#------------------------------------------------------------------------------ #$Date: 2008-03-10 10:25:41 +0200 (Mon, 10 Mar 2008) $ #$Revision: 255 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9001235.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_9001235 loop_ _publ_author_name 'Post J E' 'Bish D L' _publ_section_title ; Rietveld refinement of the coronadite structure sample from Morocco ; _journal_name_full 'American Mineralogist' _journal_page_first 913 _journal_page_last 917 _journal_volume 74 _journal_year 1989 _chemical_formula_sum 'Mn2 Pb.268 O4' _chemical_name_mineral Coronadite _symmetry_space_group_name_H-M 'I 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 90.39 _cell_angle_gamma 90 _cell_length_a 9.938 _cell_length_b 2.8678 _cell_length_c 9.834 _cell_volume 280.264 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2+y,1/2+z x,-y,z 1/2+x,1/2-y,1/2+z -x,y,-z 1/2-x,1/2+y,1/2-z -x,-y,-z 1/2-x,1/2-y,1/2-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mn1 0.85200 0.00000 0.33300 1.00000 Mn2 0.33300 0.00000 0.15600 1.00000 Pb 0.00000 0.21400 0.00000 0.26800 O1 0.63700 0.00000 0.29400 1.00000 O2 0.65700 0.00000 0.05100 1.00000 O3 0.28400 0.00000 0.32700 1.00000 O4 0.03400 0.00000 0.32900 1.00000