journal_volume 1979 _journal_year 1979 _chemical_formula_sum 'Cl4 Cs2 Pt' _[local]_cod_chemical_formula_sum_orig 'Cs2 Pt Cl4' _chemical_name_mineral Cs2PtCl4 _symmetry_space_group_name_H-M 'C m c m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 10.404 _cell_length_b 10.133 _cell_length_c 9.9598 _cell_volume 1049.999 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2+y,z x,-y,1/2+z 1/2+x,1/2-y,1/2+z -x,y,1/2-z 1/2-x,1/2+y,1/2-z -x,y,z 1/2-x,1/2+y,z x,-y,-z 1/2+x,1/2-y,-z x,y,1/2-z 1/2+x,1/2+y,1/2-z -x,-y,1/2+z 1/2-x,1/2-y,1/2+z -x,-y,-z 1/2-x,1/2-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Cs 0.22390 0.25790 0.25000 Pt 0.00000 0.00000 0.00000 Cll 0.22050 0.00000 0.00000 Cl2 0.00000 0.22600 0.97280 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Cs 0.03560 0.04080 0.02660 -0.00350 0.00000 0.00000 Pt 0.02140 0.02130 0.02020 0.00000 0.00000 -0.00020 Cll 0.02530 0.03110 0.04350 0.00000 0.00000 0.00250 Cl2 0.03340 0.02510 0.04190 0.00000 0.00000 0.00070 _cod_database_code 9009288