# generated using pymatgen data_FeO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.93987200 _cell_length_b 5.97312033 _cell_length_c 14.50089497 _cell_angle_alpha 88.61198800 _cell_angle_beta 89.14963335 _cell_angle_gamma 60.38650920 _symmetry_Int_Tables_number 1 _chemical_formula_structural FeO2 _chemical_formula_sum 'Fe12 O24' _cell_volume 447.14902079 _cell_formula_units_Z 12 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 Fe Fe0 1 0.68069000 0.65552900 0.16833700 1.0 Fe Fe1 1 0.50111400 0.50054000 0.49928700 1.0 Fe Fe2 1 0.33121700 0.82722500 0.33347900 1.0 Fe Fe3 1 0.16498200 0.65968600 0.16899800 1.0 Fe Fe4 1 0.99970700 0.00524900 0.50022700 1.0 Fe Fe5 1 0.16451900 0.17377400 0.16803600 1.0 Fe Fe6 1 0.66811000 0.17321000 0.66553600 1.0 Fe Fe7 1 0.49912500 0.00226100 0.49971700 1.0 Fe Fe8 1 0.33238900 0.33292000 0.83374200 1.0 Fe Fe9 1 0.83339000 0.33362000 0.83396600 1.0 Fe Fe10 1 0.83288100 0.83321300 0.83290400 1.0 Fe Fe11 1 0.33649600 0.83096900 0.95470200 1.0 O O12 1 0.30360000 0.34561800 0.10737900 1.0 O O13 1 0.84694500 0.35481400 0.10448700 1.0 O O14 1 0.97916100 0.49586400 0.24600100 1.0 O O15 1 0.84283800 0.80508400 0.10870500 1.0 O O16 1 0.62497400 0.67274400 0.41996800 1.0 O O17 1 0.48003500 0.53665400 0.23916000 1.0 O O18 1 0.34496800 0.83536500 0.08859400 1.0 O O19 1 0.47410600 0.96777800 0.24604800 1.0 O O20 1 0.18284200 0.69180800 0.41761600 1.0 O O21 1 0.34347800 0.82862100 0.56759400 1.0 O O22 1 0.17562900 0.13195000 0.42616100 1.0 O O23 1 0.04735300 0.97365100 0.24258900 1.0 O O24 1 0.94780100 0.02676700 0.74689100 1.0 O O25 1 0.81929300 0.88231000 0.57748300 1.0 O O26 1 0.65820600 0.17200300 0.43116000 1.0 O O27 1 0.81472900 0.31039400 0.58190500 1.0 O O28 1 0.65774600 0.16454300 0.90170300 1.0 O O29 1 0.52558000 0.02835400 0.74389300 1.0 O O30 1 0.52193600 0.45194300 0.74700200 1.0 O O31 1 0.37982900 0.32638600 0.57928300 1.0 O O32 1 0.17111000 0.16365900 0.90155400 1.0 O O33 1 0.16995300 0.66938700 0.90206400 1.0 O O34 1 0.00995900 0.50173800 0.76869500 1.0 O O35 1 0.66671100 0.66766500 0.90003400 1.0