# generated using pymatgen data_Mg6NbSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.98899500 _cell_length_b 6.35176800 _cell_length_c 10.81707000 _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 342.78146915 _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 0.00000000 0.25532700 0.08452000 1.0 Mg Mg1 1 0.00000000 0.74467300 0.08452000 1.0 Mg Mg2 1 0.00000000 0.50000000 0.83354900 1.0 Mg Mg3 1 0.50000000 0.25388100 0.91867000 1.0 Mg Mg4 1 0.50000000 0.74611900 0.91867000 1.0 Mg Mg5 1 0.50000000 0.50000000 0.66570900 1.0 Mg Mg6 1 0.00000000 0.75532700 0.58452000 1.0 Mg Mg7 1 0.00000000 0.24467300 0.58452000 1.0 Mg Mg8 1 0.00000000 0.00000000 0.33354900 1.0 Mg Mg9 1 0.50000000 0.75388100 0.41867000 1.0 Mg Mg10 1 0.50000000 0.24611900 0.41867000 1.0 Mg Mg11 1 0.50000000 0.00000000 0.16570900 1.0 Nb Nb12 1 0.50000000 0.50000000 0.16745500 1.0 Nb Nb13 1 0.50000000 0.00000000 0.66745500 1.0 Sn Sn14 1 0.00000000 0.50000000 0.32690700 1.0 Sn Sn15 1 0.00000000 0.00000000 0.82690700 1.0