# generated using pymatgen
data_Fe2Ni9N8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.55628105
_cell_length_b   3.39808029
_cell_length_c   7.25922634
_cell_angle_alpha   90.00000000
_cell_angle_beta   107.75554294
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2Ni9N8
_chemical_formula_sum   'Fe4 Ni18 N16'
_cell_volume   435.93218639
_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
  Fe  Fe0  1  0.81522000  0.00000000  0.79898000  1
  Fe  Fe1  1  0.68478000  0.50000000  0.20102000  1
  Fe  Fe2  1  0.31522000  0.50000000  0.79898000  1
  Fe  Fe3  1  0.18478000  0.00000000  0.20102000  1
  Ni  Ni4  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni5  1  0.97525500  0.00000000  0.15574800  1
  Ni  Ni6  1  0.52474500  0.50000000  0.84425200  1
  Ni  Ni7  1  0.64198400  0.00000000  0.86531400  1
  Ni  Ni8  1  0.85801600  0.50000000  0.13468600  1
  Ni  Ni9  1  0.60093100  0.00000000  0.31529800  1
  Ni  Ni10  1  0.89906900  0.50000000  0.68470200  1
  Ni  Ni11  1  0.69302900  0.50000000  0.65217500  1
  Ni  Ni12  1  0.80697100  0.00000000  0.34782500  1
  Ni  Ni13  1  0.50000000  0.00000000  0.50000000  1
  Ni  Ni14  1  0.47525500  0.50000000  0.15574800  1
  Ni  Ni15  1  0.02474500  0.00000000  0.84425200  1
  Ni  Ni16  1  0.14198400  0.50000000  0.86531400  1
  Ni  Ni17  1  0.35801600  0.00000000  0.13468600  1
  Ni  Ni18  1  0.10093100  0.50000000  0.31529800  1
  Ni  Ni19  1  0.39906900  0.00000000  0.68470200  1
  Ni  Ni20  1  0.19302900  0.00000000  0.65217500  1
  Ni  Ni21  1  0.30697100  0.50000000  0.34782500  1
  N  N22  1  0.85683200  0.00000000  0.60933000  1
  N  N23  1  0.64316800  0.50000000  0.39067000  1
  N  N24  1  0.87062800  0.00000000  0.04548500  1
  N  N25  1  0.62937200  0.50000000  0.95451500  1
  N  N26  1  0.71741700  0.00000000  0.74788900  1
  N  N27  1  0.78258300  0.50000000  0.25211100  1
  N  N28  1  0.99495800  0.50000000  0.24978700  1
  N  N29  1  0.50504200  0.00000000  0.75021300  1
  N  N30  1  0.35683200  0.50000000  0.60933000  1
  N  N31  1  0.14316800  0.00000000  0.39067000  1
  N  N32  1  0.37062800  0.50000000  0.04548500  1
  N  N33  1  0.12937200  0.00000000  0.95451500  1
  N  N34  1  0.21741700  0.50000000  0.74788900  1
  N  N35  1  0.28258300  0.00000000  0.25211100  1
  N  N36  1  0.49495800  0.00000000  0.24978700  1
  N  N37  1  0.00504200  0.50000000  0.75021300  1
