# generated using pymatgen data_Lu(Zr3Sn2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.56346648 _cell_length_b 8.50624692 _cell_length_c 5.83696830 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.77921542 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu(Zr3Sn2)3 _chemical_formula_sum 'Lu1 Zr9 Sn6' _cell_volume 369.03492323 _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 Lu Lu0 1 1.00000000 0.76065294 0.25000000 1.0 Zr Zr1 1 0.66723532 0.33249021 0.99921360 1.0 Zr Zr2 1 0.33276468 0.66525589 0.99921360 1.0 Zr Zr3 1 0.33276468 0.66525589 0.50078640 1.0 Zr Zr4 1 0.66723532 0.33249021 0.50078640 1.0 Zr Zr5 1 0.74908755 0.74843459 0.75000000 1.0 Zr Zr6 1 0.25091245 0.99934704 0.75000000 1.0 Zr Zr7 1 0.00000000 0.24516029 0.75000000 1.0 Zr Zr8 1 0.25019604 0.25186745 0.25000000 1.0 Zr Zr9 1 0.74980396 0.00167040 0.25000000 1.0 Sn Sn10 1 0.39017737 0.38937582 0.75000000 1.0 Sn Sn11 1 0.60982263 0.99919945 0.75000000 1.0 Sn Sn12 1 1.00000000 0.60820738 0.75000000 1.0 Sn Sn13 1 0.60652402 0.60784063 0.25000000 1.0 Sn Sn14 1 0.39347598 0.00131661 0.25000000 1.0 Sn Sn15 1 0.00000000 0.39143422 0.25000000 1.0