data_global _amcsd_formula_title 'Ba Co1.2 Cu0.8 O5 Y' loop_ _publ_author_name 'Barbey L' 'Nguyen N' 'Caignaert V' 'Studer F' 'Raveau B' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 112 _journal_year 1994 _journal_page_first 148 _journal_page_last 156 _publ_section_title ; Spin state and variation of the spin orientation of Co(III) in the 112- type phase YBa(Co2-xCux)O5 _cod_database_code 1001608 ; _database_code_amcsd 0013826 _chemical_formula_sum 'Y Ba (Cu.8 Co1.2) O5' _cell_length_a 3.8675 _cell_length_b 3.8675 _cell_length_c 7.5238 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 112.538 _exptl_crystal_density_diffrn 6.312 _symmetry_space_group_name_H-M 'P 4/m m m' loop_ _space_group_symop_operation_xyz 'x,y,z' '-y,-x,z' 'y,x,-z' 'y,-x,-z' '-y,x,z' 'x,-y,z' '-x,y,-z' 'x,y,-z' '-x,-y,z' 'y,x,z' '-y,-x,-z' '-y,x,-z' 'y,-x,z' '-x,y,z' 'x,-y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Y1 0.00000 0.00000 0.50000 1.00000 Ba1 0.00000 0.00000 0.00000 1.00000 Cu1 0.50000 0.50000 0.27200 0.40000 Co1 0.50000 0.50000 0.27200 0.60000 O1 0.50000 0.00000 0.31280 1.00000 O2 0.50000 0.50000 0.00000 1.00000