# generated using pymatgen data_NdTh3(Zn5Sn)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.52464484 _cell_length_b 8.52464660 _cell_length_c 9.01601240 _cell_angle_alpha 89.57700091 _cell_angle_beta 90.42300013 _cell_angle_gamma 149.72078865 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh3(Zn5Sn)2 _chemical_formula_sum 'Nd1 Th3 Zn10 Sn2' _cell_volume 330.34645877 _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 Nd Nd0 1 0.00000000 0.00000000 0.00000000 1.0 Th Th1 1 0.20551300 0.79448700 0.24943798 1.0 Th Th2 1 0.79448700 0.20551300 0.75056202 1.0 Th Th3 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn4 1 0.81554401 0.18445599 0.39407956 1.0 Zn Zn5 1 0.18445599 0.81554401 0.60592044 1.0 Zn Zn6 1 0.81634922 0.18365078 0.10829099 1.0 Zn Zn7 1 0.18365078 0.81634922 0.89170901 1.0 Zn Zn8 1 0.65639189 0.34360811 0.48383586 1.0 Zn Zn9 1 0.34360811 0.65639189 0.51616414 1.0 Zn Zn10 1 0.65728117 0.34271883 0.01467457 1.0 Zn Zn11 1 0.34271883 0.65728117 0.98532543 1.0 Zn Zn12 1 0.39466183 0.60533817 0.25166664 1.0 Zn Zn13 1 0.60533817 0.39466183 0.74833336 1.0 Sn Sn14 1 0.55463143 0.44536857 0.24831890 1.0 Sn Sn15 1 0.44536857 0.55463143 0.75168110 1.0