# generated using pymatgen data_Ho2Fe17N3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.38893000 _cell_length_b 8.63502834 _cell_length_c 8.63502834 _cell_angle_alpha 120.00000259 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho2Fe17N3 _chemical_formula_sum 'Ho4 Fe34 N6' _cell_volume 541.70734615 _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 Ho Ho0 1 0.75000000 0.66666700 0.33333300 1.0 Ho Ho1 1 0.25000000 0.33333300 0.66666700 1.0 Ho Ho2 1 0.75000000 0.00000000 0.00000000 1.0 Ho Ho3 1 0.25000000 0.00000000 0.00000000 1.0 Fe Fe4 1 0.75000000 0.61860000 0.67183100 1.0 Fe Fe5 1 0.25000000 0.38140000 0.32816900 1.0 Fe Fe6 1 0.75000000 0.05323100 0.38140000 1.0 Fe Fe7 1 0.25000000 0.94676900 0.32816900 1.0 Fe Fe8 1 0.25000000 0.94676900 0.61860000 1.0 Fe Fe9 1 0.75000000 0.05323100 0.67183100 1.0 Fe Fe10 1 0.75000000 0.32816900 0.94676900 1.0 Fe Fe11 1 0.25000000 0.67183100 0.61860000 1.0 Fe Fe12 1 0.25000000 0.67183100 0.05323100 1.0 Fe Fe13 1 0.75000000 0.32816900 0.38140000 1.0 Fe Fe14 1 0.25000000 0.38140000 0.05323100 1.0 Fe Fe15 1 0.75000000 0.61860000 0.94676900 1.0 Fe Fe16 1 0.39296700 0.66666700 0.33333300 1.0 Fe Fe17 1 0.60703300 0.33333300 0.66666700 1.0 Fe Fe18 1 0.89296700 0.33333300 0.66666700 1.0 Fe Fe19 1 0.10703300 0.66666700 0.33333300 1.0 Fe Fe20 1 0.97918100 0.83099700 0.16900300 1.0 Fe Fe21 1 0.02081900 0.16900300 0.83099700 1.0 Fe Fe22 1 0.97918100 0.33800500 0.16900300 1.0 Fe Fe23 1 0.47918100 0.16900300 0.83099700 1.0 Fe Fe24 1 0.02081900 0.66199500 0.83099700 1.0 Fe Fe25 1 0.52081900 0.83099700 0.16900300 1.0 Fe Fe26 1 0.97918100 0.83099700 0.66199500 1.0 Fe Fe27 1 0.47918100 0.66199500 0.83099700 1.0 Fe Fe28 1 0.02081900 0.16900300 0.33800500 1.0 Fe Fe29 1 0.52081900 0.33800500 0.16900300 1.0 Fe Fe30 1 0.47918100 0.16900300 0.33800500 1.0 Fe Fe31 1 0.52081900 0.83099700 0.66199500 1.0 Fe Fe32 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe33 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe34 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe35 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe36 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe37 1 0.50000000 0.50000000 0.00000000 1.0 N N38 1 0.75000000 0.83601800 0.16398200 1.0 N N39 1 0.25000000 0.16398200 0.83601800 1.0 N N40 1 0.75000000 0.32796300 0.16398200 1.0 N N41 1 0.25000000 0.67203700 0.83601800 1.0 N N42 1 0.75000000 0.83601800 0.67203700 1.0 N N43 1 0.25000000 0.16398200 0.32796300 1.0