#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/00/81/1008132.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_1008132 loop_ _publ_author_name 'Bertaut, E F' 'Delapalme, A' 'Forrat, F' 'Pauthenet, R' _publ_section_title ; Etude des uranates de cobalt et de manganese ; _journal_coden_ASTM JPRAAJ _journal_name_full 'Journal de Physique et du Radium' _journal_page_first 477 _journal_page_last 485 _journal_paper_doi 10.1051/jphysrad:01962002308-9047700 _journal_volume 23 _journal_year 1962 _chemical_formula_structural 'Co U O4' _chemical_formula_sum 'Co O4 U' _chemical_name_systematic 'Cobalt uranate' _space_group_IT_number 74 _symmetry_cell_setting orthorhombic _symmetry_Int_Tables_number 74 _symmetry_space_group_name_Hall '-I 2b 2' _symmetry_space_group_name_H-M 'I m m a' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 6.497 _cell_length_b 6.952 _cell_length_c 6.497 _cell_volume 293.5 _refine_ls_R_factor_all 0.078 _cod_database_code 1008132 loop_ _symmetry_equiv_pos_as_xyz x,y,z x,-y,-z x,1/2+y,-z x,1/2-y,z -x,-y,-z -x,y,z -x,1/2-y,z -x,1/2+y,-z 1/2+x,1/2+y,1/2+z 1/2+x,1/2-y,1/2-z 1/2+x,y,1/2-z 1/2+x,-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,-y,1/2+z 1/2-x,y,1/2-z loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Co1 Co2+ 4 b 0. 0. 0.5 1. 0 d U1 U6+ 4 c 0. 0.25 0.025(1) 1. 0 d O1 O2- 8 i 0.296(1) 0.25 0.033(1) 1. 0 d O2 O2- 8 h 0. -0.016(1) 0.201(1) 1. 0 d loop_ _atom_type_symbol _atom_type_oxidation_number Co2+ 2.000 U6+ 6.000 O2- -2.000