# generated using pymatgen
data_Fe3CoN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78323000
_cell_length_b   3.78323000
_cell_length_c   14.77504000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3CoN
_chemical_formula_sum   'Fe12 Co4 N4'
_cell_volume   211.47262443
_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  0.00000000  0.00000000  0.00000000  1
  N  N1  1  0.50000000  0.50000000  0.50000000  1
  N  N2  1  0.00000000  0.00000000  0.74758000  1
  N  N3  1  0.50000000  0.50000000  0.24758000  1
  Co  Co4  1  0.00000000  0.00000000  0.12878000  1
  Co  Co5  1  0.50000000  0.50000000  0.62878000  1
  Co  Co6  1  0.00000000  0.00000000  0.87333000  1
  Co  Co7  1  0.50000000  0.50000000  0.37333000  1
  Fe  Fe8  1  0.00000000  0.50000000  0.99921000  1
  Fe  Fe9  1  0.50000000  0.00000000  0.99921000  1
  Fe  Fe10  1  0.50000000  0.00000000  0.49921000  1
  Fe  Fe11  1  0.00000000  0.50000000  0.49921000  1
  Fe  Fe12  1  0.00000000  0.00000000  0.37457000  1
  Fe  Fe13  1  0.50000000  0.50000000  0.87457000  1
  Fe  Fe14  1  0.00000000  0.00000000  0.61529000  1
  Fe  Fe15  1  0.50000000  0.50000000  0.11529000  1
  Fe  Fe16  1  0.00000000  0.50000000  0.24810000  1
  Fe  Fe17  1  0.50000000  0.00000000  0.24810000  1
  Fe  Fe18  1  0.50000000  0.00000000  0.74810000  1
  Fe  Fe19  1  0.00000000  0.50000000  0.74810000  1
