# generated using pymatgen data_CaMg6Ga _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.15244400 _cell_length_b 6.36440300 _cell_length_c 11.60795200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaMg6Ga _chemical_formula_sum 'Ca2 Mg12 Ga2' _cell_volume 380.65063240 _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 Ca Ca0 1 0.50000000 0.50000000 0.67160700 1.0 Ca Ca1 1 0.50000000 0.00000000 0.17160700 1.0 Mg Mg2 1 0.50000000 0.74821400 0.92002000 1.0 Mg Mg3 1 0.50000000 0.25178600 0.92002000 1.0 Mg Mg4 1 0.00000000 0.24023700 0.58141700 1.0 Mg Mg5 1 0.00000000 0.75976300 0.58141700 1.0 Mg Mg6 1 0.00000000 0.50000000 0.83952200 1.0 Mg Mg7 1 0.00000000 0.00000000 0.82710600 1.0 Mg Mg8 1 0.50000000 0.24821400 0.42002000 1.0 Mg Mg9 1 0.50000000 0.75178600 0.42002000 1.0 Mg Mg10 1 0.00000000 0.74023700 0.08141700 1.0 Mg Mg11 1 0.00000000 0.25976300 0.08141700 1.0 Mg Mg12 1 0.00000000 0.00000000 0.33952200 1.0 Mg Mg13 1 0.00000000 0.50000000 0.32710600 1.0 Ga Ga14 1 0.50000000 0.00000000 0.65888800 1.0 Ga Ga15 1 0.50000000 0.50000000 0.15888800 1.0