# generated using pymatgen data_Li4Fe7(OF7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.14684000 _cell_length_b 6.15558049 _cell_length_c 10.76420876 _cell_angle_alpha 105.69174293 _cell_angle_beta 91.42641944 _cell_angle_gamma 118.72400209 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Fe7(OF7)2 _chemical_formula_sum 'Li4 Fe7 O2 F14' _cell_volume 338.02361810 _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 Li Li0 1 0.91424000 0.20539800 0.44484000 1.0 Li Li1 1 0.56937400 0.76147800 0.05704200 1.0 Li Li2 1 0.43108300 0.23262600 0.94759600 1.0 Li Li3 1 0.07106400 0.77327500 0.55808800 1.0 Fe Fe4 1 0.01237200 0.52436800 0.99073000 1.0 Fe Fe5 1 0.22396900 0.99875900 0.25209400 1.0 Fe Fe6 1 0.77248700 0.52904600 0.24260100 1.0 Fe Fe7 1 0.51029700 0.50246900 0.50297800 1.0 Fe Fe8 1 0.25263500 0.49432600 0.74961700 1.0 Fe Fe9 1 0.76583600 0.99643000 0.25232400 1.0 Fe Fe10 1 0.75028600 0.00384500 0.74841400 1.0 O O11 1 0.85125200 0.95591600 0.37602400 1.0 O O12 1 0.09491700 0.97381900 0.13773600 1.0 F F13 1 0.63373100 0.49843200 0.12087500 1.0 F F14 1 0.62479700 0.97603500 0.63732100 1.0 F F15 1 0.63718200 0.03640000 0.12926900 1.0 F F16 1 0.11911700 0.49459900 0.62996200 1.0 F F17 1 0.61731300 0.51898400 0.62918200 1.0 F F18 1 0.11441500 0.49486800 0.12217600 1.0 F F19 1 0.86496900 0.48456600 0.37872900 1.0 F F20 1 0.37277800 0.49171400 0.37566700 1.0 F F21 1 0.89142900 0.47282100 0.87588500 1.0 F F22 1 0.37208400 0.97639100 0.88134600 1.0 F F23 1 0.13800400 0.04408000 0.61304200 1.0 F F24 1 0.85794900 0.00966400 0.86760300 1.0 F F25 1 0.41763900 0.04495300 0.35360200 1.0 F F26 1 0.36878200 0.50473800 0.87525700 1.0