#------------------------------------------------------------------------------ #$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009213.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_9009213 _chemical_name 'HgBr2' loop_ _publ_author_name 'Wyckoff R W G' _journal_name_full "Crystal Structures" _journal_volume 1 _journal_year 1963 _journal_page_first 307 _journal_page_last 308 _publ_section_title ; Second edition. Interscience Publishers, New York, New York ; _chemical_formula_sum 'Hg Br2' _cell_length_a 4.624 _cell_length_b 12.445 _cell_length_c 6.798 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 391.196 _symmetry_space_group_name_H-M 'P b n m' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'x,y,1/2-z' '-x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' '1/2-x,1/2+y,1/2-z' '1/2-x,1/2+y,z' '1/2+x,1/2-y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Hg 0.00000 0.00000 0.33400 Br1 0.00000 0.13200 0.05600 Br2 0.00000 0.36800 0.38900