# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06697984
_cell_length_b   26.77791265
_cell_length_c   48.27334002
_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   3964.55995976
_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  1.002073  0.899679  0.326762  1
  Fe  Fe2  1  1.002073  0.293044  0.303214  1
  Fe  Fe3  1  1.002073  0.688294  0.276981  1
  Fe  Fe4  1  1.002073  0.055168  0.313328  1
  Fe  Fe5  1  1.002073  0.447296  0.288275  1
  Fe  Fe6  1  1.002073  0.657559  0.338699  1
  Fe  Fe7  1  1.002073  0.179650  0.296802  1
  Fe  Fe8  1  1.002073  0.544742  0.272747  1
  Fe  Fe9  1  1.002073  0.768105  0.320646  1
  Fe  Fe10  1  0.502073  0.977935  0.328059  1
  Fe  Fe11  1  0.502073  0.371689  0.304175  1
  Fe  Fe12  1  0.502073  0.762908  0.276082  1
  Fe  Fe13  1  0.502073  0.125597  0.331635  1
  Fe  Fe14  1  0.502073  0.515518  0.308450  1
  Fe  Fe15  1  0.502073  0.912555  0.281438  1
  Fe  Fe16  1  0.502073  0.022677  0.274089  1
  Fe  Fe17  1  0.502073  0.229859  0.326118  1
  Fe  Fe18  1  0.502073  0.617485  0.294122  1
  Fe  Fe19  1  1.002073  0.715833  0.404814  1
  Fe  Fe20  1  1.002073  0.108826  0.378186  1
  Fe  Fe21  1  1.002073  0.505005  0.354497  1
  Fe  Fe22  1  1.002073  0.869963  0.389070  1
  Fe  Fe23  1  1.002073  0.264657  0.365333  1
  Fe  Fe24  1  1.002073  0.475344  0.416339  1
  Fe  Fe25  1  1.002073  0.981695  0.371975  1
  Fe  Fe26  1  1.002073  0.375531  0.347604  1
  Fe  Fe27  1  1.002073  0.586038  0.399299  1
  Fe  Fe28  1  0.502073  0.793107  0.405454  1
  Fe  Fe29  1  0.502073  0.187523  0.380962  1
  Fe  Fe30  1  0.502073  0.582076  0.355195  1
  Fe  Fe31  1  0.502073  0.939185  0.409463  1
  Fe  Fe32  1  0.502073  0.334013  0.385599  1
  Fe  Fe33  1  0.502073  0.728225  0.359064  1
  Fe  Fe34  1  0.502073  0.832466  0.350120  1
  Fe  Fe35  1  0.502073  0.042864  0.401462  1
  Fe  Fe36  1  0.502073  0.438557  0.377590  1
  Fe  Fe37  1  1.002073  0.531359  0.481640  1
  Fe  Fe38  1  1.002073  0.925084  0.455485  1
  Fe  Fe39  1  1.002073  0.320328  0.430690  1
  Fe  Fe40  1  1.002073  0.686449  0.467127  1
  Fe  Fe41  1  1.002073  0.079809  0.440905  1
  Fe  Fe42  1  1.002073  0.290703  0.492523  1
  Fe  Fe43  1  1.002073  0.797037  0.449866  1
  Fe  Fe44  1  1.002073  0.190164  0.424637  1
  Fe  Fe45  1  1.002073  0.401564  0.475769  1
  Fe  Fe46  1  0.502073  0.609174  0.483273  1
  Fe  Fe47  1  0.502073  0.002447  0.456919  1
  Fe  Fe48  1  0.502073  0.398218  0.432084  1
  Fe  Fe49  1  0.502073  0.755601  0.487343  1
  Fe  Fe50  1  0.502073  0.149155  0.461279  1
  Fe  Fe51  1  0.502073  0.544993  0.436507  1
  Fe  Fe52  1  0.502073  0.649367  0.428336  1
  Fe  Fe53  1  0.502073  0.859094  0.478911  1
  Fe  Fe54  1  0.502073  0.253682  0.453851  1
  Fe  Fe55  1  1.002073  0.346897  0.558048  1
  Fe  Fe56  1  1.002073  0.741212  0.532994  1
  Fe  Fe57  1  1.002073  0.135334  0.506512  1
  Fe  Fe58  1  1.002073  0.502279  0.545083  1
  Fe  Fe59  1  1.002073  0.896085  0.519092  1
  Fe  Fe60  1  1.002073  0.106283  0.570773  1
  Fe  Fe61  1  1.002073  0.612415  0.527311  1
  Fe  Fe62  1  1.002073  0.006014  0.500914  1
  Fe  Fe63  1  1.002073  0.216750  0.551979  1
  Fe  Fe64  1  0.502073  0.423219  0.559411  1
  Fe  Fe65  1  0.502073  0.819241  0.534674  1
  Fe  Fe66  1  0.502073  0.213393  0.508448  1
  Fe  Fe67  1  0.502073  0.571280  0.563559  1
  Fe  Fe68  1  0.502073  0.964940  0.538742  1
  Fe  Fe69  1  0.502073  0.360523  0.512848  1
  Fe  Fe70  1  0.502073  0.464916  0.504906  1
  Fe  Fe71  1  0.502073  0.674564  0.556294  1
  Fe  Fe72  1  0.502073  0.069191  0.529866  1
  Fe  Fe73  1  1.002073  0.155571  0.628271  1
  Fe  Fe74  1  1.002073  0.548671  0.604841  1
  Fe  Fe75  1  1.002073  0.952208  0.583706  1
  Fe  Fe76  1  1.002073  0.318479  0.620837  1
  Fe  Fe77  1  1.002073  0.712040  0.595071  1
  Fe  Fe78  1  1.002073  0.917696  0.655121  1
