# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06720743
_cell_length_b   26.78790302
_cell_length_c   48.23751302
_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   'Fe108 P54'
_cell_volume   3963.3896756
_cell_formula_units_Z   54
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  1.002035  0.187001  0.272302  1
  Fe  Fe2  1  1.002035  0.969765  0.319223  1
  Fe  Fe3  1  1.002035  0.581298  0.295160  1
  Fe  Fe4  1  1.002035  0.127732  0.326332  1
  Fe  Fe5  1  1.002035  0.730302  0.306950  1
  Fe  Fe6  1  1.002035  0.337226  0.280014  1
  Fe  Fe7  1  1.002035  0.249661  0.323069  1
  Fe  Fe8  1  1.002035  0.843763  0.300260  1
  Fe  Fe9  1  1.002035  0.441437  0.274093  1
  Fe  Fe10  1  0.502035  0.261312  0.278628  1
  Fe  Fe11  1  0.502035  0.047324  0.331454  1
  Fe  Fe12  1  0.502035  0.653320  0.307422  1
  Fe  Fe13  1  0.502035  0.398965  0.305577  1
  Fe  Fe14  1  0.502035  1.001184  0.278043  1
  Fe  Fe15  1  0.502035  0.793013  0.329965  1
  Fe  Fe16  1  0.502035  0.111940  0.281901  1
  Fe  Fe17  1  0.502035  0.896992  0.334499  1
  Fe  Fe18  1  0.502035  0.505037  0.302722  1
  Fe  Fe19  1  1.002035  0.369079  0.347994  1
  Fe  Fe20  1  1.002035  0.156719  0.398204  1
  Fe  Fe21  1  0.002035  0.760975  0.371666  1
  Fe  Fe22  1  1.002035  0.313267  0.404102  1
  Fe  Fe23  1  1.002035  0.919161  0.377785  1
  Fe  Fe24  1  1.002035  0.524533  0.351817  1
  Fe  Fe25  1  1.002035  0.428830  0.402137  1
  Fe  Fe26  1  1.002035  0.032596  0.375087  1
  Fe  Fe27  1  1.002035  0.639818  0.349099  1
  Fe  Fe28  1  0.502035  0.443618  0.358584  1
  Fe  Fe29  1  0.502035  0.232092  0.409316  1
  Fe  Fe30  1  0.502035  0.837597  0.384387  1
  Fe  Fe31  1  0.502035  0.583145  0.380860  1
  Fe  Fe32  1  0.502035  0.188327  0.355898  1
  Fe  Fe33  1  0.502035  0.978622  0.405984  1
  Fe  Fe34  1  0.502035  0.294350  0.362752  1
  Fe  Fe35  1  0.502035  0.082583  0.411918  1
  Fe  Fe36  1  0.502035  0.687237  0.387967  1
  Fe  Fe37  1  1.002035  0.551169  0.424017  1
  Fe  Fe38  1  1.002035  0.340785  0.475377  1
  Fe  Fe39  1  1.002035  0.946495  0.449015  1
  Fe  Fe40  1  1.002035  0.497663  0.480769  1
  Fe  Fe41  1  1.002035  0.102891  0.455129  1
  Fe  Fe42  1  1.002035  0.708261  0.429083  1
  Fe  Fe43  1  1.002035  0.612389  0.478348  1
  Fe  Fe44  1  1.002035  0.217130  0.452737  1
  Fe  Fe45  1  1.002035  0.823162  0.427343  1
  Fe  Fe46  1  0.502035  0.627005  0.435150  1
  Fe  Fe47  1  0.502035  0.415748  0.486775  1
  Fe  Fe48  1  0.502035  0.022267  0.460699  1
  Fe  Fe49  1  0.502035  0.767720  0.457864  1
  Fe  Fe50  1  0.502035  0.372552  0.433070  1
  Fe  Fe51  1  0.502035  0.162517  0.483885  1
  Fe  Fe52  1  0.502035  0.477584  0.438464  1
  Fe  Fe53  1  0.502035  0.266774  0.489505  1
  Fe  Fe54  1  0.502035  0.872599  0.463406  1
  Fe  Fe55  1  1.002035  0.735571  0.500361  1
  Fe  Fe56  1  1.002035  0.524765  0.551701  1
  Fe  Fe57  1  1.002035  0.130700  0.527021  1
  Fe  Fe58  1  1.002035  0.681659  0.557101  1
  Fe  Fe59  1  1.002035  0.286686  0.533996  1
  Fe  Fe60  1  1.002035  0.892985  0.505962  1
  Fe  Fe61  1  1.002035  0.796564  0.554718  1
  Fe  Fe62  1  1.002035  0.401132  0.530019  1
  Fe  Fe63  1  1.002035  0.007448  0.503951  1
  Fe  Fe64  1  0.502035  0.811171  0.511733  1
  Fe  Fe65  1  0.502035  0.600019  0.563162  1
  Fe  Fe66  1  0.502035  0.204310  0.537731  1
  Fe  Fe67  1  0.502035  0.952442  0.534458  1
  Fe  Fe68  1  0.502035  0.556897  0.509240  1
  Fe  Fe69  1  0.502035  0.346984  0.560438  1
  Fe  Fe70  1  0.502035  0.661521  0.514654  1
  Fe  Fe71  1  0.502035  0.450742  0.566014  1
  Fe  Fe72  1  0.502035  0.056840  0.540815  1
  Fe  Fe73  1  1.002035  0.919619  0.576619  1
  Fe  Fe74  1  1.002035  0.708356  0.628064  1
  Fe  Fe75  1  1.002035  0.309477  0.597345  1
  Fe  Fe76  1  1.002035  0.865732  0.632308  1
  Fe  Fe77  1  1.002035  0.472050  0.609682  1
  Fe  Fe78  1  1.002035  0.075951  0.584460  1
