# generated using pymatgen
data_FeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.20426769
_cell_length_b   21.16855102
_cell_length_c   47.28652260
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   105.91866006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP2
_chemical_formula_sum   'Fe180 P360'
_cell_volume   21373.8579638
_cell_formula_units_Z   180
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  0.853243  0.273606  0.309702  1
  Fe  Fe2  1  0.728279  0.246417  0.335503  1
  Fe  Fe3  1  0.481069  0.304543  0.284896  1
  Fe  Fe4  1  0.519910  0.940273  0.309702  1
  Fe  Fe5  1  0.353243  0.273606  0.309702  1
  Fe  Fe6  1  0.394946  0.913083  0.335503  1
  Fe  Fe7  1  0.147736  0.971210  0.284896  1
  Fe  Fe8  1  0.228279  0.246417  0.335503  1
  Fe  Fe9  1  0.186577  0.606939  0.309702  1
  Fe  Fe10  1  0.981069  0.304543  0.284896  1
  Fe  Fe11  1  0.019910  0.940273  0.309702  1
  Fe  Fe12  1  0.061613  0.579750  0.335503  1
  Fe  Fe13  1  0.814402  0.637876  0.284896  1
  Fe  Fe14  1  0.894946  0.913083  0.335503  1
  Fe  Fe15  1  0.647736  0.971210  0.284896  1
  Fe  Fe16  1  0.686577  0.606939  0.309702  1
  Fe  Fe17  1  0.561613  0.579750  0.335503  1
  Fe  Fe18  1  0.314402  0.637876  0.284896  1
  Fe  Fe19  1  0.779648  0.448544  0.306738  1
  Fe  Fe20  1  0.625529  0.405758  0.338254  1
  Fe  Fe21  1  0.402799  0.490480  0.285172  1
  Fe  Fe22  1  0.446315  0.115210  0.306738  1
  Fe  Fe23  1  0.279648  0.448544  0.306738  1
  Fe  Fe24  1  0.292195  0.072424  0.338254  1
  Fe  Fe25  1  0.069465  0.157146  0.285172  1
  Fe  Fe26  1  0.125529  0.405758  0.338254  1
  Fe  Fe27  1  0.112982  0.781877  0.306738  1
  Fe  Fe28  1  0.902799  0.490480  0.285172  1
  Fe  Fe29  1  0.946315  0.115210  0.306738  1
  Fe  Fe30  1  0.958862  0.739091  0.338254  1
  Fe  Fe31  1  0.736132  0.823813  0.285172  1
  Fe  Fe32  1  0.792195  0.072424  0.338254  1
  Fe  Fe33  1  0.569465  0.157146  0.285172  1
  Fe  Fe34  1  0.612982  0.781877  0.306738  1
  Fe  Fe35  1  0.458862  0.739091  0.338254  1
  Fe  Fe36  1  0.236132  0.823813  0.285172  1
  Fe  Fe37  1  0.946832  0.165290  0.397941  1
  Fe  Fe38  1  0.820563  0.127293  0.426775  1
  Fe  Fe39  1  0.572399  0.197188  0.369248  1
  Fe  Fe40  1  0.613498  0.831957  0.397941  1
  Fe  Fe41  1  0.446832  0.165290  0.397941  1
  Fe  Fe42  1  0.487230  0.793959  0.426775  1
  Fe  Fe43  1  0.239066  0.863854  0.369248  1
  Fe  Fe44  1  0.320563  0.127293  0.426775  1
  Fe  Fe45  1  0.280165  0.498623  0.397941  1
  Fe  Fe46  1  0.072399  0.197188  0.369248  1
  Fe  Fe47  1  0.113498  0.831957  0.397941  1
  Fe  Fe48  1  0.153896  0.460626  0.426775  1
  Fe  Fe49  1  0.905732  0.530521  0.369248  1
  Fe  Fe50  1  0.987230  0.793959  0.426775  1
