# generated using pymatgen data_Co3BO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.99255400 _cell_length_b 9.36787400 _cell_length_c 12.04375200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3BO5 _chemical_formula_sum 'Co12 B4 O20' _cell_volume 337.63296355 _cell_formula_units_Z 4 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 0.50000000 0.75762000 0.38772800 1.0 Co Co1 1 0.50000000 0.24238000 0.61227200 1.0 Co Co2 1 0.50000000 0.25762000 0.11227200 1.0 Co Co3 1 0.50000000 0.74238000 0.88772800 1.0 Co Co4 1 0.00000000 0.00359600 0.22294900 1.0 Co Co5 1 0.00000000 0.99640400 0.77705100 1.0 Co Co6 1 0.00000000 0.50359600 0.27705100 1.0 Co Co7 1 0.00000000 0.49640400 0.72294900 1.0 Co Co8 1 0.00000000 0.00000000 0.50000000 1.0 Co Co9 1 0.00000000 0.50000000 0.00000000 1.0 Co Co10 1 0.50000000 0.50000000 0.50000000 1.0 Co Co11 1 0.50000000 0.00000000 0.00000000 1.0 B B12 1 0.50000000 0.73558000 0.13889800 1.0 B B13 1 0.50000000 0.26442000 0.86110200 1.0 B B14 1 0.50000000 0.23558000 0.36110200 1.0 B B15 1 0.50000000 0.76442000 0.63889800 1.0 O O16 1 0.50000000 0.88167600 0.14111200 1.0 O O17 1 0.50000000 0.11832400 0.85888800 1.0 O O18 1 0.50000000 0.38167600 0.35888800 1.0 O O19 1 0.50000000 0.61832400 0.64111200 1.0 O O20 1 0.50000000 0.84228900 0.53976600 1.0 O O21 1 0.50000000 0.15771100 0.46023400 1.0 O O22 1 0.50000000 0.34228900 0.96023400 1.0 O O23 1 0.50000000 0.65771100 0.03976600 1.0 O O24 1 0.50000000 0.66127400 0.23895600 1.0 O O25 1 0.50000000 0.33872600 0.76104400 1.0 O O26 1 0.50000000 0.16127400 0.26104400 1.0 O O27 1 0.50000000 0.83872600 0.73895600 1.0 O O28 1 0.00000000 0.62446300 0.41998600 1.0 O O29 1 0.00000000 0.37553700 0.58001400 1.0 O O30 1 0.00000000 0.12446300 0.08001400 1.0 O O31 1 0.00000000 0.87553700 0.91998600 1.0 O O32 1 0.00000000 0.88402900 0.35734000 1.0 O O33 1 0.00000000 0.11597100 0.64266000 1.0 O O34 1 0.00000000 0.38402900 0.14266000 1.0 O O35 1 0.00000000 0.61597100 0.85734000 1.0