# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   30.21686979
_cell_length_b   31.46434148
_cell_length_c   49.82842036
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.58755997
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe192 P768'
_cell_volume   46437.8867373
_cell_formula_units_Z   192
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  0.442487  0.550885  0.325190  1
  Fe  Fe2  1  0.942487  0.550885  0.325190  1
  Fe  Fe3  1  0.459807  0.914715  0.297266  1
  Fe  Fe4  1  0.415855  0.188410  0.360050  1
  Fe  Fe5  1  0.959807  0.914715  0.297266  1
  Fe  Fe6  1  0.915855  0.188410  0.360050  1
  Fe  Fe7  1  0.271419  0.668415  0.388023  1
  Fe  Fe8  1  0.771419  0.668415  0.388023  1
  Fe  Fe9  1  0.300162  0.027050  0.349971  1
  Fe  Fe10  1  0.330566  0.386264  0.323056  1
  Fe  Fe11  1  0.800162  0.027050  0.349971  1
  Fe  Fe12  1  0.830566  0.386264  0.323056  1
  Fe  Fe13  1  0.341865  0.431252  0.375736  1
  Fe  Fe14  1  0.841865  0.431252  0.375736  1
  Fe  Fe15  1  0.368942  0.792168  0.341221  1
  Fe  Fe16  1  0.402294  0.148402  0.308882  1
  Fe  Fe17  1  0.868942  0.792168  0.341221  1
  Fe  Fe18  1  0.902294  0.148402  0.308882  1
  Fe  Fe19  1  0.351001  0.613942  0.358692  1
  Fe  Fe20  1  0.851001  0.613942  0.358692  1
  Fe  Fe21  1  0.383289  0.970908  0.321754  1
  Fe  Fe22  1  0.402804  0.334165  0.294198  1
  Fe  Fe23  1  0.883289  0.970908  0.321754  1
  Fe  Fe24  1  0.902804  0.334165  0.294198  1
  Fe  Fe25  1  0.692487  0.550885  0.325190  1
  Fe  Fe26  1  0.192487  0.550885  0.325190  1
  Fe  Fe27  1  0.709807  0.914715  0.297266  1
  Fe  Fe28  1  0.665855  0.188410  0.360050  1
  Fe  Fe29  1  0.209807  0.914715  0.297266  1
  Fe  Fe30  1  0.165855  0.188410  0.360050  1
  Fe  Fe31  1  0.521419  0.668415  0.388023  1
  Fe  Fe32  1  0.021419  0.668415  0.388023  1
  Fe  Fe33  1  0.550162  0.027050  0.349971  1
  Fe  Fe34  1  0.580566  0.386264  0.323056  1
  Fe  Fe35  1  0.050162  0.027050  0.349971  1
  Fe  Fe36  1  0.080566  0.386264  0.323056  1
  Fe  Fe37  1  0.591865  0.431252  0.375736  1
  Fe  Fe38  1  0.091865  0.431252  0.375736  1
  Fe  Fe39  1  0.618942  0.792168  0.341221  1
  Fe  Fe40  1  0.652294  0.148402  0.308882  1
  Fe  Fe41  1  0.118942  0.792168  0.341221  1
  Fe  Fe42  1  0.152294  0.148402  0.308882  1
  Fe  Fe43  1  0.601001  0.613942  0.358692  1
  Fe  Fe44  1  0.101001  0.613942  0.358692  1
  Fe  Fe45  1  0.633289  0.970908  0.321754  1
  Fe  Fe46  1  0.652804  0.334165  0.294198  1
  Fe  Fe47  1  0.133289  0.970908  0.321754  1
  Fe  Fe48  1  0.152804  0.334165  0.294198  1
  Fe  Fe49  1  0.359221  0.469654  0.434056  1
  Fe  Fe50  1  0.859221  0.469654  0.434056  1
  Fe  Fe51  1  0.386849  0.828207  0.396260  1
  Fe  Fe52  1  0.331439  0.109759  0.471165  1
  Fe  Fe53  1  0.886849  0.828207  0.396260  1
  Fe  Fe54  1  0.831439  0.109759  0.471165  1
  Fe  Fe55  1  0.187621  0.589543  0.499839  1
  Fe  Fe56  1  0.687621  0.589543  0.499839  1
