# generated using pymatgen data_Mg6VCr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.99580000 _cell_length_b 6.19732800 _cell_length_c 10.67269100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6VCr _chemical_formula_sum 'Mg12 V2 Cr2' _cell_volume 330.43303675 _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 0.75937600 0.58559700 1.0 Mg Mg1 1 0.00000000 0.24062400 0.58559700 1.0 Mg Mg2 1 0.00000000 0.00000000 0.33465900 1.0 Mg Mg3 1 0.50000000 0.74012600 0.41346800 1.0 Mg Mg4 1 0.50000000 0.25987400 0.41346800 1.0 Mg Mg5 1 0.50000000 0.00000000 0.16549200 1.0 Mg Mg6 1 0.00000000 0.25937600 0.08559700 1.0 Mg Mg7 1 0.00000000 0.74062400 0.08559700 1.0 Mg Mg8 1 0.00000000 0.50000000 0.83465900 1.0 Mg Mg9 1 0.50000000 0.24012600 0.91346800 1.0 Mg Mg10 1 0.50000000 0.75987400 0.91346800 1.0 Mg Mg11 1 0.50000000 0.50000000 0.66549200 1.0 V V12 1 0.00000000 0.00000000 0.83568300 1.0 V V13 1 0.00000000 0.50000000 0.33568300 1.0 Cr Cr14 1 0.50000000 0.00000000 0.66603500 1.0 Cr Cr15 1 0.50000000 0.50000000 0.16603500 1.0