  Fe  Fe51  1  0.739066  0.863854  0.369248  1
  Fe  Fe52  1  0.780165  0.498623  0.397941  1
  Fe  Fe53  1  0.653896  0.460626  0.426775  1
  Fe  Fe54  1  0.405732  0.530521  0.369248  1
  Fe  Fe55  1  0.856080  0.326995  0.399755  1
  Fe  Fe56  1  0.728161  0.289918  0.427445  1
  Fe  Fe57  1  0.506266  0.373120  0.366557  1
  Fe  Fe58  1  0.522747  0.993661  0.399755  1
  Fe  Fe59  1  0.356080  0.326995  0.399755  1
  Fe  Fe60  1  0.394828  0.956585  0.427445  1
  Fe  Fe61  1  0.172933  0.039787  0.366557  1
  Fe  Fe62  1  0.228161  0.289918  0.427445  1
  Fe  Fe63  1  0.189413  0.660328  0.399755  1
  Fe  Fe64  1  0.006266  0.373120  0.366557  1
  Fe  Fe65  1  0.022747  0.993661  0.399755  1
  Fe  Fe66  1  0.061494  0.623252  0.427445  1
  Fe  Fe67  1  0.839599  0.706453  0.366557  1
  Fe  Fe68  1  0.894828  0.956585  0.427445  1
  Fe  Fe69  1  0.672933  0.039787  0.366557  1
  Fe  Fe70  1  0.689413  0.660328  0.399755  1
  Fe  Fe71  1  0.561494  0.623252  0.427445  1
  Fe  Fe72  1  0.339599  0.706453  0.366557  1
  Fe  Fe73  1  0.044242  0.045660  0.489045  1
  Fe  Fe74  1  0.918787  0.013175  0.518384  1
  Fe  Fe75  1  0.671280  0.083628  0.460285  1
  Fe  Fe76  1  0.710909  0.712327  0.489045  1
  Fe  Fe77  1  0.544242  0.045660  0.489045  1
  Fe  Fe78  1  0.585453  0.679842  0.518384  1
  Fe  Fe79  1  0.337947  0.750295  0.460285  1
  Fe  Fe80  1  0.418787  0.013175  0.518384  1
  Fe  Fe81  1  0.377576  0.378993  0.489045  1
  Fe  Fe82  1  0.171280  0.083628  0.460285  1
  Fe  Fe83  1  0.210909  0.712327  0.489045  1
  Fe  Fe84  1  0.252120  0.346509  0.518384  1
  Fe  Fe85  1  0.004613  0.416961  0.460285  1
  Fe  Fe86  1  0.085453  0.679842  0.518384  1
  Fe  Fe87  1  0.837947  0.750295  0.460285  1
  Fe  Fe88  1  0.877576  0.378993  0.489045  1
  Fe  Fe89  1  0.752120  0.346509  0.518384  1
  Fe  Fe90  1  0.504613  0.416961  0.460285  1
  Fe  Fe91  1  0.969408  0.216643  0.487552  1
  Fe  Fe92  1  0.819436  0.172983  0.521237  1
  Fe  Fe93  1  0.596583  0.253381  0.459665  1
  Fe  Fe94  1  0.636074  0.883310  0.487552  1
  Fe  Fe95  1  0.469408  0.216643  0.487552  1
  Fe  Fe96  1  0.486103  0.839650  0.521237  1
  Fe  Fe97  1  0.263249  0.920048  0.459665  1
  Fe  Fe98  1  0.319436  0.172983  0.521237  1
  Fe  Fe99  1  0.302741  0.549976  0.487552  1
  Fe  Fe100  1  0.096583  0.253381  0.459665  1
  Fe  Fe101  1  0.136074  0.883310  0.487552  1
  Fe  Fe102  1  0.152770  0.506316  0.521237  1
  Fe  Fe103  1  0.929916  0.586715  0.459665  1
  Fe  Fe104  1  0.986103  0.839650  0.521237  1
  Fe  Fe105  1  0.763249  0.920048  0.459665  1
  Fe  Fe106  1  0.802741  0.549976  0.487552  1
  Fe  Fe107  1  0.652770  0.506316  0.521237  1
  Fe  Fe108  1  0.429916  0.586715  0.459665  1