  Fe  Fe57  1  0.215604  0.948760  0.462212  1
  Fe  Fe58  1  0.243364  0.308995  0.425167  1
  Fe  Fe59  1  0.715604  0.948760  0.462212  1
  Fe  Fe60  1  0.743364  0.308995  0.425167  1
  Fe  Fe61  1  0.259229  0.354304  0.490602  1
  Fe  Fe62  1  0.759229  0.354304  0.490602  1
  Fe  Fe63  1  0.287010  0.713820  0.453607  1
  Fe  Fe64  1  0.315435  0.072958  0.416280  1
  Fe  Fe65  1  0.787010  0.713820  0.453607  1
  Fe  Fe66  1  0.815435  0.072958  0.416280  1
  Fe  Fe67  1  0.267258  0.535108  0.470633  1
  Fe  Fe68  1  0.767258  0.535108  0.470633  1
  Fe  Fe69  1  0.294927  0.894441  0.433046  1
  Fe  Fe70  1  0.323357  0.253899  0.396457  1
  Fe  Fe71  1  0.794927  0.894441  0.433046  1
  Fe  Fe72  1  0.823357  0.253899  0.396457  1
  Fe  Fe73  1  0.609221  0.469654  0.434056  1
  Fe  Fe74  1  0.109221  0.469654  0.434056  1
  Fe  Fe75  1  0.636849  0.828207  0.396260  1
  Fe  Fe76  1  0.581439  0.109759  0.471165  1
  Fe  Fe77  1  0.136849  0.828207  0.396260  1
  Fe  Fe78  1  0.081439  0.109759  0.471165  1
  Fe  Fe79  1  0.437621  0.589543  0.499839  1
  Fe  Fe80  1  0.937621  0.589543  0.499839  1
  Fe  Fe81  1  0.465604  0.948760  0.462212  1
  Fe  Fe82  1  0.493364  0.308995  0.425167  1
  Fe  Fe83  1  0.965604  0.948760  0.462212  1
  Fe  Fe84  1  0.993364  0.308995  0.425167  1
  Fe  Fe85  1  0.509229  0.354304  0.490602  1
  Fe  Fe86  1  0.009229  0.354304  0.490602  1
  Fe  Fe87  1  0.537010  0.713820  0.453607  1
  Fe  Fe88  1  0.565435  0.072958  0.416280  1
  Fe  Fe89  1  0.037010  0.713820  0.453607  1
  Fe  Fe90  1  0.065435  0.072958  0.416280  1
  Fe  Fe91  1  0.517258  0.535108  0.470633  1
  Fe  Fe92  1  0.017258  0.535108  0.470633  1
  Fe  Fe93  1  0.544927  0.894441  0.433046  1
  Fe  Fe94  1  0.573357  0.253899  0.396457  1
  Fe  Fe95  1  0.044927  0.894441  0.433046  1
  Fe  Fe96  1  0.073357  0.253899  0.396457  1
  Fe  Fe97  1  0.275401  0.390441  0.545402  1
  Fe  Fe98  1  0.775401  0.390441  0.545402  1
  Fe  Fe99  1  0.303355  0.750062  0.508401  1
  Fe  Fe100  1  0.247679  0.030611  0.582454  1
  Fe  Fe101  1  0.803355  0.750062  0.508401  1
  Fe  Fe102  1  0.747679  0.030611  0.582454  1
  Fe  Fe103  1  0.104675  0.512995  0.614073  1
  Fe  Fe104  1  0.604675  0.512995  0.614073  1
  Fe  Fe105  1  0.131842  0.870008  0.573915  1
  Fe  Fe106  1  0.159608  0.230131  0.536815  1
  Fe  Fe107  1  0.631842  0.870008  0.573915  1
  Fe  Fe108  1  0.659608  0.230131  0.536815  1
  Fe  Fe109  1  0.175104  0.275826  0.602746  1
  Fe  Fe110  1  0.675104  0.275826  0.602746  1
  Fe  Fe111  1  0.203327  0.635578  0.565285  1
  Fe  Fe112  1  0.231334  0.994473  0.527412  1
  Fe  Fe113  1  0.703327  0.635578  0.565285  1
  Fe  Fe114  1  0.731334  0.994473  0.527412  1
  Fe  Fe115  1  0.183358  0.456218  0.582460  1
  Fe  Fe116  1  0.683358  0.456218  0.582460  1
  Fe  Fe117  1  0.211331  0.815981  0.544684  1
  Fe  Fe118  1  0.239272  0.175568  0.507620  1
  Fe  Fe119  1  0.711331  0.815981  0.544684  1
  Fe  Fe120  1  0.739272  0.175568  0.507620  1
