# generated using pymatgen
data_Fe4P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.90914855
_cell_length_b   9.86324763
_cell_length_c   44.91818980
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4P
_chemical_formula_sum   'Fe48 P12'
_cell_volume   1731.90615944
_cell_formula_units_Z   12
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  Fe1  1  0.448961  0.591637  0.342643  1
  Fe  Fe2  1  0.476752  0.935845  0.387131  1
  Fe  Fe3  1  1.033914  0.342404  0.403499  1
  Fe  Fe4  1  0.978162  0.011166  0.358075  1
  Fe  Fe5  1  0.464970  0.838947  0.336361  1
  Fe  Fe6  1  0.502069  0.203509  0.372191  1
  Fe  Fe7  1  0.965700  0.759056  0.365256  1
  Fe  Fe8  1  0.988320  0.390950  0.348519  1
  Fe  Fe9  1  0.545919  0.259959  0.430756  1
  Fe  Fe10  1  0.653364  0.601294  0.472214  1
  Fe  Fe11  1  0.058467  0.179732  0.462121  1
  Fe  Fe12  1  0.165889  0.671364  0.443591  1
  Fe  Fe13  1  0.610245  0.503073  0.425375  1
  Fe  Fe14  1  0.652406  0.845713  0.463640  1
  Fe  Fe15  1  0.110141  0.423295  0.454397  1
  Fe  Fe16  1  0.995983  0.101238  0.407229  1
  Fe  Fe17  1  0.578251  0.118434  0.489876  1
  Fe  Fe18  1  0.139675  0.534396  0.555291  1
  Fe  Fe19  1  0.115594  0.037939  0.523732  1
  Fe  Fe20  1  0.144789  0.553345  0.501225  1
  Fe  Fe21  1  0.610192  0.358091  0.481402  1
  Fe  Fe22  1  0.641998  0.693043  0.521975  1
  Fe  Fe23  1  0.114977  0.289923  0.515174  1
  Fe  Fe24  1  0.139552  0.790149  0.491892  1
  Fe  Fe25  1  0.638156  0.893840  0.568897  1
  Fe  Fe26  1  0.611317  0.163272  0.598999  1
  Fe  Fe27  1  0.181091  0.773757  0.598389  1
  Fe  Fe28  1  0.110300  0.241676  0.571125  1
  Fe  Fe29  1  0.616510  0.130077  0.546080  1
  Fe  Fe30  1  0.638958  0.633069  0.575433  1
  Fe  Fe31  1  0.123067  0.015374  0.583453  1
  Fe  Fe32  1  0.139976  0.787814  0.545593  1
  Fe  Fe33  1  0.458099  0.537817  0.635083  1
  Fe  Fe34  1  0.514754  0.006151  0.679654  1
  Fe  Fe35  1  0.900381  0.491725  0.680315  1
  Fe  Fe36  1  0.046023  0.081827  0.634545  1
  Fe  Fe37  1  0.554625  0.944396  0.624352  1
  Fe  Fe38  1  0.415284  0.369664  0.677692  1
  Fe  Fe39  1  1.023300  0.859948  0.662502  1
  Fe  Fe40  1  0.920992  0.356042  0.630835  1
  Fe  Fe41  1  0.491646  0.513202  0.722193  1
  Fe  Fe42  1  0.513126  0.734685  0.758450  1
  Fe  Fe43  1  0.980478  0.354771  0.725288  1
  Fe  Fe44  1  1.009230  0.974906  0.712076  1
  Fe  Fe45  1  0.529288  0.798338  0.706217  1
  Fe  Fe46  1  0.483810  0.196750  0.717319  1
  Fe  Fe47  1  1.011102  0.662152  0.728200  1
  Fe  Fe48  1  0.981536  0.199453  0.683575  1
  P  P49  1  0.502933  0.431278  0.379556  1
  P  P50  1  0.478523  0.071697  0.331388  1
  P  P51  1  0.491080  0.034835  0.439463  1
  P  P52  1  0.707042  0.730941  0.415918  1
  P  P53  1  0.626955  0.916467  0.515210  1
  P  P54  1  0.640934  0.468359  0.526306  1
  P  P55  1  0.706268  0.730246  0.620795  1
  P  P56  1  0.374601  0.408150  0.596096  1
  P  P57  1  0.308887  0.637743  0.677471  1
  P  P58  1  0.519350  0.184651  0.650027  1
  P  P59  1  0.493370  0.345172  0.758828  1
  P  P60  1  0.506718  -0.013253  0.741309  1
