# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.75711428
_cell_length_b   6.88500302
_cell_length_c   49.51035267
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.83587131
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe144 P72'
_cell_volume   5490.05717554
_cell_formula_units_Z   72
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  0.598354  0.162786  0.311161  1
  Fe  Fe2  1  0.257286  0.051137  0.294241  1
  Fe  Fe3  1  0.942855  0.247727  0.327394  1
  Fe  Fe4  1  0.406882  0.820050  0.319547  1
  Fe  Fe5  1  0.071984  0.772651  0.302799  1
  Fe  Fe6  1  0.725098  0.708215  0.282970  1
  Fe  Fe7  1  0.545040  0.475795  0.286724  1
  Fe  Fe8  1  0.217622  0.620556  0.321961  1
  Fe  Fe9  1  0.885873  0.544996  0.304683  1
  Fe  Fe10  1  0.648853  0.880477  0.299591  1
  Fe  Fe11  1  0.301769  0.784338  0.281311  1
  Fe  Fe12  1  0.992276  0.958967  0.317350  1
  Fe  Fe13  1  0.749676  0.541313  0.329847  1
  Fe  Fe14  1  0.407883  0.447469  0.311205  1
  Fe  Fe15  1  0.080908  0.412680  0.293549  1
  Fe  Fe16  1  0.498076  0.266630  0.330576  1
  Fe  Fe17  1  0.160253  0.192832  0.312946  1
  Fe  Fe18  1  0.825912  0.125744  0.293418  1
  Fe  Fe19  1  0.620219  0.377947  0.365917  1
  Fe  Fe20  1  0.289132  0.346892  0.343219  1
  Fe  Fe21  1  0.957789  0.452835  0.385014  1
  Fe  Fe22  1  0.425837  0.047359  0.375682  1
  Fe  Fe23  1  0.082026  0.979333  0.356824  1
  Fe  Fe24  1  0.759461  0.924726  0.336222  1
  Fe  Fe25  1  0.540566  0.705367  0.336294  1
  Fe  Fe26  1  0.228996  0.826089  0.377867  1
  Fe  Fe27  1  0.884061  0.782707  0.355022  1
  Fe  Fe28  1  0.666518  0.093011  0.352268  1
  Fe  Fe29  1  0.329813  0.017420  0.334069  1
  Fe  Fe30  1  0.002417  0.164652  0.372701  1
  Fe  Fe31  1  0.759828  0.745261  0.384243  1
  Fe  Fe32  1  0.421781  0.669382  0.365494  1
  Fe  Fe33  1  0.084593  0.604457  0.348448  1
  Fe  Fe34  1  0.516380  0.489917  0.385437  1
  Fe  Fe35  1  0.177947  0.409170  0.367649  1
  Fe  Fe36  1  0.836854  0.335236  0.347530  1
  Fe  Fe37  1  0.634655  0.601196  0.420482  1
  Fe  Fe38  1  0.296630  0.539715  0.401933  1
  Fe  Fe39  1  0.972528  0.671732  0.439789  1
  Fe  Fe40  1  0.448041  0.280521  0.430508  1
  Fe  Fe41  1  0.109196  0.204510  0.411829  1
  Fe  Fe42  1  0.770418  0.131993  0.392763  1
  Fe  Fe43  1  0.556602  0.920153  0.392983  1
  Fe  Fe44  1  0.233679  0.066237  0.430475  1
  Fe  Fe45  1  0.894576  0.993994  0.411705  1
  Fe  Fe46  1  0.679496  0.310983  0.409122  1
  Fe  Fe47  1  0.341017  0.237688  0.391383  1
  Fe  Fe48  1  0.017336  0.382288  0.428126  1
  Fe  Fe49  1  0.773044  0.962226  0.439932  1
  Fe  Fe50  1  0.436299  0.890150  0.421970  1
  Fe  Fe51  1  0.098372  0.819890  0.403771  1
  Fe  Fe52  1  0.531268  0.708864  0.440846  1
  Fe  Fe53  1  0.192897  0.632663  0.423197  1
  Fe  Fe54  1  0.853802  0.560910  0.404159  1
  Fe  Fe55  1  0.648971  0.819447  0.476209  1
  Fe  Fe56  1  0.311023  0.744835  0.458416  1
  Fe  Fe57  1  0.987097  0.891584  0.494929  1
  Fe  Fe58  1  0.461465  0.495938  0.485906  1
  Fe  Fe59  1  0.123096  0.421855  0.467573  1
  Fe  Fe60  1  0.784620  0.350172  0.448663  1
  Fe  Fe61  1  0.571705  0.139539  0.448568  1
  Fe  Fe62  1  0.248437  0.284568  0.485915  1
  Fe  Fe63  1  0.909449  0.211429  0.467199  1
  Fe  Fe64  1  0.693900  0.528526  0.464750  1
  Fe  Fe65  1  0.356054  0.456044  0.446474  1
  Fe  Fe66  1  0.031956  0.601066  0.483561  1
  Fe  Fe67  1  0.787417  0.180225  0.495661  1
