# generated using pymatgen data_Ti3(Co10B3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.42152266 _cell_length_b 7.42152266 _cell_length_c 7.42152266 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3(Co10B3)2 _chemical_formula_sum 'Ti3 Co20 B6' _cell_volume 289.04406457 _cell_formula_units_Z 1 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 Ti Ti0 1 0.00000000 0.00000000 0.00000000 1.0 Ti Ti1 1 0.25000000 0.25000000 0.25000000 1.0 Ti Ti2 1 0.75000000 0.75000000 0.75000000 1.0 Co Co3 1 0.85206600 0.38264500 0.38264500 1.0 Co Co4 1 0.38264500 0.85206600 0.38264500 1.0 Co Co5 1 0.38264500 0.38264500 0.85206600 1.0 Co Co6 1 0.38264500 0.38264500 0.38264500 1.0 Co Co7 1 0.14793400 0.61735500 0.61735500 1.0 Co Co8 1 0.61735500 0.14793400 0.61735500 1.0 Co Co9 1 0.61735500 0.61735500 0.14793400 1.0 Co Co10 1 0.61735500 0.61735500 0.61735500 1.0 Co Co11 1 0.65819000 0.00000000 0.00000000 1.0 Co Co12 1 0.65819000 0.00000000 0.34181000 1.0 Co Co13 1 0.65819000 0.34181000 0.00000000 1.0 Co Co14 1 0.00000000 0.65819000 0.34181000 1.0 Co Co15 1 0.00000000 0.65819000 0.00000000 1.0 Co Co16 1 0.34181000 0.65819000 0.00000000 1.0 Co Co17 1 0.00000000 0.34181000 0.65819000 1.0 Co Co18 1 0.34181000 0.00000000 0.65819000 1.0 Co Co19 1 0.00000000 0.00000000 0.65819000 1.0 Co Co20 1 0.34181000 0.00000000 0.00000000 1.0 Co Co21 1 0.00000000 0.34181000 0.00000000 1.0 Co Co22 1 0.00000000 0.00000000 0.34181000 1.0 B B23 1 0.72832800 0.27167200 0.27167200 1.0 B B24 1 0.72832800 0.27167200 0.72832800 1.0 B B25 1 0.72832800 0.72832800 0.27167200 1.0 B B26 1 0.27167200 0.72832800 0.72832800 1.0 B B27 1 0.27167200 0.72832800 0.27167200 1.0 B B28 1 0.27167200 0.27167200 0.72832800 1.0