#------------------------------------------------------------------------------ #$Date: 2015-10-14 19:25:47 +0300 (Wed, 14 Oct 2015) $ #$Revision: 168960 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/98/1539879.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_1539879 loop_ _publ_author_name 'Czybulka, A.' 'Schuster, H.U.' 'Pinger, B.' _publ_section_title ; Neue Erdalkali-Gallium-Silicide, -Germanide und -Stannide mit vom Al B2-Typ abgeleiteten Strukturen ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 151 _journal_page_last 157 _journal_volume 579 _journal_year 1989 _chemical_formula_sum 'Ga Sn Sr' _chemical_name_systematic 'Sr Ga Sn' _space_group_IT_number 194 _symmetry_space_group_name_Hall '-P 6c 2c' _symmetry_space_group_name_H-M 'P 63/m m c' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 4 _cell_length_a 4.552 _cell_length_b 4.552 _cell_length_c 18.664 _cell_volume 334.919 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Czybulka_ZAACAB_1989_1270.cif _cod_data_source_block Ga1Sn1Sr1 _cod_original_cell_volume 334.9191 _cod_chemical_formula_sum_orig 'Ga1 Sn1 Sr1' _cod_database_code 1539879 loop_ _symmetry_equiv_pos_as_xyz x,y,z x-y,x,z+1/2 -y,x-y,z -x,-y,z+1/2 -x+y,-x,z y,-x+y,z+1/2 -y,-x,-z+1/2 x-y,-y,-z x,x-y,-z+1/2 y,x,-z -x+y,y,-z+1/2 -x,-x+y,-z -x,-y,-z -x+y,-x,-z-1/2 y,-x+y,-z x,y,-z-1/2 x-y,x,-z -y,x-y,-z-1/2 y,x,z-1/2 -x+y,y,z -x,-x+y,z-1/2 -y,-x,z x-y,-y,z-1/2 x,x-y,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 Ga1 Ga 0.3333 0.6667 0.1617 1 0.0 Sr1 Sr 0 0 0 1 0.0 Sn1 Sn 0.3333 0.6667 0.6162 1 0.0 Sr2 Sr 0 0 0.25 1 0.0