# generated using pymatgen data_Hf5Ga3S _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.04850828 _cell_length_b 8.04850568 _cell_length_c 5.87410167 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99966674 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Ga3S _chemical_formula_sum 'Hf10 Ga6 S2' _cell_volume 329.53701151 _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 Hf Hf0 1 0.66666686 0.33333343 0.99999989 1.0 Hf Hf1 1 0.33333314 0.66666657 0.00000011 1.0 Hf Hf2 1 0.33333314 0.66666657 0.49999989 1.0 Hf Hf3 1 0.66666686 0.33333343 0.50000011 1.0 Hf Hf4 1 0.74207144 0.74207156 0.75000000 1.0 Hf Hf5 1 0.25792902 0.00000020 0.75000000 1.0 Hf Hf6 1 0.00000040 0.25792898 0.75000000 1.0 Hf Hf7 1 0.25792856 0.25792844 0.25000000 1.0 Hf Hf8 1 0.74207098 0.99999980 0.25000000 1.0 Hf Hf9 1 0.99999960 0.74207102 0.25000000 1.0 Ga Ga10 1 0.39627109 0.39627113 0.75000000 1.0 Ga Ga11 1 0.60372843 0.99999974 0.75000000 1.0 Ga Ga12 1 0.99999977 0.60372842 0.75000000 1.0 Ga Ga13 1 0.60372891 0.60372887 0.25000000 1.0 Ga Ga14 1 0.39627157 0.00000026 0.25000000 1.0 Ga Ga15 1 0.00000023 0.39627158 0.25000000 1.0 S S16 1 0.00000000 0.00000000 0.00000000 1.0 S S17 1 0.00000000 0.00000000 0.50000000 1.0