#------------------------------------------------------------------------------ #$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9007517.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_9007517 loop_ _publ_author_name 'Adiwidjaja G' 'Lohn J' _publ_section_title ; Strukturverfeinerung von enargit, Cu3AsS4 Locality: Butte, Montana, USA ; _journal_name_full 'Acta Crystallographica, Section B' _journal_page_first 1878 _journal_page_last 1879 _journal_volume 26 _journal_year 1970 _chemical_formula_sum 'As Cu3 S4' _[local]_cod_chemical_formula_sum_orig 'Cu3 As S4' _chemical_name_mineral Enargite _symmetry_space_group_name_H-M 'P m n 21' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 7.407 _cell_length_b 6.436 _cell_length_c 6.154 _cell_volume 293.370 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,-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 _atom_site_U_iso_or_equiv Cu1 0.00000 0.15140 0.49830 0.01029 Cu2 0.24660 0.32550 0.98660 0.01179 As 0.00000 0.82680 0.00000 ? S1 0.00000 0.82260 0.64540 ? S2 0.00000 0.14360 0.11660 0.00100 S3 0.25980 0.33640 0.61880 ? _cod_database_code 9007517