# generated using pymatgen
data_Fe3Mo3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86598971
_cell_length_b   7.86598791
_cell_length_c   7.86599114
_cell_angle_alpha   60.00013869
_cell_angle_beta   60.00010277
_cell_angle_gamma   60.00021375
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Mo3N
_chemical_formula_sum   'Fe12 Mo12 N4'
_cell_volume   344.14906807
_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
  Fe  Fe0  1  0.12501165  0.62499544  0.62500061  1.0
  Fe  Fe1  1  0.62499817  0.12501294  0.62499818  1.0
  Fe  Fe2  1  0.62500227  0.62499723  0.12501032  1.0
  Fe  Fe3  1  0.62499740  0.62499275  0.62499408  1.0
  Fe  Fe4  1  0.74324108  0.41892193  0.41892111  1.0
  Fe  Fe5  1  0.41892185  0.74323895  0.41892230  1.0
  Fe  Fe6  1  0.41892115  0.41892227  0.74324023  1.0
  Fe  Fe7  1  0.41891497  0.41891583  0.41891535  1.0
  Fe  Fe8  1  0.50675574  0.83107803  0.83107816  1.0
  Fe  Fe9  1  0.83107847  0.50675373  0.83107865  1.0
  Fe  Fe10  1  0.83107772  0.83107749  0.50675832  1.0
  Fe  Fe11  1  0.83108946  0.83109035  0.83108785  1.0
  Mo  Mo12  1  0.80499985  0.80500267  0.19500208  1.0
  Mo  Mo13  1  0.19500511  0.19500584  0.80499512  1.0
  Mo  Mo14  1  0.80500054  0.19500208  0.80500173  1.0
  Mo  Mo15  1  0.19500629  0.80499461  0.19500732  1.0
  Mo  Mo16  1  0.19500156  0.80500212  0.80500048  1.0
  Mo  Mo17  1  0.80499304  0.19500670  0.19500709  1.0
  Mo  Mo18  1  0.44499291  0.44499500  0.05500574  1.0
  Mo  Mo19  1  0.05499879  0.05499848  0.44499371  1.0
  Mo  Mo20  1  0.44499204  0.05500747  0.44499125  1.0
  Mo  Mo21  1  0.05499905  0.44499450  0.05499936  1.0
  Mo  Mo22  1  0.05500727  0.44499370  0.44499083  1.0
  Mo  Mo23  1  0.44499335  0.05499901  0.05499970  1.0
  N  N24  1  0.62499815  0.12500160  0.12500155  1.0
  N  N25  1  0.12500146  0.62499945  0.12500113  1.0
  N  N26  1  0.12500159  0.12500112  0.62499772  1.0
  N  N27  1  0.12499909  0.12499872  0.12500007  1.0