  Fe  Fe109  1  0.140955  0.931347  0.581493  1
  Fe  Fe110  1  0.014167  0.891828  0.609545  1
  Fe  Fe111  1  0.765924  0.964271  0.552150  1
  Fe  Fe112  1  0.807622  0.598013  0.581493  1
  Fe  Fe113  1  0.640955  0.931347  0.581493  1
  Fe  Fe114  1  0.680834  0.558494  0.609545  1
  Fe  Fe115  1  0.432591  0.630937  0.552150  1
  Fe  Fe116  1  0.514167  0.891828  0.609545  1
  Fe  Fe117  1  0.474289  0.264680  0.581493  1
  Fe  Fe118  1  0.265924  0.964271  0.552150  1
  Fe  Fe119  1  0.307622  0.598013  0.581493  1
  Fe  Fe120  1  0.347501  0.225161  0.609545  1
  Fe  Fe121  1  0.099257  0.297604  0.552150  1
  Fe  Fe122  1  0.180834  0.558494  0.609545  1
  Fe  Fe123  1  0.932591  0.630937  0.552150  1
  Fe  Fe124  1  0.974289  0.264680  0.581493  1
  Fe  Fe125  1  0.847501  0.225161  0.609545  1
  Fe  Fe126  1  0.599257  0.297604  0.552150  1
  Fe  Fe127  1  0.051091  0.094120  0.582052  1
  Fe  Fe128  1  0.926249  0.056919  0.607987  1
  Fe  Fe129  1  0.697384  0.137514  0.549735  1
  Fe  Fe130  1  0.717758  0.760787  0.582052  1
  Fe  Fe131  1  0.551091  0.094120  0.582052  1
  Fe  Fe132  1  0.592916  0.723586  0.607987  1
  Fe  Fe133  1  0.364050  0.804181  0.549735  1
  Fe  Fe134  1  0.426249  0.056919  0.607987  1
  Fe  Fe135  1  0.384425  0.427453  0.582052  1
  Fe  Fe136  1  0.197384  0.137514  0.549735  1
  Fe  Fe137  1  0.217758  0.760787  0.582052  1
  Fe  Fe138  1  0.259582  0.390252  0.607987  1
  Fe  Fe139  1  0.030717  0.470848  0.549735  1
  Fe  Fe140  1  0.092916  0.723586  0.607987  1
  Fe  Fe141  1  0.864050  0.804181  0.549735  1
  Fe  Fe142  1  0.884425  0.427453  0.582052  1
  Fe  Fe143  1  0.759582  0.390252  0.607987  1
  Fe  Fe144  1  0.530717  0.470848  0.549735  1
  Fe  Fe145  1  0.233390  0.811712  0.671804  1
  Fe  Fe146  1  0.108228  0.774107  0.697169  1
  Fe  Fe147  1  0.860820  0.851742  0.643640  1
  Fe  Fe148  1  0.900057  0.478379  0.671804  1
  Fe  Fe149  1  0.733390  0.811712  0.671804  1
  Fe  Fe150  1  0.774894  0.440774  0.697169  1
  Fe  Fe151  1  0.527487  0.518408  0.643640  1
  Fe  Fe152  1  0.608228  0.774107  0.697169  1
  Fe  Fe153  1  0.566724  0.145045  0.671804  1
  Fe  Fe154  1  0.360820  0.851742  0.643640  1
  Fe  Fe155  1  0.400057  0.478379  0.671804  1
  Fe  Fe156  1  0.441561  0.107441  0.697169  1
  Fe  Fe157  1  0.194154  0.185075  0.643640  1
  Fe  Fe158  1  0.274894  0.440774  0.697169  1
  Fe  Fe159  1  0.027487  0.518408  0.643640  1
  Fe  Fe160  1  0.066724  0.145045  0.671804  1
  Fe  Fe161  1  0.941561  0.107441  0.697169  1
  Fe  Fe162  1  0.694154  0.185075  0.643640  1
  Fe  Fe163  1  0.152729  0.980925  0.673763  1
  Fe  Fe164  1  0.019648  0.941406  0.698613  1
  Fe  Fe165  1  0.779852  0.020252  0.646417  1
