# generated using pymatgen
data_Nd2Fe17N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55316786
_cell_length_b   6.55316786
_cell_length_c   6.55316748
_cell_angle_alpha   83.61919053
_cell_angle_beta   83.61919053
_cell_angle_gamma   83.61918533
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Fe17N3
_chemical_formula_sum   'Nd2 Fe17 N3'
_cell_volume   276.54963295
_cell_formula_units_Z   1
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
  Nd  Nd0  1  0.65556800  0.65556800  0.65556800  1.0
  Nd  Nd1  1  0.34443200  0.34443200  0.34443200  1.0
  Fe  Fe2  1  0.90618400  0.90618400  0.90618400  1.0
  Fe  Fe3  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe4  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe5  1  0.50000000  0.00000000  0.00000000  1.0
  Fe  Fe6  1  0.71739000  0.28261000  0.00000000  1.0
  Fe  Fe7  1  0.28261000  0.00000000  0.71739000  1.0
  Fe  Fe8  1  0.00000000  0.71739000  0.28261000  1.0
  Fe  Fe9  1  0.28261000  0.71739000  0.00000000  1.0
  Fe  Fe10  1  0.71739000  0.00000000  0.28261000  1.0
  Fe  Fe11  1  0.00000000  0.28261000  0.71739000  1.0
  Fe  Fe12  1  0.14046900  0.65928500  0.65928500  1.0
  Fe  Fe13  1  0.65928500  0.65928500  0.14046900  1.0
  Fe  Fe14  1  0.65928500  0.14046900  0.65928500  1.0
  Fe  Fe15  1  0.34071500  0.85953100  0.34071500  1.0
  Fe  Fe16  1  0.85953100  0.34071500  0.34071500  1.0
  Fe  Fe17  1  0.34071500  0.34071500  0.85953100  1.0
  Fe  Fe18  1  0.09381600  0.09381600  0.09381600  1.0
  N  N19  1  0.00000000  0.50000000  0.50000000  1.0
  N  N20  1  0.50000000  0.00000000  0.50000000  1.0
  N  N21  1  0.50000000  0.50000000  0.00000000  1.0