# generated using pymatgen data_Tm2P7Ir7Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.53192479 _cell_length_b 9.54206622 _cell_length_c 3.85247444 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.29913917 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2P7Ir7Ru5 _chemical_formula_sum 'Tm2 P7 Ir7 Ru5' _cell_volume 302.53555227 _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 0.00016357 0.00105486 0.00000000 1.0 Tm Tm1 1 0.66856109 0.33105213 0.50000000 1.0 P P2 1 0.45278521 0.37905427 0.00000000 1.0 P P3 1 0.61703027 0.06914927 0.00000000 1.0 P P4 1 0.92925856 0.54575325 0.00000000 1.0 P P5 1 0.04774288 0.26456380 0.50000000 1.0 P P6 1 0.74038473 0.78921493 0.50000000 1.0 P P7 1 0.21443411 0.95257361 0.50000000 1.0 P P8 1 0.32949778 0.67012017 0.00000000 1.0 Ir Ir9 1 0.71633380 0.59485873 0.00000000 1.0 Ir Ir10 1 0.40216724 0.11784414 0.00000000 1.0 Ir Ir11 1 0.88282670 0.28399698 0.00000000 1.0 Ir Ir12 1 0.26355040 0.21518697 0.50000000 1.0 Ir Ir13 1 0.78337564 0.04921528 0.50000000 1.0 Ir Ir14 1 0.94869890 0.73485854 0.50000000 1.0 Ir Ir15 1 0.48690583 0.55099402 0.50000000 1.0 Ru Ru16 1 0.22012259 0.40074506 0.00000000 1.0 Ru Ru17 1 0.60050569 0.81572779 0.00000000 1.0 Ru Ru18 1 0.17854992 0.78587496 0.00000000 1.0 Ru Ru19 1 0.44608648 0.92899660 0.50000000 1.0 Ru Ru20 1 0.07101160 0.51916363 0.50000000 1.0