# generated using pymatgen data_Mg6NiSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.87279800 _cell_length_b 6.26882900 _cell_length_c 10.67469500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6NiSn _chemical_formula_sum 'Mg12 Ni2 Sn2' _cell_volume 326.07710513 _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 0.24827900 0.58432300 1.0 Mg Mg1 1 0.50000000 0.75172100 0.58432300 1.0 Mg Mg2 1 0.00000000 0.26610300 0.41331400 1.0 Mg Mg3 1 0.00000000 0.73389700 0.41331400 1.0 Mg Mg4 1 0.00000000 0.00000000 0.67460300 1.0 Mg Mg5 1 0.00000000 0.00000000 0.16446000 1.0 Mg Mg6 1 0.50000000 0.74827900 0.08432300 1.0 Mg Mg7 1 0.50000000 0.25172100 0.08432300 1.0 Mg Mg8 1 0.00000000 0.76610300 0.91331400 1.0 Mg Mg9 1 0.00000000 0.23389700 0.91331400 1.0 Mg Mg10 1 0.00000000 0.50000000 0.17460300 1.0 Mg Mg11 1 0.00000000 0.50000000 0.66446000 1.0 Ni Ni12 1 0.50000000 0.00000000 0.83317300 1.0 Ni Ni13 1 0.50000000 0.50000000 0.33317300 1.0 Sn Sn14 1 0.50000000 0.00000000 0.33249500 1.0 Sn Sn15 1 0.50000000 0.50000000 0.83249500 1.0