#------------------------------------------------------------------------------ #$Date: 2013-03-29 12:50:04 +0200 (Fri, 29 Mar 2013) $ #$Revision: 77877 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/74/9007443.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9007443 loop_ _publ_author_name 'Jellinek, F.' _publ_section_title ; The structures of the chromium sulphides ; _journal_name_full 'Acta Crystallographica' _journal_page_first 620 _journal_page_last 628 _journal_volume 10 _journal_year 1957 _chemical_formula_structural CrS _chemical_formula_sum 'Cr S' _space_group_IT_number 15 _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 101.6 _cell_angle_gamma 90 _cell_length_a 3.826 _cell_length_b 5.913 _cell_length_c 6.089 _cell_volume 134.939 _exptl_crystal_density_diffrn 4.138 _cod_database_code 9007443 _amcsd_database_code AMCSD#0009139 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 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Cr 0.00000 0.00000 0.00000 S 0.00000 0.32000 0.25000