# generated using pymatgen
data_Fe7N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.98949000
_cell_length_b   3.91100000
_cell_length_c   3.91800000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe7N
_chemical_formula_sum   'Fe28 N4'
_cell_volume   352.27480614
_cell_formula_units_Z   4
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
  N  N0  1  0.07994000  0.00000000  0.00000000  1
  N  N1  1  0.92006000  0.00000000  0.00000000  1
  N  N2  1  0.57994000  0.50000000  0.00000000  1
  N  N3  1  0.42006000  0.50000000  0.00000000  1
  Fe  Fe4  1  0.71764000  0.00000000  0.00000000  1
  Fe  Fe5  1  0.28236000  0.00000000  0.00000000  1
  Fe  Fe6  1  0.21764000  0.50000000  0.00000000  1
  Fe  Fe7  1  0.78236000  0.50000000  0.00000000  1
  Fe  Fe8  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe9  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe10  1  0.64980000  0.00000000  0.50000000  1
  Fe  Fe11  1  0.35020000  0.00000000  0.50000000  1
  Fe  Fe12  1  0.14980000  0.50000000  0.50000000  1
  Fe  Fe13  1  0.85020000  0.50000000  0.50000000  1
  Fe  Fe14  1  0.78196000  0.00000000  0.50000000  1
  Fe  Fe15  1  0.21804000  0.00000000  0.50000000  1
  Fe  Fe16  1  0.28196000  0.50000000  0.50000000  1
  Fe  Fe17  1  0.71804000  0.50000000  0.50000000  1
  Fe  Fe18  1  0.42064000  0.00000000  0.00000000  1
  Fe  Fe19  1  0.57936000  0.00000000  0.00000000  1
  Fe  Fe20  1  0.92064000  0.50000000  0.00000000  1
  Fe  Fe21  1  0.07936000  0.50000000  0.00000000  1
  Fe  Fe22  1  0.15884000  0.00000000  0.00000000  1
  Fe  Fe23  1  0.84116000  0.00000000  0.00000000  1
  Fe  Fe24  1  0.65884000  0.50000000  0.00000000  1
  Fe  Fe25  1  0.34116000  0.50000000  0.00000000  1
  Fe  Fe26  1  0.92080000  0.00000000  0.50000000  1
  Fe  Fe27  1  0.07920000  0.00000000  0.50000000  1
  Fe  Fe28  1  0.42080000  0.50000000  0.50000000  1
  Fe  Fe29  1  0.57920000  0.50000000  0.50000000  1
  Fe  Fe30  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe31  1  0.50000000  0.50000000  0.00000000  1
