# generated using pymatgen data_LiMg6V _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.23559745 _cell_length_b 6.23559697 _cell_length_c 5.07706700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.21117700 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMg6V _chemical_formula_sum 'Li1 Mg6 V1' _cell_volume 170.59705693 _cell_formula_units_Z 1 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 Li Li0 1 0.32944718 0.17055282 0.75000000 1.0 Mg Mg1 1 0.17043068 0.83921108 0.25000000 1.0 Mg Mg2 1 0.66078892 0.32956932 0.25000000 1.0 Mg Mg3 1 0.66532819 0.83467181 0.25000000 1.0 Mg Mg4 1 0.32809358 0.65167423 0.75000000 1.0 Mg Mg5 1 0.84832577 0.17190642 0.75000000 1.0 Mg Mg6 1 0.83277161 0.66722839 0.75000000 1.0 V V7 1 0.16481407 0.33518593 0.25000000 1.0