# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.15910105
_cell_length_b   6.87599125
_cell_length_c   48.17130231
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   63.56960729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe48 P24'
_cell_volume   1826.81628375
_cell_formula_units_Z   24
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  0.233887  0.831345  0.309198  1
  Fe  Fe2  1  0.949786  0.251391  0.280541  1
  Fe  Fe3  1  0.698551  0.986581  0.298463  1
  Fe  Fe4  1  0.045676  0.590414  0.289942  1
  Fe  Fe5  1  0.526063  0.395916  0.303318  1
  Fe  Fe6  1  0.253990  0.196041  0.317640  1
  Fe  Fe7  1  0.116895  0.069606  0.365083  1
  Fe  Fe8  1  0.819114  0.506393  0.332412  1
  Fe  Fe9  1  0.573568  0.228022  0.353560  1
  Fe  Fe10  1  0.915052  0.836137  0.345062  1
  Fe  Fe11  1  0.415430  0.642920  0.359197  1
  Fe  Fe12  1  0.124970  0.437878  0.374717  1
  Fe  Fe13  1  0.993674  0.316600  0.420353  1
  Fe  Fe14  1  0.703714  0.746419  0.388706  1
  Fe  Fe15  1  0.449684  0.474978  0.408626  1
  Fe  Fe16  1  0.793037  0.084774  0.400563  1
  Fe  Fe17  1  0.291733  0.890834  0.414847  1
  Fe  Fe18  1  0.001932  0.684690  0.429997  1
  Fe  Fe19  1  0.870356  0.564094  0.475875  1
  Fe  Fe20  1  0.580646  0.993397  0.444097  1
  Fe  Fe21  1  0.325421  0.722464  0.464164  1
  Fe  Fe22  1  0.669716  0.332214  0.456032  1
  Fe  Fe23  1  0.168637  0.138107  0.470426  1
  Fe  Fe24  1  0.876917  0.933018  0.485448  1
  Fe  Fe25  1  0.743337  0.813081  0.531119  1
  Fe  Fe26  1  0.457834  0.240172  0.499974  1
  Fe  Fe27  1  0.201994  0.970041  0.519465  1
  Fe  Fe28  1  0.546681  0.579395  0.511556  1
  Fe  Fe29  1  0.046473  0.383823  0.526068  1
  Fe  Fe30  1  0.750227  0.182589  0.540985  1
  Fe  Fe31  1  0.657929  0.053002  0.587486  1
  Fe  Fe32  1  0.339073  0.490408  0.555122  1
  Fe  Fe33  1  0.052287  0.202943  0.576409  1
  Fe  Fe34  1  0.423366  0.829849  0.567002  1
  Fe  Fe35  1  0.923263  0.630414  0.581710  1
  Fe  Fe36  1  0.624619  0.432055  0.596752  1
  Fe  Fe37  1  0.552019  0.290044  0.644910  1
  Fe  Fe38  1  0.191869  0.774839  0.607141  1
  Fe  Fe39  1  0.919016  0.448768  0.633150  1
  Fe  Fe40  1  0.297367  0.081094  0.622143  1
  Fe  Fe41  1  0.797745  0.879980  0.637152  1
  Fe  Fe42  1  0.503313  0.676030  0.652594  1
  Fe  Fe43  1  0.353573  0.562638  0.695737  1
  Fe  Fe44  1  0.067441  0.999448  0.665647  1
  Fe  Fe45  1  0.835802  0.723759  0.684715  1
  Fe  Fe46  1  0.181445  0.323221  0.677542  1
  Fe  Fe47  1  0.664750  0.126700  0.692318  1
  Fe  Fe48  1  0.391122  0.918241  0.706617  1
  P  P49  1  0.905038  0.138025  0.322606  1
  P  P50  1  0.640609  0.647128  0.283441  1
  P  P51  1  0.212857  0.513992  0.331921  1
  P  P52  1  0.778714  0.389211  0.377777  1
  P  P53  1  0.524557  0.889531  0.341097  1
  P  P54  1  0.090114  0.763695  0.387301  1
  P  P55  1  0.654262  0.635998  0.433603  1
  P  P56  1  0.403259  0.137503  0.396552  1
  P  P57  1  0.966547  0.010872  0.442876  1
  P  P58  1  0.530538  0.884193  0.489172  1
  P  P59  1  0.280048  0.384628  0.452190  1
  P  P60  1  0.843287  0.258524  0.498383  1
  P  P61  1  0.403078  0.132290  0.545597  1
  P  P62  1  0.155993  0.631949  0.507585  1
  P  P63  1  0.721454  0.508087  0.553906  1
  P  P64  1  0.280691  0.379697  0.600890  1
  P  P65  1  0.031090  0.877751  0.562124  1
  P  P66  1  0.594714  0.756877  0.609405  1
  P  P67  1  0.160487  0.629339  0.654016  1
  P  P68  1  0.906849  0.131105  0.619777  1
  P  P69  1  0.463000  0.005572  0.664213  1
  P  P70  1  0.025934  0.891732  0.714933  1
  P  P71  1  0.789589  0.385671  0.680628  1
  P  P72  1  0.328954  0.273543  0.723428  1
