# generated using pymatgen data_Mg6NbSi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06938300 _cell_length_b 5.74711800 _cell_length_c 10.89245700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6NbSi _chemical_formula_sum 'Mg12 Nb2 Si2' _cell_volume 317.34457060 _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 0.25122300 0.42319800 1.0 Mg Mg1 1 0.50000000 0.74877700 0.42319800 1.0 Mg Mg2 1 0.00000000 0.74440400 0.08096100 1.0 Mg Mg3 1 0.00000000 0.25559600 0.08096100 1.0 Mg Mg4 1 0.00000000 0.00000000 0.32209500 1.0 Mg Mg5 1 0.00000000 0.50000000 0.32519400 1.0 Mg Mg6 1 0.50000000 0.75122300 0.92319800 1.0 Mg Mg7 1 0.50000000 0.24877700 0.92319800 1.0 Mg Mg8 1 0.00000000 0.24440400 0.58096100 1.0 Mg Mg9 1 0.00000000 0.75559600 0.58096100 1.0 Mg Mg10 1 0.00000000 0.50000000 0.82209500 1.0 Mg Mg11 1 0.00000000 0.00000000 0.82519400 1.0 Nb Nb12 1 0.50000000 0.50000000 0.17548200 1.0 Nb Nb13 1 0.50000000 0.00000000 0.67548200 1.0 Si Si14 1 0.50000000 0.00000000 0.16890700 1.0 Si Si15 1 0.50000000 0.50000000 0.66890700 1.0