# generated using pymatgen data_Li7Fe3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.55052100 _cell_length_b 7.75152222 _cell_length_c 10.46267933 _cell_angle_alpha 111.12979245 _cell_angle_beta 86.04108087 _cell_angle_gamma 109.13975067 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7Fe3O8 _chemical_formula_sum 'Li14 Fe6 O16' _cell_volume 396.06250084 _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 0.28479900 0.18306200 0.93337300 1.0 Li Li1 1 0.31712100 0.62140500 0.94634800 1.0 Li Li2 1 0.14362700 0.53701700 0.66560500 1.0 Li Li3 1 0.46755100 0.82548300 0.72235500 1.0 Li Li4 1 0.58078000 0.79929900 0.56103900 1.0 Li Li5 1 0.46005000 0.18789600 0.77962700 1.0 Li Li6 1 0.28401600 0.57929800 0.48384400 1.0 Li Li7 1 0.71598400 0.42070200 0.51615600 1.0 Li Li8 1 0.53995000 0.81210400 0.22037300 1.0 Li Li9 1 0.41922000 0.20070100 0.43896100 1.0 Li Li10 1 0.53244900 0.17451700 0.27764500 1.0 Li Li11 1 0.85637300 0.46298300 0.33439500 1.0 Li Li12 1 0.68287900 0.37859500 0.05365200 1.0 Li Li13 1 0.71520100 0.81693800 0.06662700 1.0 Fe Fe14 1 0.80818500 0.41970000 0.85420400 1.0 Fe Fe15 1 0.94761200 0.99081700 0.83806400 1.0 Fe Fe16 1 0.05988700 0.06832200 0.62180000 1.0 Fe Fe17 1 0.94011300 0.93167800 0.37820000 1.0 Fe Fe18 1 0.05238800 0.00918300 0.16193600 1.0 Fe Fe19 1 0.19181500 0.58030000 0.14579600 1.0 O O20 1 0.90966700 0.21807900 0.84541000 1.0 O O21 1 0.48622100 0.48849300 0.76300800 1.0 O O22 1 0.26624900 0.86045600 0.95334000 1.0 O O23 1 0.64932700 0.76016300 0.87584500 1.0 O O24 1 0.10005300 0.69309700 0.79686400 1.0 O O25 1 0.07647400 0.26976200 0.65896300 1.0 O O26 1 0.63239200 0.75415100 0.46015300 1.0 O O27 1 0.23564800 0.88638900 0.48186000 1.0 O O28 1 0.76435200 0.11361100 0.51814000 1.0 O O29 1 0.36760800 0.24584900 0.53984700 1.0 O O30 1 0.92352600 0.73023800 0.34103700 1.0 O O31 1 0.89994700 0.30690300 0.20313600 1.0 O O32 1 0.35067300 0.23983700 0.12415500 1.0 O O33 1 0.73375100 0.13954400 0.04666000 1.0 O O34 1 0.51377900 0.51150700 0.23699200 1.0 O O35 1 0.09033300 0.78192100 0.15459000 1.0