# generated using pymatgen data_Tm5Th3Ni8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.30633727 _cell_length_b 5.34118746 _cell_length_c 13.67852964 _cell_angle_alpha 89.59677942 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5Th3Ni8 _chemical_formula_sum 'Tm5 Th3 Ni8' _cell_volume 314.61144855 _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 0.25000000 0.52485059 0.28389187 1.0 Tm Tm1 1 0.75000000 0.47694077 0.71610217 1.0 Tm Tm2 1 0.25000000 0.97109801 0.77986089 1.0 Tm Tm3 1 0.25000000 0.75444040 0.53844034 1.0 Tm Tm4 1 0.25000000 0.74292080 0.03188018 1.0 Th Th5 1 0.75000000 0.25907139 0.96375067 1.0 Th Th6 1 0.75000000 0.02247997 0.21595271 1.0 Th Th7 1 0.75000000 0.24491964 0.46857433 1.0 Ni Ni8 1 0.25000000 0.01946782 0.35592696 1.0 Ni Ni9 1 0.75000000 0.52629904 0.14571071 1.0 Ni Ni10 1 0.75000000 0.74772180 0.39581653 1.0 Ni Ni11 1 0.25000000 0.47664836 0.85318880 1.0 Ni Ni12 1 0.75000000 0.97901036 0.64401893 1.0 Ni Ni13 1 0.75000000 0.75446589 0.89277670 1.0 Ni Ni14 1 0.25000000 0.24763677 0.10477293 1.0 Ni Ni15 1 0.25000000 0.25202639 0.60933327 1.0