# generated using pymatgen data_Mg6NbSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.13266800 _cell_length_b 6.03920400 _cell_length_c 11.05643800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6NbSn _chemical_formula_sum 'Mg12 Nb2 Sn2' _cell_volume 342.71894190 _cell_formula_units_Z 2 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 Mg Mg0 1 0.50000000 0.25153100 0.41778000 1.0 Mg Mg1 1 0.50000000 0.74846900 0.41778000 1.0 Mg Mg2 1 0.00000000 0.73907700 0.08305400 1.0 Mg Mg3 1 0.00000000 0.26092300 0.08305400 1.0 Mg Mg4 1 0.00000000 0.00000000 0.33482700 1.0 Mg Mg5 1 0.00000000 0.50000000 0.32691200 1.0 Mg Mg6 1 0.50000000 0.75153100 0.91778000 1.0 Mg Mg7 1 0.50000000 0.24846900 0.91778000 1.0 Mg Mg8 1 0.00000000 0.23907700 0.58305400 1.0 Mg Mg9 1 0.00000000 0.76092300 0.58305400 1.0 Mg Mg10 1 0.00000000 0.50000000 0.83482700 1.0 Mg Mg11 1 0.00000000 0.00000000 0.82691200 1.0 Nb Nb12 1 0.50000000 0.50000000 0.16935100 1.0 Nb Nb13 1 0.50000000 0.00000000 0.66935100 1.0 Sn Sn14 1 0.50000000 0.00000000 0.16723800 1.0 Sn Sn15 1 0.50000000 0.50000000 0.66723800 1.0