  Fe  Fe68  1  0.450308  0.108562  0.477496  1
  Fe  Fe69  1  0.111718  0.035407  0.458824  1
  Fe  Fe70  1  0.545997  0.927496  0.496585  1
  Fe  Fe71  1  0.207967  0.854254  0.478328  1
  Fe  Fe72  1  0.868868  0.780619  0.459586  1
  Fe  Fe73  1  0.663336  0.036870  0.532039  1
  Fe  Fe74  1  0.325730  0.964709  0.513636  1
  Fe  Fe75  1  0.001448  0.109038  0.550462  1
  Fe  Fe76  1  0.475858  0.714228  0.541576  1
  Fe  Fe77  1  0.137881  0.641532  0.522970  1
  Fe  Fe78  1  0.799047  0.568131  0.504289  1
  Fe  Fe79  1  0.585993  0.357937  0.504288  1
  Fe  Fe80  1  0.263217  0.503331  0.541465  1
  Fe  Fe81  1  0.924014  0.429879  0.522712  1
  Fe  Fe82  1  0.708209  0.746948  0.520326  1
  Fe  Fe83  1  0.370647  0.674484  0.502127  1
  Fe  Fe84  1  0.046586  0.819874  0.538990  1
  Fe  Fe85  1  0.801956  0.397978  0.551276  1
  Fe  Fe86  1  0.464427  0.326427  0.533067  1
  Fe  Fe87  1  0.125899  0.253164  0.514291  1
  Fe  Fe88  1  0.560339  0.145331  0.552312  1
  Fe  Fe89  1  0.222572  0.072858  0.533763  1
  Fe  Fe90  1  0.883637  0.999202  0.515004  1
  Fe  Fe91  1  0.678179  0.255687  0.587730  1
  Fe  Fe92  1  0.340071  0.183178  0.569309  1
  Fe  Fe93  1  0.015878  0.326285  0.605768  1
  Fe  Fe94  1  0.491485  0.934657  0.597162  1
  Fe  Fe95  1  0.152350  0.860622  0.578382  1
  Fe  Fe96  1  0.813847  0.785755  0.559668  1
  Fe  Fe97  1  0.599600  0.575748  0.559709  1
  Fe  Fe98  1  0.276934  0.720142  0.596689  1
  Fe  Fe99  1  0.939008  0.648624  0.578122  1
  Fe  Fe100  1  0.722270  0.966996  0.575722  1
  Fe  Fe101  1  0.385147  0.893145  0.557606  1
  Fe  Fe102  1  0.060795  0.038221  0.594250  1
  Fe  Fe103  1  0.817052  0.615718  0.606028  1
  Fe  Fe104  1  0.479086  0.544736  0.588488  1
  Fe  Fe105  1  0.140314  0.471604  0.569761  1
  Fe  Fe106  1  0.574691  0.363511  0.608191  1
  Fe  Fe107  1  0.236847  0.290468  0.589099  1
  Fe  Fe108  1  0.898528  0.217445  0.570519  1
  Fe  Fe109  1  0.702914  0.517970  0.640742  1
  Fe  Fe110  1  0.355353  0.403181  0.624413  1
  Fe  Fe111  1  0.027439  0.539516  0.662487  1
  Fe  Fe112  1  0.488787  0.128444  0.654407  1
  Fe  Fe113  1  0.166481  0.081697  0.633137  1
  Fe  Fe114  1  0.824868  0.993418  0.615355  1
  Fe  Fe115  1  0.615689  0.795250  0.615544  1
  Fe  Fe116  1  0.301073  0.931122  0.653977  1
  Fe  Fe117  1  0.951984  0.866718  0.633345  1
  Fe  Fe118  1  0.736922  0.188986  0.631322  1
  Fe  Fe119  1  0.399753  0.113068  0.613454  1
  Fe  Fe120  1  0.073787  0.257556  0.649733  1
  Fe  Fe121  1  0.833910  0.836907  0.664198  1
  Fe  Fe122  1  0.495371  0.767879  0.646052  1
  Fe  Fe123  1  0.154980  0.690681  0.625060  1
  Fe  Fe124  1  0.587411  0.583962  0.663661  1
  Fe  Fe125  1  0.250858  0.509921  0.644649  1
  Fe  Fe126  1  0.913554  0.435626  0.626265  1
  Fe  Fe127  1  0.712367  0.735617  0.694376  1
  Fe  Fe128  1  0.369805  0.655458  0.676732  1
  Fe  Fe129  1  0.060541  0.832917  0.711573  1
  Fe  Fe130  1  0.528056  0.379714  0.706565  1
  Fe  Fe131  1  0.181121  0.282559  0.689249  1
  Fe  Fe132  1  0.838500  0.205942  0.671676  1
  Fe  Fe133  1  0.634690  0.987321  0.672302  1
  Fe  Fe134  1  0.291141  0.124653  0.707532  1
  Fe  Fe135  1  0.966770  0.075616  0.689395  1
  Fe  Fe136  1  0.754150  0.407758  0.685162  1
  Fe  Fe137  1  0.412983  0.324977  0.667922  1
  Fe  Fe138  1  0.092764  0.474900  0.705444  1
  Fe  Fe139  1  0.846196  0.047610  0.716020  1
  Fe  Fe140  1  0.514079  0.989832  0.699084  1
