# generated using pymatgen data_Ta3C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.44817752 _cell_length_b 5.44817752 _cell_length_c 4.70315600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999419 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3C _chemical_formula_sum 'Ta6 C2' _cell_volume 120.89895344 _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 0.16738400 0.33476700 0.25000000 1.0 Ta Ta1 1 0.66523300 0.83261600 0.25000000 1.0 Ta Ta2 1 0.16738400 0.83261600 0.25000000 1.0 Ta Ta3 1 0.83261600 0.66523300 0.75000000 1.0 Ta Ta4 1 0.33476700 0.16738400 0.75000000 1.0 Ta Ta5 1 0.83261600 0.16738400 0.75000000 1.0 C C6 1 0.33333300 0.66666700 0.75000000 1.0 C C7 1 0.66666700 0.33333300 0.25000000 1.0