# generated using pymatgen data_PmThGa4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.23136428 _cell_length_b 4.23136499 _cell_length_c 8.52330905 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000202 _symmetry_Int_Tables_number 1 _chemical_formula_structural PmThGa4 _chemical_formula_sum 'Pm1 Th1 Ga4' _cell_volume 132.15991864 _cell_formula_units_Z 1 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 Pm Pm0 1 0.00000000 0.00000000 0.00000000 1.0 Th Th1 1 0.00000000 0.00000000 0.49999900 1.0 Ga Ga2 1 0.66666700 0.33333400 0.24812196 1.0 Ga Ga3 1 0.33333400 0.66666700 0.24812196 1.0 Ga Ga4 1 0.66666700 0.33333400 0.75187804 1.0 Ga Ga5 1 0.33333400 0.66666700 0.75187804 1.0