  Fe  Fe141  1  0.170119  0.901500  0.679886  1
  Fe  Fe142  1  0.605438  0.797108  0.717441  1
  Fe  Fe143  1  0.258883  0.720289  0.699993  1
  Fe  Fe144  1  0.925860  0.651046  0.680829  1
  P  P145  1  0.507976  0.782953  0.289616  1
  P  P146  1  0.191210  0.931244  0.333324  1
  P  P147  1  0.858947  0.857371  0.306825  1
  P  P148  1  0.634350  0.551285  0.320361  1
  P  P149  1  0.291374  0.451823  0.295588  1
  P  P150  1  0.966042  0.417728  0.279871  1
  P  P151  1  0.740902  0.235747  0.309838  1
  P  P152  1  0.407629  0.136189  0.291102  1
  P  P153  1  0.064660  0.062463  0.275801  1
  P  P154  1  0.526776  0.007010  0.349627  1
  P  P155  1  0.207684  0.154787  0.386371  1
  P  P156  1  0.867800  0.082262  0.367466  1
  P  P157  1  0.646440  0.776351  0.374313  1
  P  P158  1  0.310246  0.699018  0.356527  1
  P  P159  1  0.970926  0.623626  0.339876  1
  P  P160  1  0.757441  0.428121  0.371059  1
  P  P161  1  0.416451  0.348394  0.353295  1
  P  P162  1  0.080717  0.292374  0.335063  1
  P  P163  1  0.543554  0.229589  0.405182  1
  P  P164  1  0.220651  0.375420  0.442597  1
  P  P165  1  0.881167  0.301292  0.423849  1
  P  P166  1  0.661310  0.994058  0.429867  1
  P  P167  1  0.325151  0.923096  0.412727  1
  P  P168  1  0.983322  0.845257  0.394031  1
  P  P169  1  0.771349  0.648526  0.426876  1
  P  P170  1  0.432913  0.575374  0.408457  1
  P  P171  1  0.095043  0.504025  0.390498  1
  P  P172  1  0.558607  0.449217  0.460979  1
  P  P173  1  0.234743  0.593237  0.498317  1
  P  P174  1  0.896077  0.520363  0.479545  1
  P  P175  1  0.675698  0.211790  0.485637  1
  P  P176  1  0.338204  0.139635  0.467554  1
  P  P177  1  0.999314  0.066177  0.448888  1
  P  P178  1  0.785644  0.866280  0.482528  1
  P  P179  1  0.448072  0.793544  0.464287  1
  P  P180  1  0.109807  0.720123  0.446018  1
  P  P181  1  0.572730  0.667555  0.516623  1
  P  P182  1  0.249472  0.812687  0.553748  1
  P  P183  1  0.910762  0.739048  0.535001  1
  P  P184  1  0.689888  0.429714  0.541209  1
  P  P185  1  0.352674  0.358066  0.522995  1
  P  P186  1  0.013815  0.284473  0.504329  1
  P  P187  1  0.800356  0.084246  0.538117  1
  P  P188  1  0.462706  0.012338  0.519879  1
  P  P189  1  0.124372  0.939056  0.501312  1
  P  P190  1  0.586933  0.885742  0.572626  1
  P  P191  1  0.263815  0.027786  0.609664  1
  P  P192  1  0.924513  0.957046  0.590746  1
  P  P193  1  0.703993  0.649902  0.596089  1
  P  P194  1  0.367380  0.576711  0.578626  1
  P  P195  1  0.028531  0.503250  0.559721  1
  P  P196  1  0.815528  0.300689  0.593786  1
  P  P197  1  0.477091  0.230001  0.575639  1
  P  P198  1  0.138909  0.157965  0.556647  1
  P  P199  1  0.601583  0.111441  0.628872  1
  P  P200  1  0.279719  0.251967  0.664410  1
  P  P201  1  0.938876  0.178425  0.646498  1
  P  P202  1  0.720918  0.875708  0.651171  1
  P  P203  1  0.382073  0.794877  0.633446  1
  P  P204  1  0.042937  0.721239  0.615286  1
  P  P205  1  0.830745  0.524628  0.648739  1
  P  P206  1  0.492606  0.455033  0.631188  1
  P  P207  1  0.153106  0.376157  0.612150  1
  P  P208  1  0.622536  0.332370  0.684161  1
  P  P209  1  0.299544  0.481092  0.721223  1
  P  P210  1  0.955878  0.416149  0.706232  1
  P  P211  1  0.737373  0.113856  0.710986  1
  P  P212  1  0.396571  0.029340  0.694831  1
  P  P213  1  0.057940  0.948471  0.669945  1
  P  P214  1  0.841330  0.720246  0.710866  1
  P  P215  1  0.491460  0.647430  0.691559  1
  P  P216  1  0.165411  0.590484  0.667427  1
