# generated using pymatgen data_MgCu6OF11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.61861406 _cell_length_b 5.02312270 _cell_length_c 8.15509824 _cell_angle_alpha 91.05862771 _cell_angle_beta 93.52154009 _cell_angle_gamma 90.56189499 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCu6OF11 _chemical_formula_sum 'Mg1 Cu6 O1 F11' _cell_volume 229.67362526 _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 Mg Mg0 1 0.14421800 0.47326500 0.18391800 1.0 Cu Cu1 1 0.00670500 0.99958800 0.98167600 1.0 Cu Cu2 1 0.54147800 0.53873500 0.00552700 1.0 Cu Cu3 1 0.34486000 0.95940500 0.32917000 1.0 Cu Cu4 1 0.71267400 0.57284500 0.39104400 1.0 Cu Cu5 1 0.19977600 0.48770600 0.66529600 1.0 Cu Cu6 1 0.68340900 0.02163800 0.66660400 1.0 O O7 1 0.48275100 0.65182900 0.22783700 1.0 F F8 1 0.29710500 0.16062600 0.08382800 1.0 F F9 1 0.99212200 0.78708300 0.26457400 1.0 F F10 1 0.84288200 0.31954800 0.07361700 1.0 F F11 1 0.16968500 0.28293700 0.39165200 1.0 F F12 1 0.64395400 0.18790500 0.45164400 1.0 F F13 1 0.39710300 0.79029200 0.58479100 1.0 F F14 1 0.90815000 0.65697600 0.58645000 1.0 F F15 1 0.48813800 0.35932600 0.78272100 1.0 F F16 1 0.18304600 0.66475300 0.95945900 1.0 F F17 1 0.00276200 0.18787900 0.73536200 1.0 F F18 1 0.70917900 0.85599600 0.88482900 1.0