# generated using pymatgen data_MgCu6OF11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43652421 _cell_length_b 4.99386374 _cell_length_c 8.57045998 _cell_angle_alpha 90.75213618 _cell_angle_beta 93.72643986 _cell_angle_gamma 90.94550617 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCu6OF11 _chemical_formula_sum 'Mg1 Cu6 O1 F11' _cell_volume 232.13457921 _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 0.49821800 0.49489900 0.49207900 1.0 Cu Cu1 1 0.01160800 0.00699700 0.00461400 1.0 Cu Cu2 1 0.48435200 0.56504100 0.06052800 1.0 Cu Cu3 1 0.42016600 0.98764100 0.30177000 1.0 Cu Cu4 1 0.90645400 0.49279600 0.30210100 1.0 Cu Cu5 1 0.09193500 0.50538100 0.70143200 1.0 Cu Cu6 1 0.60676900 0.98101600 0.70974600 1.0 O O7 1 0.59611100 0.66301000 0.27631700 1.0 F F8 1 0.31250900 0.21785100 0.07446000 1.0 F F9 1 0.11285100 0.79704600 0.24531000 1.0 F F10 1 0.82493400 0.27918000 0.09392300 1.0 F F11 1 0.21095800 0.30524500 0.38451800 1.0 F F12 1 0.69402500 0.19476100 0.41567400 1.0 F F13 1 0.31348000 0.78225400 0.59395100 1.0 F F14 1 0.78889400 0.67283300 0.60947400 1.0 F F15 1 0.41248900 0.31115500 0.69678900 1.0 F F16 1 0.20302800 0.71956700 0.91673900 1.0 F F17 1 0.90968800 0.19105700 0.76222200 1.0 F F18 1 0.70152900 0.80449200 0.94429100 1.0