#------------------------------------------------------------------------------ #$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009154.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_9009154 loop_ _publ_author_name 'Wyckoff R W G' _publ_section_title ; Second edition. Interscience Publishers, New York, New York ; _journal_name_full 'Crystal Structures' _journal_page_first 290 _journal_page_last 295 _journal_volume 1 _journal_year 1963 _chemical_formula_sum 'Fe H O2' _[local]_cod_chemical_formula_sum_orig 'Fe O2 H' _chemical_name_mineral Lepidocrocite _symmetry_space_group_name_H-M 'B b m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 12.4 _cell_length_b 3.87 _cell_length_c 3.06 _cell_volume 146.843 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,y,1/2+z -x,1/2+y,z 1/2-x,1/2+y,1/2+z x,1/2-y,-z 1/2+x,1/2-y,1/2-z x,y,-z 1/2+x,y,1/2-z -x,-y,z 1/2-x,-y,1/2+z x,1/2-y,z 1/2+x,1/2-y,1/2+z -x,1/2+y,-z 1/2-x,1/2+y,1/2-z -x,-y,-z 1/2-x,-y,1/2-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Fe -0.17800 0.25000 0.00000 O 0.21000 0.25000 0.00000 O-H 0.42500 0.25000 0.00000 _cod_database_code 9009154