#------------------------------------------------------------------------------ #$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $ #$Revision: 211196 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/23/1522373.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_1522373 loop_ _publ_author_name 'Liang Jingkui' 'Xie Sishen' _publ_section_title ; The structure of Ni Ga4 crystal - a new vacancy controlled gamma-brass phase ; _journal_name_full 'Scientia Sinica, Serie A' _journal_page_first 1305 _journal_page_last 1313 _journal_volume 26 _journal_year 1983 _chemical_formula_sum 'Ga3.76 Ni' _space_group_IT_number 197 _symmetry_space_group_name_Hall 'I 2 2 3' _symmetry_space_group_name_H-M 'I 2 3' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 8.4295 _cell_length_b 8.4295 _cell_length_c 8.4295 _cell_volume 598.971 _citation_journal_id_ASTM SSASEA _cod_data_source_file LiangJingkui_SSASEA_1983_262.cif _cod_data_source_block Ga3.76Ni1 _cod_original_cell_volume 598.9705 _cod_original_formula_sum 'Ga3.76 Ni1' _cod_database_code 1522373 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z x,-y,-z -x,y,-z z,x,y -z,-x,y z,-x,-y -z,x,-y y,z,x y,-z,-x -y,z,-x -y,-z,x x+1/2,y+1/2,z+1/2 -x+1/2,-y+1/2,z+1/2 x+1/2,-y+1/2,-z+1/2 -x+1/2,y+1/2,-z+1/2 z+1/2,x+1/2,y+1/2 -z+1/2,-x+1/2,y+1/2 z+1/2,-x+1/2,-y+1/2 -z+1/2,x+1/2,-y+1/2 y+1/2,z+1/2,x+1/2 y+1/2,-z+1/2,-x+1/2 -y+1/2,z+1/2,-x+1/2 -y+1/2,-z+1/2,x+1/2 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 Ga3 Ga 0.2518 0 0.5 0.94 0.0 Ga1 Ga 0.1688 0.1688 0.1688 0.94 0.0 Ga2 Ga 0.3542 0 0 0.94 0.0 Ni1 Ni 0.3345 0.3345 0.3345 1 0.0