  Fe  Fe121  1  0.525401  0.390441  0.545402  1
  Fe  Fe122  1  0.025401  0.390441  0.545402  1
  Fe  Fe123  1  0.553355  0.750062  0.508401  1
  Fe  Fe124  1  0.497679  0.030611  0.582454  1
  Fe  Fe125  1  0.053355  0.750062  0.508401  1
  Fe  Fe126  1  0.997679  0.030611  0.582454  1
  Fe  Fe127  1  0.354675  0.512995  0.614073  1
  Fe  Fe128  1  0.854675  0.512995  0.614073  1
  Fe  Fe129  1  0.381842  0.870008  0.573915  1
  Fe  Fe130  1  0.409608  0.230131  0.536815  1
  Fe  Fe131  1  0.881842  0.870008  0.573915  1
  Fe  Fe132  1  0.909608  0.230131  0.536815  1
  Fe  Fe133  1  0.425104  0.275826  0.602746  1
  Fe  Fe134  1  0.925104  0.275826  0.602746  1
  Fe  Fe135  1  0.453327  0.635578  0.565285  1
  Fe  Fe136  1  0.481334  0.994473  0.527412  1
  Fe  Fe137  1  0.953327  0.635578  0.565285  1
  Fe  Fe138  1  0.981334  0.994473  0.527412  1
  Fe  Fe139  1  0.433358  0.456218  0.582460  1
  Fe  Fe140  1  0.933358  0.456218  0.582460  1
  Fe  Fe141  1  0.461331  0.815981  0.544684  1
  Fe  Fe142  1  0.489272  0.175568  0.507620  1
  Fe  Fe143  1  0.961331  0.815981  0.544684  1
  Fe  Fe144  1  0.989272  0.175568  0.507620  1
  Fe  Fe145  1  0.191409  0.311884  0.657502  1
  Fe  Fe146  1  0.691409  0.311884  0.657502  1
  Fe  Fe147  1  0.219288  0.671999  0.620376  1
  Fe  Fe148  1  0.159364  0.956991  0.689461  1
  Fe  Fe149  1  0.719288  0.671999  0.620376  1
  Fe  Fe150  1  0.659364  0.956991  0.689461  1
  Fe  Fe151  1  0.024215  0.431246  0.714180  1
  Fe  Fe152  1  0.524215  0.431246  0.714180  1
  Fe  Fe153  1  0.047246  0.794374  0.681864  1
  Fe  Fe154  1  0.078080  0.152168  0.649746  1
  Fe  Fe155  1  0.547246  0.794374  0.681864  1
  Fe  Fe156  1  0.578080  0.152168  0.649746  1
  Fe  Fe157  1  0.095827  0.187909  0.700407  1
  Fe  Fe158  1  0.595827  0.187909  0.700407  1
  Fe  Fe159  1  0.118251  0.552031  0.670722  1
  Fe  Fe160  1  0.147573  0.914909  0.638632  1
  Fe  Fe161  1  0.618251  0.552031  0.670722  1
  Fe  Fe162  1  0.647573  0.914909  0.638632  1
  Fe  Fe163  1  0.097149  0.380090  0.688298  1
  Fe  Fe164  1  0.597149  0.380090  0.688298  1
  Fe  Fe165  1  0.127526  0.738344  0.655415  1
  Fe  Fe166  1  0.155762  0.095945  0.618879  1
  Fe  Fe167  1  0.627526  0.738344  0.655415  1
  Fe  Fe168  1  0.655762  0.095945  0.618879  1
  Fe  Fe169  1  0.441409  0.311884  0.657502  1
  Fe  Fe170  1  0.941409  0.311884  0.657502  1
  Fe  Fe171  1  0.469288  0.671999  0.620376  1
  Fe  Fe172  1  0.409364  0.956991  0.689461  1
  Fe  Fe173  1  0.969288  0.671999  0.620376  1
  Fe  Fe174  1  0.909364  0.956991  0.689461  1
  Fe  Fe175  1  0.274215  0.431246  0.714180  1
  Fe  Fe176  1  0.774215  0.431246  0.714180  1
  Fe  Fe177  1  0.297246  0.794374  0.681864  1
  Fe  Fe178  1  0.328080  0.152168  0.649746  1
  Fe  Fe179  1  0.797246  0.794374  0.681864  1
  Fe  Fe180  1  0.828080  0.152168  0.649746  1
  Fe  Fe181  1  0.345827  0.187909  0.700407  1
  Fe  Fe182  1  0.845827  0.187909  0.700407  1