  Fe  Fe79  1  1.002035  0.981491  0.631806  1
  Fe  Fe80  1  1.002035  0.585355  0.606785  1
  Fe  Fe81  1  1.002035  0.192911  0.581763  1
  Fe  Fe82  1  0.502035  0.996773  0.589331  1
  Fe  Fe83  1  0.502035  0.783243  0.638915  1
  Fe  Fe84  1  0.502035  0.387183  0.614554  1
  Fe  Fe85  1  0.502035  0.135963  0.613025  1
  Fe  Fe86  1  0.502035  0.740606  0.585541  1
  Fe  Fe87  1  0.502035  0.532146  0.637149  1
  Fe  Fe88  1  0.502035  0.845499  0.590830  1
  Fe  Fe89  1  0.502035  0.634702  0.642800  1
  Fe  Fe90  1  0.502035  0.240332  0.618345  1
  Fe  Fe91  1  1.002035  0.104437  0.658074  1
  Fe  Fe92  1  1.002035  0.885023  0.703647  1
  Fe  Fe93  1  1.002035  0.493377  0.675429  1
  Fe  Fe94  1  1.002035  0.040222  0.712078  1
  Fe  Fe95  1  1.002035  0.657245  0.686526  1
  Fe  Fe96  1  1.002035  0.255992  0.665129  1
  Fe  Fe97  1  1.002035  0.173512  0.707866  1
  Fe  Fe98  1  1.002035  0.772020  0.684312  1
  Fe  Fe99  1  1.002035  0.381339  0.660365  1
  Fe  Fe100  1  0.502035  0.179787  0.667709  1
  Fe  Fe101  1  0.502035  0.961216  0.718435  1
  Fe  Fe102  1  0.502035  0.572155  0.691863  1
  Fe  Fe103  1  0.502035  0.324360  0.686768  1
  Fe  Fe104  1  0.502035  0.924029  0.661087  1
  Fe  Fe105  1  0.502035  0.721289  0.715117  1
  Fe  Fe106  1  0.502035  0.028881  0.669850  1
  Fe  Fe107  1  0.502035  0.814217  0.719863  1
  Fe  Fe108  1  0.502035  0.423748  0.693486  1
  P  P109  1  0.502035  0.187061  0.309040  1
  P  P110  1  0.502035  0.784551  0.280218  1
  P  P111  1  0.502035  0.577982  0.332473  1
  P  P112  1  0.502035  0.318417  0.318152  1
  P  P113  1  0.502035  0.916319  0.288846  1
  P  P114  1  0.502035  0.710950  0.343547  1
  P  P115  1  1.002035  0.451505  0.325127  1
  P  P116  1  1.002035  0.053503  0.297562  1
  P  P117  1  1.002035  0.664249  0.272185  1
  P  P118  1  0.502035  0.370520  0.385053  1
  P  P119  1  0.502035  0.973830  0.357059  1
  P  P120  1  0.502035  0.764585  0.409551  1
  P  P121  1  0.502035  0.501542  0.392941  1
  P  P122  1  0.502035  0.105892  0.366520  1
  P  P123  1  0.502035  0.896794  0.417962  1
  P  P124  1  0.002035  0.631711  0.401024  1
  P  P125  1  1.002035  0.237907  0.374981  1
  P  P126  1  0.002035  0.842928  0.350807  1
  P  P127  1  0.502035  0.553853  0.460944  1
  P  P128  1  0.502035  0.158716  0.435243  1
  P  P129  1  0.502035  0.948948  0.486084  1
  P  P130  1  0.502035  0.685609  0.469234  1
  P  P131  1  0.502035  0.290268  0.444017  1
  P  P132  1  0.502035  0.080654  0.495294  1
  P  P133  1  0.002035  0.817153  0.477905  1
  P  P134  1  0.002035  0.422087  0.452873  1
  P  P135  1  1.002035  0.027477  0.426549  1
  P  P136  1  0.502035  0.737757  0.537346  1
  P  P137  1  0.502035  0.342109  0.512454  1
  P  P138  1  0.502035  0.132346  0.564571  1
  P  P139  1  0.502035  0.869974  0.545659  1
  P  P140  1  0.502035  0.474594  0.520570  1
  P  P141  1  0.502035  0.262008  0.571492  1
  P  P142  1  1.002035  0.001301  0.555058  1
  P  P143  1  0.002035  0.606195  0.529279  1
  P  P144  1  1.002035  0.211871  0.504040  1
  P  P145  1  0.502035  0.922548  0.613386  1
  P  P146  1  0.502035  0.526792  0.588643  1
  P  P147  1  0.502035  0.315573  0.639523  1
  P  P148  1  0.502035  0.054980  0.625087  1
  P  P149  1  0.502035  0.658484  0.597052  1
  P  P150  1  0.502035  0.448512  0.646802  1
  P  P151  1  1.002035  0.185060  0.632879  1
  P  P152  1  1.002035  0.789922  0.605424  1
  P  P153  1  1.002035  0.396182  0.581312  1
  P  P154  1  0.502035  0.104379  0.696731  1
  P  P155  1  0.502035  0.711012  0.665156  1
  P  P156  1  0.502035  0.498969  0.715856  1
  P  P157  1  0.502035  0.243893  0.704362  1
  P  P158  1  0.502035  0.842247  0.671966  1
  P  P159  1  0.502035  0.633707  0.724082  1
  P  P160  1  1.002035  0.369222  0.713196  1
  P  P161  1  1.002035  0.970258  0.682330  1
  P  P162  1  1.002035  0.580372  0.658391  1
