# generated using pymatgen
data_Fe3C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09698935
_cell_length_b   2.65107591
_cell_length_c   14.59244192
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.36116756
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3C
_chemical_formula_sum   'Fe24 C8'
_cell_volume   304.75898268
_cell_formula_units_Z   8
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  0.23650200  0.50000000  0.21500800  1
  Fe  Fe1  1  0.76349800  0.50000000  0.78499200  1
  Fe  Fe2  1  0.54052400  0.50000000  0.29282200  1
  Fe  Fe3  1  0.45947600  0.50000000  0.70717800  1
  Fe  Fe4  1  0.61943800  0.50000000  0.46669700  1
  Fe  Fe5  1  0.38056200  0.50000000  0.53330300  1
  Fe  Fe6  1  0.35215700  0.00000000  0.37589900  1
  Fe  Fe7  1  0.64784300  0.00000000  0.62410100  1
  Fe  Fe8  1  0.46154900  0.50000000  0.12082400  1
  Fe  Fe9  1  0.53845100  0.50000000  0.87917600  1
  Fe  Fe10  1  0.15078900  0.50000000  0.03494900  1
  Fe  Fe11  1  0.84921100  0.50000000  0.96505100  1
  Fe  Fe12  1  0.73650200  0.00000000  0.21500800  1
  Fe  Fe13  1  0.26349800  0.00000000  0.78499200  1
  Fe  Fe14  1  0.04052400  0.00000000  0.29282200  1
  Fe  Fe15  1  0.95947600  0.00000000  0.70717800  1
  Fe  Fe16  1  0.11943800  0.00000000  0.46669700  1
  Fe  Fe17  1  0.88056200  0.00000000  0.53330300  1
  Fe  Fe18  1  0.85215700  0.50000000  0.37589900  1
  Fe  Fe19  1  0.14784300  0.50000000  0.62410100  1
  Fe  Fe20  1  0.96154900  0.00000000  0.12082400  1
  Fe  Fe21  1  0.03845100  0.00000000  0.87917600  1
  Fe  Fe22  1  0.65078900  0.00000000  0.03494900  1
  Fe  Fe23  1  0.34921100  0.00000000  0.96505100  1
  C  C24  1  0.27466100  0.00000000  0.12015300  1
  C  C25  1  0.72533900  0.00000000  0.87984700  1
  C  C26  1  0.66697800  0.00000000  0.37500500  1
  C  C27  1  0.33302200  0.00000000  0.62499500  1
  C  C28  1  0.77466100  0.50000000  0.12015300  1
  C  C29  1  0.22533900  0.50000000  0.87984700  1
  C  C30  1  0.16697800  0.50000000  0.37500500  1
  C  C31  1  0.83302200  0.50000000  0.62499500  1
