# generated using pymatgen data_TaCo2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.78638883 _cell_length_b 4.78639778 _cell_length_c 7.75973698 _cell_angle_alpha 90.00022330 _cell_angle_beta 90.00000001 _cell_angle_gamma 119.99998000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaCo2 _chemical_formula_sum 'Ta4 Co8' _cell_volume 153.95524332 _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 Ta Ta0 1 0.33334084 0.66668069 0.05806612 1.0 Ta Ta1 1 0.66666057 0.33332214 0.94192154 1.0 Ta Ta2 1 0.33334004 0.66667909 0.44187268 1.0 Ta Ta3 1 0.66665946 0.33331992 0.55808400 1.0 Co Co4 1 0.82976923 0.17022289 0.24992216 1.0 Co Co5 1 0.34045266 0.17022289 0.24992216 1.0 Co Co6 1 0.17024211 0.82976708 0.75009063 1.0 Co Co7 1 0.17024637 0.34049174 0.75009143 1.0 Co Co8 1 0.82976587 0.65953375 0.24992222 1.0 Co Co9 1 0.99999814 0.99999629 0.99998972 1.0 Co Co10 1 0.65952597 0.82976708 0.75009063 1.0 Co Co11 1 0.99999873 0.99999746 0.50002672 1.0