  Fe  Fe166  1  0.819396  0.647592  0.673763  1
  Fe  Fe167  1  0.652729  0.980925  0.673763  1
  Fe  Fe168  1  0.686315  0.608072  0.698613  1
  Fe  Fe169  1  0.446519  0.686919  0.646417  1
  Fe  Fe170  1  0.519648  0.941406  0.698613  1
  Fe  Fe171  1  0.486063  0.314259  0.673763  1
  Fe  Fe172  1  0.279852  0.020252  0.646417  1
  Fe  Fe173  1  0.319396  0.647592  0.673763  1
  Fe  Fe174  1  0.352982  0.274739  0.698613  1
  Fe  Fe175  1  0.113186  0.353585  0.646417  1
  Fe  Fe176  1  0.186315  0.608072  0.698613  1
  Fe  Fe177  1  0.946519  0.686919  0.646417  1
  Fe  Fe178  1  0.986063  0.314259  0.673763  1
  Fe  Fe179  1  0.852982  0.274739  0.698613  1
  Fe  Fe180  1  0.613186  0.353585  0.646417  1
  P  P181  1  0.861762  0.392045  0.304691  1
  P  P182  1  0.720591  0.358181  0.334433  1
  P  P183  1  0.585876  0.316284  0.368373  1
  P  P184  1  0.528428  0.058712  0.304691  1
  P  P185  1  0.361762  0.392045  0.304691  1
  P  P186  1  0.387258  0.024848  0.334433  1
  P  P187  1  0.252543  0.982951  0.368373  1
  P  P188  1  0.220591  0.358181  0.334433  1
  P  P189  1  0.195095  0.725379  0.304691  1
  P  P190  1  0.085876  0.316284  0.368373  1
  P  P191  1  0.028428  0.058712  0.304691  1
  P  P192  1  0.053925  0.691515  0.334433  1
  P  P193  1  0.919210  0.649617  0.368373  1
  P  P194  1  0.887258  0.024848  0.334433  1
  P  P195  1  0.752543  0.982951  0.368373  1
  P  P196  1  0.695095  0.725379  0.304691  1
  P  P197  1  0.553925  0.691515  0.334433  1
  P  P198  1  0.419210  0.649617  0.368373  1
  P  P199  1  0.822215  0.534658  0.273744  1
  P  P200  1  0.685348  0.493174  0.306253  1
  P  P201  1  0.543574  0.459648  0.332899  1
  P  P202  1  0.488882  0.201325  0.273744  1
  P  P203  1  0.322215  0.534658  0.273744  1
  P  P204  1  0.352015  0.159840  0.306253  1
  P  P205  1  0.210241  0.126315  0.332899  1
  P  P206  1  0.185348  0.493174  0.306253  1
  P  P207  1  0.155548  0.867992  0.273744  1
  P  P208  1  0.043574  0.459648  0.332899  1
  P  P209  1  0.988882  0.201325  0.273744  1
  P  P210  1  0.018682  0.826507  0.306253  1
  P  P211  1  0.876908  0.792981  0.332899  1
  P  P212  1  0.852015  0.159840  0.306253  1
  P  P213  1  0.710241  0.126315  0.332899  1
  P  P214  1  0.655548  0.867992  0.273744  1
  P  P215  1  0.518682  0.826507  0.306253  1
  P  P216  1  0.376908  0.792981  0.332899  1
  P  P217  1  0.810490  0.504422  0.348916  1
  P  P218  1  0.587473  0.587145  0.286170  1
  P  P219  1  0.449330  0.551099  0.320982  1
  P  P220  1  0.477156  0.171089  0.348916  1
  P  P221  1  0.310490  0.504422  0.348916  1
  P  P222  1  0.254140  0.253812  0.286170  1
  P  P223  1  0.115997  0.217766  0.320982  1
  P  P224  1  0.087473  0.587145  0.286170  1
