# generated using pymatgen data_Fe8N3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.18370994 _cell_length_b 9.18370994 _cell_length_c 4.68417068 _cell_angle_alpha 89.98556771 _cell_angle_beta 89.98556771 _cell_angle_gamma 124.06654598 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe8N3 _chemical_formula_sum 'Fe24 N9' _cell_volume 327.26723219 _cell_formula_units_Z 3 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 0.91561300 0.83261700 0.67235500 1.0 Fe Fe1 1 0.66638200 0.08372800 0.16593600 1.0 Fe Fe2 1 0.83466900 0.91262200 0.16197700 1.0 Fe Fe3 1 0.83116000 0.42009800 0.33661900 1.0 Fe Fe4 1 0.41949800 0.33291300 0.66284000 1.0 Fe Fe5 1 0.57990200 0.16884000 0.66338100 1.0 Fe Fe6 1 0.74952500 0.99829100 0.66566000 1.0 Fe Fe7 1 0.74890400 0.49850900 0.82840500 1.0 Fe Fe8 1 0.91627200 0.33361700 0.83406400 1.0 Fe Fe9 1 0.58079200 0.66706900 0.83543000 1.0 Fe Fe10 1 0.16920000 0.58306700 0.16069800 1.0 Fe Fe11 1 0.33293100 0.41920800 0.16457000 1.0 Fe Fe12 1 0.50149100 0.25109600 0.17159500 1.0 Fe Fe13 1 0.50029500 0.74860700 0.32604500 1.0 Fe Fe14 1 0.33052000 0.91435600 0.32913700 1.0 Fe Fe15 1 0.66708700 0.58050200 0.33716000 1.0 Fe Fe16 1 0.08564400 0.66948000 0.67086300 1.0 Fe Fe17 1 0.25139300 0.49970500 0.67395500 1.0 Fe Fe18 1 0.24702700 0.00198800 0.83853100 1.0 Fe Fe19 1 0.08737800 0.16533100 0.83802300 1.0 Fe Fe20 1 0.41693300 0.83080000 0.83930200 1.0 Fe Fe21 1 0.99801200 0.75297300 0.16146900 1.0 Fe Fe22 1 0.00170900 0.25047500 0.33434000 1.0 Fe Fe23 1 0.16738300 0.08438700 0.32764500 1.0 N N24 1 0.87867400 0.12132600 0.00000000 1.0 N N25 1 0.95832800 0.54203300 0.99437200 1.0 N N26 1 0.78804000 0.21196000 0.50000000 1.0 N N27 1 0.70809900 0.79089900 0.50083200 1.0 N N28 1 0.54132900 0.45867100 0.00000000 1.0 N N29 1 0.45796700 0.04167200 0.00562800 1.0 N N30 1 0.29514300 0.70485700 0.50000000 1.0 N N31 1 0.12183200 0.87816800 0.50000000 1.0 N N32 1 0.20910100 0.29190100 0.49916800 1.0