# generated using pymatgen data_Tm9Th3Ru4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.27154256 _cell_length_b 7.15726829 _cell_length_c 9.34716276 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.47284942 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm9Th3Ru4 _chemical_formula_sum 'Tm9 Th3 Ru4' _cell_volume 419.54939070 _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 0.86265537 0.53782353 0.25000000 1.0 Tm Tm1 1 0.17037818 0.17326965 0.06780580 1.0 Tm Tm2 1 0.83233463 0.82437585 0.93615358 1.0 Tm Tm3 1 0.66860039 0.32919305 0.93570350 1.0 Tm Tm4 1 0.83233463 0.82437585 0.56384642 1.0 Tm Tm5 1 0.32613242 0.67292029 0.06930168 1.0 Tm Tm6 1 0.17037818 0.17326965 0.43219420 1.0 Tm Tm7 1 0.32613242 0.67292029 0.43069832 1.0 Tm Tm8 1 0.66860039 0.32919305 0.56429650 1.0 Th Th9 1 0.64916210 0.04875669 0.25000000 1.0 Th Th10 1 0.35699153 0.95259878 0.75000000 1.0 Th Th11 1 0.14293797 0.45205231 0.75000000 1.0 Ru Ru12 1 0.46316016 0.36814045 0.25000000 1.0 Ru Ru13 1 0.53241433 0.62946797 0.75000000 1.0 Ru Ru14 1 0.96619534 0.13024114 0.75000000 1.0 Ru Ru15 1 0.03159095 0.88140045 0.25000000 1.0