# generated using pymatgen data_Mg6NbGa _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.86403600 _cell_length_b 6.26896100 _cell_length_c 10.77259700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6NbGa _chemical_formula_sum 'Mg12 Nb2 Ga2' _cell_volume 328.48289679 _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 0.25298700 0.08155900 1.0 Mg Mg1 1 0.00000000 0.74701300 0.08155900 1.0 Mg Mg2 1 0.00000000 0.50000000 0.83324000 1.0 Mg Mg3 1 0.50000000 0.24334900 0.91350000 1.0 Mg Mg4 1 0.50000000 0.75665100 0.91350000 1.0 Mg Mg5 1 0.50000000 0.50000000 0.66659000 1.0 Mg Mg6 1 0.00000000 0.75298700 0.58155900 1.0 Mg Mg7 1 0.00000000 0.24701300 0.58155900 1.0 Mg Mg8 1 0.00000000 0.00000000 0.33324000 1.0 Mg Mg9 1 0.50000000 0.74334900 0.41350000 1.0 Mg Mg10 1 0.50000000 0.25665100 0.41350000 1.0 Mg Mg11 1 0.50000000 0.00000000 0.16659000 1.0 Nb Nb12 1 0.00000000 0.50000000 0.32606100 1.0 Nb Nb13 1 0.00000000 0.00000000 0.82606100 1.0 Ga Ga14 1 0.50000000 0.50000000 0.18399300 1.0 Ga Ga15 1 0.50000000 0.00000000 0.68399300 1.0