# generated using pymatgen data_LiCaMg6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.24735800 _cell_length_b 6.58043400 _cell_length_c 11.50848600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCaMg6 _chemical_formula_sum 'Li2 Ca2 Mg12' _cell_volume 397.38679010 _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 0.50000000 0.50000000 0.16248800 1.0 Li Li1 1 0.50000000 0.00000000 0.66248800 1.0 Ca Ca2 1 0.00000000 0.50000000 0.33111200 1.0 Ca Ca3 1 0.00000000 0.00000000 0.83111200 1.0 Mg Mg4 1 0.00000000 0.74442500 0.08151800 1.0 Mg Mg5 1 0.00000000 0.25557500 0.08151800 1.0 Mg Mg6 1 0.00000000 0.00000000 0.33635400 1.0 Mg Mg7 1 0.50000000 0.24362000 0.41974900 1.0 Mg Mg8 1 0.50000000 0.75638000 0.41974900 1.0 Mg Mg9 1 0.50000000 0.00000000 0.16751300 1.0 Mg Mg10 1 0.00000000 0.24442500 0.58151800 1.0 Mg Mg11 1 0.00000000 0.75557500 0.58151800 1.0 Mg Mg12 1 0.00000000 0.50000000 0.83635400 1.0 Mg Mg13 1 0.50000000 0.74362000 0.91974900 1.0 Mg Mg14 1 0.50000000 0.25638000 0.91974900 1.0 Mg Mg15 1 0.50000000 0.50000000 0.66751300 1.0