# generated using pymatgen
data_Fe2Ni3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58484080
_cell_length_b   6.92442226
_cell_length_c   5.51168370
_cell_angle_alpha   90.00000071
_cell_angle_beta   93.06786932
_cell_angle_gamma   128.31102793
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2Ni3N4
_chemical_formula_sum   'Fe4 Ni6 N8'
_cell_volume   166.85758689
_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  0.60617900  0.16819800  0.64735100  1.0
  Fe  Fe1  1  0.39382100  0.56201900  0.85264900  1.0
  Fe  Fe2  1  0.39382100  0.83180200  0.35264900  1.0
  Fe  Fe3  1  0.60617900  0.43798100  0.14735100  1.0
  Ni  Ni4  1  0.22988600  0.00429500  0.01143200  1.0
  Ni  Ni5  1  0.77011400  0.77440800  0.48856800  1.0
  Ni  Ni6  1  0.77011400  0.99570500  0.98856800  1.0
  Ni  Ni7  1  0.22988600  0.22559200  0.51143200  1.0
  Ni  Ni8  1  0.00000000  0.63864300  0.75000000  1.0
  Ni  Ni9  1  0.00000000  0.36135700  0.25000000  1.0
  N  N10  1  0.20117700  0.92122800  0.52965200  1.0
  N  N11  1  0.79882300  0.72005100  0.97034800  1.0
  N  N12  1  0.79882300  0.07877200  0.47034800  1.0
  N  N13  1  0.20117700  0.27994900  0.02965200  1.0
  N  N14  1  0.67415700  0.24426900  0.97689100  1.0
  N  N15  1  0.32584300  0.57011200  0.52310900  1.0
  N  N16  1  0.32584300  0.75573100  0.02310900  1.0
  N  N17  1  0.67415700  0.42988800  0.47689100  1.0