# generated using pymatgen data_Tm2P7IrRu11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.29035909 _cell_length_b 9.35429085 _cell_length_c 3.92426487 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.67366661 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2P7IrRu11 _chemical_formula_sum 'Tm2 P7 Ir1 Ru11' _cell_volume 296.31323815 _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 0.66774281 0.33408716 0.50000000 1.0 Tm Tm1 1 0.33174008 0.66385212 0.00000000 1.0 P P2 1 0.59808271 0.71190118 0.50000000 1.0 P P3 1 0.99961967 0.00012288 0.00000000 1.0 P P4 1 0.27729222 0.87848247 0.50000000 1.0 P P5 1 0.11785900 0.40058619 0.50000000 1.0 P P6 1 0.88543375 0.57623550 0.00000000 1.0 P P7 1 0.42753306 0.31098969 0.00000000 1.0 P P8 1 0.69616168 0.12139209 0.00000000 1.0 Ir Ir9 1 0.54926298 0.94050469 0.50000000 1.0 Ru Ru10 1 0.39145004 0.44211956 0.50000000 1.0 Ru Ru11 1 0.91226759 0.12413625 0.50000000 1.0 Ru Ru12 1 0.20966063 0.08512100 0.50000000 1.0 Ru Ru13 1 0.87706516 0.79467646 0.50000000 1.0 Ru Ru14 1 0.72672721 0.89398652 0.00000000 1.0 Ru Ru15 1 0.10981175 0.83697033 0.00000000 1.0 Ru Ru16 1 0.16363473 0.27052593 0.00000000 1.0 Ru Ru17 1 0.43054566 0.06966157 0.00000000 1.0 Ru Ru18 1 0.93505847 0.36134629 0.00000000 1.0 Ru Ru19 1 0.64185148 0.57577824 0.00000000 1.0 Ru Ru20 1 0.05119933 0.60752287 0.50000000 1.0