# generated using pymatgen data_TaCo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.69910002 _cell_length_b 4.69910002 _cell_length_c 7.66576800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000031 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaCo3 _chemical_formula_sum 'Ta3 Co9' _cell_volume 146.59382615 _cell_formula_units_Z 3 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 Ta Ta0 1 0.00000000 0.00000000 0.45312900 1.0 Ta Ta1 1 0.00000000 0.00000000 0.06999800 1.0 Ta Ta2 1 0.33333300 0.66666700 0.90606000 1.0 Co Co3 1 0.66666700 0.33333300 0.50091000 1.0 Co Co4 1 0.66666700 0.33333300 0.00498400 1.0 Co Co5 1 0.83510800 0.67021600 0.75022400 1.0 Co Co6 1 0.83510800 0.16489200 0.75022400 1.0 Co Co7 1 0.32978400 0.16489200 0.75022400 1.0 Co Co8 1 0.49570900 0.99141700 0.25172000 1.0 Co Co9 1 0.49570900 0.50429100 0.25172000 1.0 Co Co10 1 0.00858300 0.50429100 0.25172000 1.0 Co Co11 1 0.33333300 0.66666700 0.55918200 1.0