# generated using pymatgen data_TaCo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.11863737 _cell_length_b 5.11865106 _cell_length_c 4.11545417 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00007524 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaCo3 _chemical_formula_sum 'Ta2 Co6' _cell_volume 93.38087931 _cell_formula_units_Z 2 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 0.33332769 0.66666434 0.25000000 1.0 Ta Ta1 1 0.66667231 0.33333566 0.75000000 1.0 Co Co2 1 0.84224521 0.15775342 0.25000000 1.0 Co Co3 1 0.84224521 0.68449079 0.25000000 1.0 Co Co4 1 0.31551008 0.15775504 0.25000000 1.0 Co Co5 1 0.15775479 0.84224658 0.75000000 1.0 Co Co6 1 0.15775479 0.31550921 0.75000000 1.0 Co Co7 1 0.68448992 0.84224496 0.75000000 1.0