data_global _chemical_name_mineral 'Bowieite' loop_ _publ_author_name 'Parthe E' 'Hohnke D' 'Hulliger F' _journal_name_full 'Acta Crystallographica' _journal_volume 23 _journal_year 1967 _journal_page_first 832 _journal_page_last 840 _publ_section_title ; A new structure type with octahedron pairs for Rh2S3,Rh2Se3 and Ir2S3 ; _database_code_amcsd 0009315 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Rh2 S3' _cell_length_a 8.462 _cell_length_b 5.985 _cell_length_c 6.138 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 310.859 _exptl_crystal_density_diffrn 6.453 _symmetry_space_group_name_H-M 'P b c n' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,-y,1/2+z' '-x,y,1/2-z' '1/2-x,1/2+y,z' '1/2+x,1/2-y,-z' '1/2+x,1/2+y,1/2-z' '1/2-x,1/2-y,1/2+z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Rh 0.10645 0.25170 0.03380 0.00236 S1 0.15180 0.39060 0.39300 0.00214 S2 0.00000 0.95250 0.25000 0.00189