# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06604328
_cell_length_b   10.54976288
_cell_length_c   50.05178566
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe42 P21'
_cell_volume   1618.97653952
_cell_formula_units_Z   21
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  1.002226  0.530771  0.312925  1
  Fe  Fe2  1  1.002226  0.913878  0.312015  1
  Fe  Fe3  1  1.002226  0.212323  0.299703  1
  Fe  Fe4  1  0.502226  0.722559  0.318552  1
  Fe  Fe5  1  0.502226  0.088499  0.330809  1
  Fe  Fe6  1  0.502226  0.351084  0.330117  1
  Fe  Fe7  1  1.002226  0.029297  0.374691  1
  Fe  Fe8  1  1.002226  0.424658  0.370565  1
  Fe  Fe9  1  1.002226  0.718034  0.359952  1
  Fe  Fe10  1  0.502226  0.224937  0.381501  1
  Fe  Fe11  1  0.502226  0.588837  0.394375  1
  Fe  Fe12  1  0.502226  0.852876  0.393955  1
  Fe  Fe13  1  1.002226  0.530410  0.437692  1
  Fe  Fe14  1  1.002226  0.925324  0.433125  1
  Fe  Fe15  1  1.002226  0.211005  0.424126  1
  Fe  Fe16  1  0.502226  0.724467  0.443649  1
  Fe  Fe17  1  0.502226  0.089111  0.456870  1
  Fe  Fe18  1  0.502226  0.352502  0.455771  1
  Fe  Fe19  1  1.002226  0.029706  0.499844  1
  Fe  Fe20  1  1.002226  0.425666  0.495722  1
  Fe  Fe21  1  1.002226  0.711068  0.486321  1
  Fe  Fe22  1  0.502226  0.223736  0.506368  1
  Fe  Fe23  1  0.502226  0.589141  0.519334  1
  Fe  Fe24  1  0.502226  0.852145  0.518075  1
  Fe  Fe25  1  1.002226  0.528352  0.562284  1
  Fe  Fe26  1  1.002226  0.925826  0.559397  1
  Fe  Fe27  1  1.002226  0.210331  0.549042  1
  Fe  Fe28  1  0.502226  0.720396  0.568450  1
  Fe  Fe29  1  0.502226  0.089633  0.581270  1
  Fe  Fe30  1  0.502226  0.350812  0.580503  1
  Fe  Fe31  1  1.002226  0.011289  0.619361  1
  Fe  Fe32  1  1.002226  0.427185  0.620258  1
  Fe  Fe33  1  1.002226  0.715439  0.612072  1
  Fe  Fe34  1  0.502226  0.218886  0.631163  1
  Fe  Fe35  1  0.502226  0.590694  0.644073  1
  Fe  Fe36  1  0.502226  0.848011  0.643394  1
  Fe  Fe37  1  1.002226  0.513544  0.686914  1
  Fe  Fe38  1  1.002226  0.925776  0.686832  1
  Fe  Fe39  1  1.002226  0.218777  0.675916  1
  Fe  Fe40  1  0.502226  0.719846  0.696504  1
  Fe  Fe41  1  0.502226  0.097805  0.706607  1
  Fe  Fe42  1  0.502226  0.340078  0.706659  1
  P  P43  1  0.502226  0.043975  0.284713  1
  P  P44  1  0.502226  0.392750  0.285613  1
  P  P45  1  1.002226  0.720182  0.284404  1
  P  P46  1  0.502226  0.554778  0.348887  1
  P  P47  1  0.502226  0.890859  0.349497  1
  P  P48  1  1.002226  0.221026  0.348785  1
  P  P49  1  0.502226  0.055632  0.410619  1
  P  P50  1  0.502226  0.389336  0.410672  1
  P  P51  1  0.002226  0.721225  0.410607  1
  P  P52  1  0.502226  0.554901  0.473097  1
  P  P53  1  0.502226  0.888967  0.472837  1
  P  P54  1  1.002226  0.222146  0.473517  1
  P  P55  1  0.502226  0.053058  0.535376  1
  P  P56  1  0.502226  0.388458  0.535296  1
  P  P57  1  1.002226  0.722707  0.535908  1
  P  P58  1  0.502226  0.554157  0.597913  1
  P  P59  1  0.502226  0.883111  0.596974  1
  P  P60  1  1.002226  0.221488  0.598827  1
  P  P61  1  0.502226  0.049591  0.658887  1
  P  P62  1  0.502226  0.388193  0.659151  1
  P  P63  1  1.002226  0.720220  0.662313  1
