# generated using pymatgen data_Tm3Ga5Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.79728000 _cell_length_b 6.79728000 _cell_length_c 4.25058964 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000472 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Ga5Ru _chemical_formula_sum 'Tm3 Ga5 Ru1' _cell_volume 170.07877168 _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 Tm Tm0 1 0.58603679 0.00000000 0.00000000 1.0 Tm Tm1 1 0.00000000 0.58603679 0.00000000 1.0 Tm Tm2 1 0.41396321 0.41396321 0.00000000 1.0 Ga Ga3 1 0.23529075 1.00000000 0.50000000 1.0 Ga Ga4 1 1.00000000 0.23529075 0.50000000 1.0 Ga Ga5 1 0.76470925 0.76470925 0.50000000 1.0 Ga Ga6 1 0.33333300 0.66666700 0.50000000 1.0 Ga Ga7 1 0.66666700 0.33333300 0.50000000 1.0 Ru Ru8 1 0.00000000 0.00000000 0.00000000 1.0