  P  P225  1  0.143823  0.837755  0.348916  1
  P  P226  1  0.949330  0.551099  0.320982  1
  P  P227  1  0.977156  0.171089  0.348916  1
  P  P228  1  0.920807  0.920478  0.286170  1
  P  P229  1  0.782664  0.884433  0.320982  1
  P  P230  1  0.754140  0.253812  0.286170  1
  P  P231  1  0.615997  0.217766  0.320982  1
  P  P232  1  0.643823  0.837755  0.348916  1
  P  P233  1  0.420807  0.920478  0.286170  1
  P  P234  1  0.282664  0.884433  0.320982  1
  P  P235  1  0.821149  0.268377  0.356945  1
  P  P236  1  0.590300  0.346982  0.293882  1
  P  P237  1  0.456177  0.302113  0.329575  1
  P  P238  1  0.487816  0.935044  0.356945  1
  P  P239  1  0.321149  0.268377  0.356945  1
  P  P240  1  0.256966  0.013649  0.293882  1
  P  P241  1  0.122844  0.968779  0.329575  1
  P  P242  1  0.090300  0.346982  0.293882  1
  P  P243  1  0.154483  0.601711  0.356945  1
  P  P244  1  0.956177  0.302113  0.329575  1
  P  P245  1  0.987816  0.935044  0.356945  1
  P  P246  1  0.923633  0.680315  0.293882  1
  P  P247  1  0.789511  0.635446  0.329575  1
  P  P248  1  0.756966  0.013649  0.293882  1
  P  P249  1  0.622844  0.968779  0.329575  1
  P  P250  1  0.654483  0.601711  0.356945  1
  P  P251  1  0.423633  0.680315  0.293882  1
  P  P252  1  0.289511  0.635446  0.329575  1
  P  P253  1  0.948535  0.280424  0.398253  1
  P  P254  1  0.812838  0.237554  0.428513  1
  P  P255  1  0.678626  0.199548  0.457890  1
  P  P256  1  0.615202  0.947091  0.398253  1
  P  P257  1  0.448535  0.280424  0.398253  1
  P  P258  1  0.479504  0.904221  0.428513  1
  P  P259  1  0.345292  0.866215  0.457890  1
  P  P260  1  0.312838  0.237554  0.428513  1
  P  P261  1  0.281868  0.613757  0.398253  1
  P  P262  1  0.178626  0.199548  0.457890  1
  P  P263  1  0.115202  0.947091  0.398253  1
  P  P264  1  0.146171  0.570887  0.428513  1
  P  P265  1  0.011959  0.532882  0.457890  1
  P  P266  1  0.979504  0.904221  0.428513  1
  P  P267  1  0.845292  0.866215  0.457890  1
  P  P268  1  0.781868  0.613757  0.398253  1
  P  P269  1  0.646171  0.570887  0.428513  1
  P  P270  1  0.511959  0.532882  0.457890  1
  P  P271  1  0.913864  0.418379  0.368407  1
  P  P272  1  0.777781  0.381740  0.397990  1
  P  P273  1  0.646696  0.344693  0.429917  1
  P  P274  1  0.580531  0.085046  0.368407  1
  P  P275  1  0.413864  0.418379  0.368407  1
  P  P276  1  0.444448  0.048407  0.397990  1
  P  P277  1  0.313363  0.011360  0.429917  1
  P  P278  1  0.277781  0.381740  0.397990  1
  P  P279  1  0.247197  0.751712  0.368407  1
  P  P280  1  0.146696  0.344693  0.429917  1
  P  P281  1  0.080531  0.085046  0.368407  1
  P  P282  1  0.111115  0.715073  0.397990  1
  P  P283  1  0.980030  0.678026  0.429917  1
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