# generated using pymatgen data_Li7Fe(O2F)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.52704700 _cell_length_b 5.89510329 _cell_length_c 9.94473146 _cell_angle_alpha 105.44390164 _cell_angle_beta 88.29325518 _cell_angle_gamma 117.46102347 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7Fe(O2F)2 _chemical_formula_sum 'Li14 Fe2 O8 F4' _cell_volume 275.48933247 _cell_formula_units_Z 2 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 0.02424800 0.15489300 0.77327100 1.0 Li Li1 1 0.49676300 0.14670400 0.24855500 1.0 Li Li2 1 0.53499500 0.43892600 0.61797200 1.0 Li Li3 1 0.96801900 0.56123500 0.88094000 1.0 Li Li4 1 0.02357100 0.18059000 0.55780900 1.0 Li Li5 1 0.53642300 0.28730400 0.04368100 1.0 Li Li6 1 0.98571700 0.33283100 0.32357400 1.0 Li Li7 1 0.46773400 0.77921100 0.94244800 1.0 Li Li8 1 0.96786100 0.75274700 0.45944200 1.0 Li Li9 1 0.00878800 0.40314800 0.12157400 1.0 Li Li10 1 0.49546600 0.61008300 0.38513400 1.0 Li Li11 1 0.43768300 0.79992900 0.73156500 1.0 Li Li12 1 0.02742200 0.87023100 0.24988500 1.0 Li Li13 1 0.52103400 0.67538800 0.17574200 1.0 Fe Fe14 1 0.06081800 0.95905200 0.02336900 1.0 Fe Fe15 1 0.49595100 0.08929500 0.45607700 1.0 O O16 1 0.30119300 0.85614500 0.19668900 1.0 O O17 1 0.16840600 0.81258500 0.96120300 1.0 O O18 1 0.67572700 0.88194800 0.44641600 1.0 O O19 1 0.73528100 0.55890000 0.11166200 1.0 O O20 1 0.24284900 0.42490200 0.90023500 1.0 O O21 1 0.33094100 0.15372200 0.53634300 1.0 O O22 1 0.21446400 0.16489700 0.29810000 1.0 O O23 1 0.78653200 0.49645000 0.38030300 1.0 F F24 1 0.20721200 0.48774000 0.61109400 1.0 F F25 1 0.79872700 0.86103700 0.70833800 1.0 F F26 1 0.80553300 0.13882800 0.06602600 1.0 F F27 1 0.68064700 0.12128100 0.79255200 1.0