# generated using pymatgen data_Tm2Pa(GaIr)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.11434332 _cell_length_b 7.29288108 _cell_length_c 3.78008280 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.83369843 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2Pa(GaIr)3 _chemical_formula_sum 'Tm2 Pa1 Ga3 Ir3' _cell_volume 168.40531089 _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 0.59480224 0.59108286 0.50000000 1.0 Tm Tm1 1 0.40519776 0.99628063 0.50000000 1.0 Pa Pa2 1 0.00000000 0.42025564 0.50000000 1.0 Ga Ga3 1 0.00000000 0.76468711 0.00000000 1.0 Ga Ga4 1 0.26228979 0.25126279 0.00000000 1.0 Ga Ga5 1 0.73771021 0.98897200 0.00000000 1.0 Ir Ir6 1 0.31071875 0.64391098 0.00000000 1.0 Ir Ir7 1 0.68928125 0.33319123 0.00000000 1.0 Ir Ir8 1 1.00000000 0.01035677 0.50000000 1.0