# generated using pymatgen data_Ta4AlC3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.10753899 _cell_length_b 3.10753899 _cell_length_c 24.68199300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00002118 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta4AlC3 _chemical_formula_sum 'Ta8 Al2 C6' _cell_volume 206.41627571 _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 0.66666700 0.33333300 0.34080400 1.0 Ta Ta1 1 0.33333300 0.66666700 0.84080400 1.0 Ta Ta2 1 0.33333300 0.66666700 0.65919600 1.0 Ta Ta3 1 0.66666700 0.33333300 0.15919600 1.0 Ta Ta4 1 0.33333300 0.66666700 0.44536700 1.0 Ta Ta5 1 0.66666700 0.33333300 0.94536700 1.0 Ta Ta6 1 0.66666700 0.33333300 0.55463300 1.0 Ta Ta7 1 0.33333300 0.66666700 0.05463300 1.0 Al Al8 1 0.66666700 0.33333300 0.75000000 1.0 Al Al9 1 0.33333300 0.66666700 0.25000000 1.0 C C10 1 0.00000000 0.00000000 0.38973200 1.0 C C11 1 0.00000000 0.00000000 0.88973200 1.0 C C12 1 0.00000000 0.00000000 0.61026800 1.0 C C13 1 0.00000000 0.00000000 0.00000000 1.0 C C14 1 0.00000000 0.00000000 0.11026800 1.0 C C15 1 0.00000000 0.00000000 0.50000000 1.0