#------------------------------------------------------------------------------ #$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $ #$Revision: 211196 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/10/65/2106580.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # 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_2106580 loop_ _publ_author_name 'Philippe, M.J.' 'Roques, B.' 'Malaman, B.' 'Protas, J.' 'Courtois, A.' _publ_section_title ; Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4 ; _journal_name_full 'Acta Crystallographica B (24,1968-38,1982)' _journal_page_first 477 _journal_page_last 482 _journal_volume 31 _journal_year 1975 _chemical_formula_sum 'Cr3 Ga4' _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 106 _cell_angle_gamma 90 _cell_formula_units_Z 6 _cell_length_a 10.135 _cell_length_b 7.845 _cell_length_c 7.986 _cell_volume 610.362 _citation_journal_id_ASTM ACBCAR _cod_data_source_file Philippe_ACBCAR_1975_1910.cif _cod_data_source_block Cr3Ga4 _cod_original_cell_volume 610.3622 _cod_database_code 2106580 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z -x,-y,-z x,-y,z x+1/2,y+1/2,z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,-y+1/2,z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Ga2 Ga 0.0475 0 0.3529 1 0.0 Cr1 Cr 0 0 0 1 0.0 Cr2 Cr 0.5018 0 0.3246 1 0.0 Cr3 Cr 0.2295 0 0.6531 1 0.0 Ga3 Ga 0.6042 0.2097 0.1526 1 0.0 Ga4 Ga 0.3487 0.1917 0.4447 1 0.0 Cr4 Cr 0.1408 0.1924 -0.1493 1 0.0 Ga1 Ga 0.2803 0 0.0895 1 0.0