# generated using pymatgen data_CoBi2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 17.21882400 _cell_length_b 7.78139800 _cell_length_c 10.29588780 _cell_angle_alpha 68.58357687 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CoBi2O7 _chemical_formula_sum 'Co8 Bi16 O56' _cell_volume 1284.25666588 _cell_formula_units_Z 8 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Co Co0 1 0.68425100 0.36481000 0.07629300 1.0 Co Co1 1 0.18425100 0.63519000 0.42370700 1.0 Co Co2 1 0.31574900 0.63519000 0.92370700 1.0 Co Co3 1 0.81574900 0.36481000 0.57629300 1.0 Co Co4 1 0.75531900 0.02009700 0.24500400 1.0 Co Co5 1 0.25531900 0.97990300 0.25499600 1.0 Co Co6 1 0.24468100 0.97990300 0.75499600 1.0 Co Co7 1 0.74468100 0.02009700 0.74500400 1.0 Bi Bi8 1 0.84779800 0.20230200 0.91991600 1.0 Bi Bi9 1 0.00109100 0.49668100 0.73386700 1.0 Bi Bi10 1 0.49890900 0.49668100 0.23386700 1.0 Bi Bi11 1 0.99890900 0.50331900 0.26613300 1.0 Bi Bi12 1 0.70376300 0.54211900 0.74806800 1.0 Bi Bi13 1 0.20376300 0.45788100 0.75193200 1.0 Bi Bi14 1 0.29623700 0.45788100 0.25193200 1.0 Bi Bi15 1 0.79623700 0.54211900 0.24806800 1.0 Bi Bi16 1 0.50109100 0.50331900 0.76613300 1.0 Bi Bi17 1 0.14016900 0.15483600 0.42890600 1.0 Bi Bi18 1 0.64016900 0.84516400 0.07109400 1.0 Bi Bi19 1 0.85983100 0.84516400 0.57109400 1.0 Bi Bi20 1 0.34779800 0.79769800 0.58008400 1.0 Bi Bi21 1 0.65220200 0.20230200 0.41991600 1.0 Bi Bi22 1 0.15220200 0.79769800 0.08008400 1.0 Bi Bi23 1 0.35983100 0.15483600 0.92890600 1.0 O O24 1 0.95884300 0.29872000 0.93548000 1.0 O O25 1 0.45884300 0.70128000 0.56452000 1.0 O O26 1 0.04115700 0.70128000 0.06452000 1.0 O O27 1 0.54115700 0.29872000 0.43548000 1.0 O O28 1 0.81060800 0.95865100 0.88773000 1.0 O O29 1 0.31060800 0.04134900 0.61227000 1.0 O O30 1 0.18939200 0.04134900 0.11227000 1.0 O O31 1 0.68939200 0.95865100 0.38773000 1.0 O O32 1 0.84033000 0.03024500 0.13312000 1.0 O O33 1 0.34033000 0.96975500 0.36688000 1.0 O O34 1 0.15967000 0.96975500 0.86688000 1.0 O O35 1 0.65967000 0.03024500 0.63312000 1.0 O O36 1 0.29184000 0.40372900 0.91914800 1.0 O O37 1 0.79184000 0.59627100 0.58085200 1.0 O O38 1 0.70816000 0.59627100 0.08085200 1.0 O O39 1 0.20816000 0.40372900 0.41914800 1.0 O O40 1 0.34762000 0.03607200 0.14823800 1.0 O O41 1 0.84762000 0.96392800 0.35176200 1.0 O O42 1 0.65238000 0.96392800 0.85176200 1.0 O O43 1 0.15238000 0.03607200 0.64823800 1.0 O O44 1 0.31478800 0.88689000 0.90285700 1.0 O O45 1 0.39481500 0.66654200 0.80254800 1.0 O O46 1 0.81478800 0.11311000 0.59714300 1.0 O O47 1 0.18521200 0.88689000 0.40285700 1.0 O O48 1 0.43538000 0.27146700 0.74622200 1.0 O O49 1 0.93538000 0.72853300 0.75377800 1.0 O O50 1 0.56462000 0.72853300 0.25377800 1.0 O O51 1 0.06462000 0.27146700 0.24622200 1.0 O O52 1 0.47227800 0.26165600 0.96457500 1.0 O O53 1 0.97227800 0.73834400 0.53542500 1.0 O O54 1 0.52772200 0.73834400 0.03542500 1.0 O O55 1 0.02772200 0.26165600 0.46457500 1.0 O O56 1 0.89564900 0.55736400 0.12998500 1.0 O O57 1 0.39564900 0.44263600 0.37001500 1.0 O O58 1 0.10435100 0.44263600 0.87001500 1.0 O O59 1 0.60435100 0.55736400 0.62998500 1.0 O O60 1 0.75035000 0.27069200 0.23563100 1.0 O O61 1 0.25035000 0.72930800 0.26436900 1.0 O O62 1 0.24965000 0.72930800 0.76436900 1.0 O O63 1 0.74965000 0.27069200 0.73563100 1.0 O O64 1 0.72907800 0.41103500 0.44367300 1.0 O O65 1 0.22907800 0.58896500 0.05632700 1.0 O O66 1 0.27092200 0.58896500 0.55632700 1.0 O O67 1 0.77092200 0.41103500 0.94367300 1.0 O O68 1 0.73261700 0.78604200 0.23951500 1.0 O O69 1 0.23261700 0.21395800 0.26048500 1.0 O O70 1 0.26738300 0.21395800 0.76048500 1.0 O O71 1 0.76738300 0.78604200 0.73951500 1.0 O O72 1 0.87838700 0.46715800 0.41447500 1.0 O O73 1 0.37838700 0.53284200 0.08552500 1.0 O O74 1 0.12161300 0.53284200 0.58552500 1.0 O O75 1 0.62161300 0.46715800 0.91447500 1.0 O O76 1 0.10518500 0.66654200 0.30254800 1.0 O O77 1 0.60518500 0.33345800 0.19745200 1.0 O O78 1 0.89481500 0.33345800 0.69745200 1.0 O O79 1 0.68521200 0.11311000 0.09714300 1.0