# generated using pymatgen data_Mg6NiSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.90493624 _cell_length_b 9.95414006 _cell_length_c 9.95414006 _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 'Mg24 Ni4 Sn4' _cell_volume 684.17494677 _cell_formula_units_Z 4 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 0.22595952 0.23917021 0.52320389 1.0 Mg Mg1 1 0.22595952 0.76082979 0.47679611 1.0 Mg Mg2 1 0.72595952 0.47679611 0.23917021 1.0 Mg Mg3 1 0.72595952 0.23917021 0.47679611 1.0 Mg Mg4 1 0.72595952 0.52320389 0.76082979 1.0 Mg Mg5 1 0.72595952 0.76082979 0.52320389 1.0 Mg Mg6 1 0.22595952 0.47679611 0.76082979 1.0 Mg Mg7 1 0.22595952 0.52320389 0.23917021 1.0 Mg Mg8 1 0.02896040 0.03607906 0.34645053 1.0 Mg Mg9 1 0.02896040 0.96392094 0.65354947 1.0 Mg Mg10 1 0.52896040 0.65354947 0.03607906 1.0 Mg Mg11 1 0.52896040 0.03607906 0.65354947 1.0 Mg Mg12 1 0.52896040 0.34645053 0.96392094 1.0 Mg Mg13 1 0.52896040 0.96392094 0.34645053 1.0 Mg Mg14 1 0.02896040 0.65354947 0.96392094 1.0 Mg Mg15 1 0.02896040 0.34645053 0.03607906 1.0 Mg Mg16 1 0.46948133 0.50000000 0.50000000 1.0 Mg Mg17 1 0.96948133 0.50000000 0.50000000 1.0 Mg Mg18 1 0.99912995 0.00000000 0.00000000 1.0 Mg Mg19 1 0.49912995 -0.00000000 0.00000000 1.0 Mg Mg20 1 0.33675232 0.22572895 0.22572895 1.0 Mg Mg21 1 0.33675232 0.77427105 0.77427105 1.0 Mg Mg22 1 0.83675232 0.77427105 0.22572895 1.0 Mg Mg23 1 0.83675232 0.22572895 0.77427105 1.0 Ni Ni24 1 0.00878215 0.30947046 0.30947046 1.0 Ni Ni25 1 0.00878215 0.69052954 0.69052954 1.0 Ni Ni26 1 0.50878215 0.69052954 0.30947046 1.0 Ni Ni27 1 0.50878215 0.30947046 0.69052954 1.0 Sn Sn28 1 0.74117003 0.17146115 0.17146115 1.0 Sn Sn29 1 0.74117003 0.82853885 0.82853885 1.0 Sn Sn30 1 0.24117003 0.82853885 0.17146115 1.0 Sn Sn31 1 0.24117003 0.17146115 0.82853885 1.0