# generated using pymatgen data_Mg6MoW _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.74259900 _cell_length_b 5.95618200 _cell_length_c 10.87978400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6MoW _chemical_formula_sum 'Mg12 Mo2 W2' _cell_volume 307.32977531 _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 0.74069400 0.07641900 1.0 Mg Mg1 1 0.00000000 0.25930600 0.07641900 1.0 Mg Mg2 1 0.00000000 0.00000000 0.33036200 1.0 Mg Mg3 1 0.50000000 0.25835200 0.42434100 1.0 Mg Mg4 1 0.50000000 0.74164800 0.42434100 1.0 Mg Mg5 1 0.50000000 0.00000000 0.16947700 1.0 Mg Mg6 1 0.00000000 0.24069400 0.57641900 1.0 Mg Mg7 1 0.00000000 0.75930600 0.57641900 1.0 Mg Mg8 1 0.00000000 0.50000000 0.83036200 1.0 Mg Mg9 1 0.50000000 0.75835200 0.92434100 1.0 Mg Mg10 1 0.50000000 0.24164800 0.92434100 1.0 Mg Mg11 1 0.50000000 0.50000000 0.66947700 1.0 Mo Mo12 1 0.00000000 0.50000000 0.30959700 1.0 Mo Mo13 1 0.00000000 0.00000000 0.80959700 1.0 W W14 1 0.50000000 0.50000000 0.18904200 1.0 W W15 1 0.50000000 0.00000000 0.68904200 1.0