# generated using pymatgen data_Mg6NiSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.87996400 _cell_length_b 6.19710100 _cell_length_c 10.65937700 _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 322.35693297 _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 0.25450900 0.41756900 1.0 Mg Mg1 1 0.50000000 0.74549100 0.41756900 1.0 Mg Mg2 1 0.50000000 0.00000000 0.66646400 1.0 Mg Mg3 1 0.00000000 0.25982000 0.58765400 1.0 Mg Mg4 1 0.00000000 0.74018000 0.58765400 1.0 Mg Mg5 1 0.00000000 0.00000000 0.83112200 1.0 Mg Mg6 1 0.50000000 0.75450900 0.91756900 1.0 Mg Mg7 1 0.50000000 0.24549100 0.91756900 1.0 Mg Mg8 1 0.50000000 0.50000000 0.16646400 1.0 Mg Mg9 1 0.00000000 0.75982000 0.08765400 1.0 Mg Mg10 1 0.00000000 0.24018000 0.08765400 1.0 Mg Mg11 1 0.00000000 0.50000000 0.33112200 1.0 Ni Ni12 1 0.50000000 0.00000000 0.16501100 1.0 Ni Ni13 1 0.50000000 0.50000000 0.66501100 1.0 Sn Sn14 1 0.00000000 0.00000000 0.32695600 1.0 Sn Sn15 1 0.00000000 0.50000000 0.82695600 1.0