# generated using pymatgen data_Cu6OF11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.19079291 _cell_length_b 13.70274985 _cell_length_c 4.57558502 _cell_angle_alpha 91.14804451 _cell_angle_beta 84.64664774 _cell_angle_gamma 90.96229600 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu6OF11 _chemical_formula_sum 'Cu6 O1 F11' _cell_volume 199.12167712 _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 Cu Cu0 1 0.01930052 0.00360103 0.01127065 1.0 Cu Cu1 1 -0.00044719 0.66613203 0.99604463 1.0 Cu Cu2 1 0.97959908 0.32827481 0.97863292 1.0 Cu Cu3 1 0.49602535 0.49808070 0.48658902 1.0 Cu Cu4 1 0.50275841 0.83445839 0.50357140 1.0 Cu Cu5 1 0.50543481 0.17433442 0.52484552 1.0 O O6 1 -0.00614311 0.22876610 0.71132226 1.0 F F7 1 0.02985548 0.56600518 0.69675721 1.0 F F8 1 0.03898539 0.90155952 0.71647730 1.0 F F9 1 0.52699511 0.26509493 0.20939204 1.0 F F10 1 0.52942741 0.59826442 0.19950997 1.0 F F11 1 0.54966008 0.93544985 0.21832761 1.0 F F12 1 0.48898383 0.06759629 0.80177633 1.0 F F13 1 0.43938593 0.39835635 0.77395852 1.0 F F14 1 0.46847164 0.73450790 0.79275447 1.0 F F15 1 -0.03135909 0.76643517 0.29471897 1.0 F F16 1 0.01095048 0.10260035 0.31433226 1.0 F F17 1 0.95211787 0.43048455 0.26971992 1.0