#------------------------------------------------------------------------------ #$Date: 2015-07-12 17:24:55 +0300 (Sun, 12 Jul 2015) $ #$Revision: 146781 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/57/1525736.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_1525736 loop_ _publ_author_name 'Capitan, M.J.' 'Louis dit Picard, C.' 'Laurent, Y.' 'Odriozola, J.A.' _publ_section_title ; The crystalline structure of germanium oxynitrides within the Cd Zn Ge O N family ; _journal_name_full 'Materials Science Forum' _journal_page_first 25 _journal_page_last 30 _journal_volume 325 _journal_year 2000 _chemical_formula_sum 'Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13' _chemical_name_systematic '(Cd0.25 Zn1.13 Ge0.62) (O0.76 N1.24)' _space_group_IT_number 186 _symmetry_space_group_name_Hall 'P 6c -2c' _symmetry_space_group_name_H-M 'P 63 m c' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 3.1997 _cell_length_b 3.1997 _cell_length_c 5.1802 _cell_volume 45.930 _citation_journal_id_ASTM MSFOEP _cod_data_source_file Capitan_MSFOEP_2000_364.cif _cod_data_source_block Cd0.25Ge0.62N1.24O0.76Zn1.13 _cod_original_cell_volume 45.92992 _cod_database_code 1525736 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 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 Zn1 Zn+2 0.3333 0.6667 0 0.565 0.0 N1 N-3 0.3333 0.6667 0.399 0.62 0.0 O1 O-2 0.3333 0.6667 0.399 0.38 0.0 Cd1 Cd+2 0.3333 0.6667 0 0.125 0.0 Ge1 Ge+4 0.3333 0.6667 0 0.31 0.0