# generated using pymatgen data_Mg6CuC _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.51789500 _cell_length_b 8.17192800 _cell_length_c 10.05035800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6CuC _chemical_formula_sum 'Mg12 Cu2 C2' _cell_volume 288.92753753 _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 0.67143000 0.12368600 1.0 Mg Mg1 1 0.00000000 0.32857000 0.12368600 1.0 Mg Mg2 1 0.00000000 0.50000000 0.88014300 1.0 Mg Mg3 1 0.50000000 0.77961700 0.88526900 1.0 Mg Mg4 1 0.50000000 0.22038300 0.88526900 1.0 Mg Mg5 1 0.50000000 0.50000000 0.63600300 1.0 Mg Mg6 1 0.00000000 0.17143000 0.62368600 1.0 Mg Mg7 1 0.00000000 0.82857000 0.62368600 1.0 Mg Mg8 1 0.00000000 0.00000000 0.38014300 1.0 Mg Mg9 1 0.50000000 0.27961700 0.38526900 1.0 Mg Mg10 1 0.50000000 0.72038300 0.38526900 1.0 Mg Mg11 1 0.50000000 0.00000000 0.13600300 1.0 Cu Cu12 1 0.00000000 0.50000000 0.44445300 1.0 Cu Cu13 1 0.00000000 0.00000000 0.94445300 1.0 C C14 1 0.50000000 0.50000000 0.02149200 1.0 C C15 1 0.50000000 0.00000000 0.52149200 1.0