# generated using pymatgen
data_Fe4CoN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84796000
_cell_length_b   3.84593000
_cell_length_c   8.93411000
_cell_angle_alpha   90.00000000
_cell_angle_beta   102.11132000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4CoN
_chemical_formula_sum   'Fe8 Co2 N2'
_cell_volume   129.27287374
_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
  N  N0  1  0.00000000  0.00000000  0.00000000  1
  N  N1  1  0.20930000  0.00000000  0.42122000  1
  Co  Co2  1  0.31771000  0.00000000  0.63371000  1
  Co  Co3  1  0.10394000  0.00000000  0.21073000  1
  Fe  Fe4  1  0.60475000  0.50000000  0.21089000  1
  Fe  Fe5  1  0.00002000  0.50000000  0.00248000  1
  Fe  Fe6  1  0.21046000  0.50000000  0.42100000  1
  Fe  Fe7  1  0.40055000  0.50000000  0.80567000  1
  Fe  Fe8  1  0.70970000  0.00000000  0.42133000  1
  Fe  Fe9  1  0.50208000  0.00000000  0.00478000  1
  Fe  Fe10  1  0.89048000  0.00000000  0.78659000  1
  Fe  Fe11  1  0.80646000  0.50000000  0.61334000  1
