# generated using pymatgen data_MgCu6OF11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.67316726 _cell_length_b 4.73132073 _cell_length_c 8.76310604 _cell_angle_alpha 89.89879462 _cell_angle_beta 90.63086944 _cell_angle_gamma 94.42081351 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCu6OF11 _chemical_formula_sum 'Mg1 Cu6 O1 F11' _cell_volume 234.50143387 _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 0.99015100 0.31790400 0.24597500 1.0 Cu Cu1 1 0.99813100 0.97233300 0.97148200 1.0 Cu Cu2 1 0.49567100 0.55195300 0.02979800 1.0 Cu Cu3 1 0.36848000 0.96168600 0.31360400 1.0 Cu Cu4 1 0.69791200 0.64971200 0.40639400 1.0 Cu Cu5 1 0.18065300 0.49384600 0.66692800 1.0 Cu Cu6 1 0.66588700 0.00608600 0.67929500 1.0 O O7 1 0.51421800 0.67120000 0.23286100 1.0 F F8 1 0.23795200 0.20193500 0.09712900 1.0 F F9 1 0.01619000 0.73433000 0.25789400 1.0 F F10 1 0.78547700 0.23123300 0.06876500 1.0 F F11 1 0.21063500 0.25205600 0.41092100 1.0 F F12 1 0.72614500 0.21241000 0.38785600 1.0 F F13 1 0.41429600 0.76835400 0.57252100 1.0 F F14 1 0.89458600 0.71570000 0.58915700 1.0 F F15 1 0.44429000 0.27572800 0.73976200 1.0 F F16 1 0.21477600 0.70715800 0.90556800 1.0 F F17 1 0.94820800 0.21897000 0.74862200 1.0 F F18 1 0.72133700 0.75184700 0.89422100 1.0