# generated using pymatgen data_LiMg2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.26247725 _cell_length_b 8.26247725 _cell_length_c 5.02762197 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 158.12279312 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiMg2 _chemical_formula_sum 'Li2 Mg4' _cell_volume 127.89328788 _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 Li Li0 1 0.61083569 0.38916431 0.25000000 1.0 Li Li1 1 0.38916431 0.61083569 0.75000000 1.0 Mg Mg2 1 0.27783690 0.72216310 0.25000000 1.0 Mg Mg3 1 0.94469988 0.05530012 0.25000000 1.0 Mg Mg4 1 0.72216310 0.27783690 0.75000000 1.0 Mg Mg5 1 0.05530012 0.94469988 0.75000000 1.0