# generated using pymatgen
data_Cr8Fe3N8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.03977101
_cell_length_b   3.93618883
_cell_length_c   6.02882136
_cell_angle_alpha   90.00000000
_cell_angle_beta   109.36112777
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr8Fe3N8
_chemical_formula_sum   'Cr16 Fe6 N16'
_cell_volume   359.10741913
_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
  Cr  Cr0  1  0.96843500  0.00000000  0.73699500  1
  Cr  Cr1  1  0.53156500  0.50000000  0.26300500  1
  Cr  Cr2  1  0.65170900  0.00000000  0.46999000  1
  Cr  Cr3  1  0.84829100  0.50000000  0.53001000  1
  Cr  Cr4  1  0.59049800  0.00000000  0.95470400  1
  Cr  Cr5  1  0.90950200  0.50000000  0.04529600  1
  Cr  Cr6  1  0.71790600  0.50000000  0.83839400  1
  Cr  Cr7  1  0.78209400  0.00000000  0.16160600  1
  Cr  Cr8  1  0.46843500  0.50000000  0.73699500  1
  Cr  Cr9  1  0.03156500  0.00000000  0.26300500  1
  Cr  Cr10  1  0.15170900  0.50000000  0.46999000  1
  Cr  Cr11  1  0.34829100  0.00000000  0.53001000  1
  Cr  Cr12  1  0.09049800  0.50000000  0.95470400  1
  Cr  Cr13  1  0.40950200  0.00000000  0.04529600  1
  Cr  Cr14  1  0.21790600  0.00000000  0.83839400  1
  Cr  Cr15  1  0.28209400  0.50000000  0.16160600  1
  Fe  Fe16  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe17  1  0.81637500  0.00000000  0.78407200  1
  Fe  Fe18  1  0.68362500  0.50000000  0.21592800  1
  Fe  Fe19  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe20  1  0.31637500  0.50000000  0.78407200  1
  Fe  Fe21  1  0.18362500  0.00000000  0.21592800  1
  N  N22  1  0.89593000  0.00000000  0.09154700  1
  N  N23  1  0.60407000  0.50000000  0.90845300  1
  N  N24  1  0.84460000  0.00000000  0.51196900  1
  N  N25  1  0.65540000  0.50000000  0.48803100  1
  N  N26  1  0.70039200  0.00000000  0.81807900  1
  N  N27  1  0.79960800  0.50000000  0.18192100  1
  N  N28  1  0.96523400  0.50000000  0.76908100  1
  N  N29  1  0.53476600  0.00000000  0.23091900  1
  N  N30  1  0.39593000  0.50000000  0.09154700  1
  N  N31  1  0.10407000  0.00000000  0.90845300  1
  N  N32  1  0.34460000  0.50000000  0.51196900  1
  N  N33  1  0.15540000  0.00000000  0.48803100  1
  N  N34  1  0.20039200  0.50000000  0.81807900  1
  N  N35  1  0.29960800  0.00000000  0.18192100  1
  N  N36  1  0.46523400  0.00000000  0.76908100  1
  N  N37  1  0.03476600  0.50000000  0.23091900  1
