# generated using pymatgen data_TmPa(ZnIr)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.86609910 _cell_length_b 6.97691348 _cell_length_c 8.29489648 _cell_angle_alpha 91.01089257 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmPa(ZnIr)2 _chemical_formula_sum 'Tm2 Pa2 Zn4 Ir4' _cell_volume 223.70706004 _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 Tm Tm0 1 0.75000000 0.94329406 0.68297559 1.0 Tm Tm1 1 0.25000000 0.05670594 0.31702441 1.0 Pa Pa2 1 0.25000000 0.55176832 0.18998675 1.0 Pa Pa3 1 0.75000000 0.44823168 0.81001325 1.0 Zn Zn4 1 0.25000000 0.63155835 0.55854386 1.0 Zn Zn5 1 0.75000000 0.36844165 0.44145614 1.0 Zn Zn6 1 0.75000000 0.88571977 0.06059604 1.0 Zn Zn7 1 0.25000000 0.11428023 0.93940396 1.0 Ir Ir8 1 0.25000000 0.72466768 0.87688765 1.0 Ir Ir9 1 0.75000000 0.27533232 0.12311235 1.0 Ir Ir10 1 0.75000000 0.75232406 0.36013187 1.0 Ir Ir11 1 0.25000000 0.24767594 0.63986813 1.0