# generated using pymatgen data_TmPa3(GeIr)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.30502911 _cell_length_b 6.89726495 _cell_length_c 7.62846634 _cell_angle_alpha 89.54419943 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmPa3(GeIr)4 _chemical_formula_sum 'Tm1 Pa3 Ge4 Ir4' _cell_volume 226.50432211 _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 0.75000000 0.00717080 0.20142437 1.0 Pa Pa1 1 0.25000000 0.49426060 0.70170468 1.0 Pa Pa2 1 0.25000000 0.99526302 0.80026107 1.0 Pa Pa3 1 0.75000000 0.50768467 0.29726645 1.0 Ge Ge4 1 0.25000000 0.82579688 0.40863528 1.0 Ge Ge5 1 0.25000000 0.31139987 0.08769954 1.0 Ge Ge6 1 0.75000000 0.17584092 0.58085718 1.0 Ge Ge7 1 0.75000000 0.68319058 0.91955381 1.0 Ir Ir8 1 0.25000000 0.23100531 0.41835099 1.0 Ir Ir9 1 0.25000000 0.71697472 0.08744982 1.0 Ir Ir10 1 0.75000000 0.77366045 0.58911768 1.0 Ir Ir11 1 0.75000000 0.27775116 0.90767913 1.0