  Fe  Fe79  1  1.002073  0.429984  0.604047  1
  Fe  Fe80  1  1.002073  0.822046  0.578900  1
  Fe  Fe81  1  1.002073  0.036873  0.628131  1
  Fe  Fe82  1  0.502073  0.238513  0.635548  1
  Fe  Fe83  1  0.502073  0.633366  0.611392  1
  Fe  Fe84  1  0.502073  0.026512  0.585478  1
  Fe  Fe85  1  0.502073  0.387060  0.640271  1
  Fe  Fe86  1  0.502073  0.780879  0.615751  1
  Fe  Fe87  1  0.502073  0.176842  0.588115  1
  Fe  Fe88  1  0.502073  0.280473  0.581013  1
  Fe  Fe89  1  0.502073  0.489317  0.633228  1
  Fe  Fe90  1  0.502073  0.885490  0.608897  1
  Fe  Fe91  1  1.002073  0.982227  0.708928  1
  Fe  Fe92  1  1.002073  0.363789  0.682980  1
  Fe  Fe93  1  1.002073  0.762241  0.661212  1
  Fe  Fe94  1  1.002073  0.136574  0.700115  1
  Fe  Fe95  1  1.002073  0.527590  0.672954  1
  Fe  Fe96  1  1.002073  0.737849  0.721110  1
  Fe  Fe97  1  1.002073  0.247860  0.682045  1
  Fe  Fe98  1  1.002073  0.641574  0.657841  1
  Fe  Fe99  1  1.002073  0.847044  0.704984  1
  Fe  Fe100  1  0.502073  0.060712  0.714876  1
  Fe  Fe101  1  0.502073  0.448523  0.688702  1
  Fe  Fe102  1  0.502073  0.844485  0.663410  1
  Fe  Fe103  1  0.502073  0.206782  0.716795  1
  Fe  Fe104  1  0.502073  0.596990  0.690125  1
  Fe  Fe105  1  0.502073  0.992581  0.667012  1
  Fe  Fe106  1  0.502073  0.097333  0.657031  1
  Fe  Fe107  1  0.502073  0.300093  0.711177  1
  Fe  Fe108  1  0.502073  0.696847  0.684762  1
  P  P109  1  0.502073  0.108387  0.284919  1
  P  P110  1  0.502073  0.311508  0.339378  1
  P  P111  1  0.502073  0.701732  0.313173  1
  P  P112  1  0.502073  0.239653  0.276359  1
  P  P113  1  0.502073  0.442926  0.330654  1
  P  P114  1  0.502073  0.836356  0.303545  1
  P  P115  1  1.002073  0.970552  0.294191  1
  P  P116  1  1.002073  0.361373  0.269485  1
  P  P117  1  1.002073  0.574455  0.321733  1
  P  P118  1  0.502073  0.916546  0.362659  1
  P  P119  1  0.502073  0.126024  0.414468  1
  P  P120  1  0.502073  0.521885  0.390085  1
  P  P121  1  0.502073  0.049420  0.353967  1
  P  P122  1  0.502073  0.258405  0.406909  1
  P  P123  1  0.502073  0.653432  0.381233  1
  P  P124  1  1.002073  0.784803  0.371460  1
  P  P125  1  1.002073  0.180134  0.347397  1
  P  P126  1  0.002073  0.390380  0.398280  1
  P  P127  1  0.502073  0.732810  0.440577  1
  P  P128  1  0.502073  0.941861  0.491827  1
  P  P129  1  0.502073  0.337359  0.466386  1
  P  P130  1  0.502073  0.863969  0.431191  1
  P  P131  1  0.502073  0.073571  0.482554  1
  P  P132  1  0.502073  0.469349  0.457812  1
  P  P133  1  1.002073  0.601484  0.449478  1
  P  P134  1  1.002073  0.995166  0.422942  1
  P  P135  1  1.002073  0.205499  0.474666  1
  P  P136  1  0.502073  0.547822  0.517409  1
  P  P137  1  0.502073  0.758143  0.568903  1
  P  P138  1  0.502073  0.151804  0.542539  1
  P  P139  1  0.502073  0.680090  0.508918  1
  P  P140  1  0.502073  0.889608  0.561158  1
  P  P141  1  0.502073  0.284789  0.533989  1
  P  P142  1  1.002073  0.417170  0.525856  1
  P  P143  1  1.002073  0.811764  0.500717  1
  P  P144  1  1.002073  0.022103  0.551272  1
  P  P145  1  0.502073  0.363669  0.593903  1
  P  P146  1  0.502073  0.572611  0.643578  1
  P  P147  1  0.502073  0.966416  0.622407  1
  P  P148  1  0.502073  0.493114  0.584711  1
  P  P149  1  0.502073  0.704918  0.636496  1
  P  P150  1  0.502073  0.098377  0.609372  1
  P  P151  1  0.002073  0.233215  0.602302  1
  P  P152  1  1.002073  0.626988  0.578039  1
  P  P153  1  1.002073  0.836881  0.629439  1
  P  P154  1  0.502073  0.178858  0.668383  1
  P  P155  1  0.502073  0.386862  0.720782  1
  P  P156  1  0.502073  0.782871  0.696654  1
  P  P157  1  0.502073  0.309601  0.660727  1
  P  P158  1  0.502073  0.521471  0.712960  1
  P  P159  1  0.502073  0.917366  0.694266  1
  P  P160  1  1.002073  0.051735  0.678597  1
  P  P161  1  1.002073  0.442015  0.655164  1
  P  P162  1  1.002073  0.649699  0.711384  1