  Fe  Fe183  1  0.368251  0.552031  0.670722  1
  Fe  Fe184  1  0.397573  0.914909  0.638632  1
  Fe  Fe185  1  0.868251  0.552031  0.670722  1
  Fe  Fe186  1  0.897573  0.914909  0.638632  1
  Fe  Fe187  1  0.347149  0.380090  0.688298  1
  Fe  Fe188  1  0.847149  0.380090  0.688298  1
  Fe  Fe189  1  0.377526  0.738344  0.655415  1
  Fe  Fe190  1  0.405762  0.095945  0.618879  1
  Fe  Fe191  1  0.877526  0.738344  0.655415  1
  Fe  Fe192  1  0.905762  0.095945  0.618879  1
  P  P193  1  0.413969  0.441242  0.361833  1
  P  P194  1  0.913969  0.441242  0.361833  1
  P  P195  1  0.440945  0.800203  0.324089  1
  P  P196  1  0.468557  0.161607  0.288571  1
  P  P197  1  0.940945  0.800203  0.324089  1
  P  P198  1  0.968557  0.161607  0.288571  1
  P  P199  1  0.325111  0.639663  0.316577  1
  P  P200  1  0.825111  0.639663  0.316577  1
  P  P201  1  0.354470  0.999423  0.279134  1
  P  P202  1  0.298304  0.280300  0.353455  1
  P  P203  1  0.854470  0.999423  0.279134  1
  P  P204  1  0.798304  0.280300  0.353455  1
  P  P205  1  0.308823  0.461448  0.333495  1
  P  P206  1  0.808823  0.461448  0.333495  1
  P  P207  1  0.335941  0.817515  0.297884  1
  P  P208  1  0.283539  0.100153  0.371806  1
  P  P209  1  0.835941  0.817515  0.297884  1
  P  P210  1  0.783539  0.100153  0.371806  1
  P  P211  1  0.280186  0.599062  0.370489  1
  P  P212  1  0.780186  0.599062  0.370489  1
  P  P213  1  0.309010  0.958284  0.331543  1
  P  P214  1  0.333336  0.321540  0.294878  1
  P  P215  1  0.809010  0.958284  0.331543  1
  P  P216  1  0.833336  0.321540  0.294878  1
  P  P217  1  0.354569  0.502949  0.280177  1
  P  P218  1  0.854569  0.502949  0.280177  1
  P  P219  1  0.297017  0.780036  0.353491  1
  P  P220  1  0.326973  0.140895  0.315765  1
  P  P221  1  0.797017  0.780036  0.353491  1
  P  P222  1  0.826973  0.140895  0.315765  1
  P  P223  1  0.280055  0.738355  0.294747  1
  P  P224  1  0.780055  0.738355  0.294747  1
  P  P225  1  0.226236  0.018241  0.366197  1
  P  P226  1  0.253080  0.381103  0.329198  1
  P  P227  1  0.726236  0.018241  0.366197  1
  P  P228  1  0.753080  0.381103  0.329198  1
  P  P229  1  0.722581  0.520349  0.366105  1
  P  P230  1  0.222581  0.520349  0.366105  1
  P  P231  1  0.749990  0.879111  0.329546  1
  P  P232  1  0.779848  0.238120  0.293704  1
  P  P233  1  0.249990  0.879111  0.329546  1
  P  P234  1  0.279848  0.238120  0.293704  1
  P  P235  1  0.427996  0.622255  0.344623  1
  P  P236  1  0.927996  0.622255  0.344623  1
  P  P237  1  0.456937  0.984250  0.305316  1
  P  P238  1  0.400973  0.259892  0.381347  1
  P  P239  1  0.956937  0.984250  0.305316  1
  P  P240  1  0.900973  0.259892  0.381347  1
  P  P241  1  0.369304  0.539572  0.339170  1
  P  P242  1  0.869304  0.539572  0.339170  1
  P  P243  1  0.392790  0.897693  0.299565  1
  P  P244  1  0.342458  0.179717  0.376005  1
  P  P245  1  0.892790  0.897693  0.299565  1
  P  P246  1  0.842458  0.179717  0.376005  1
  P  P247  1  0.765456  0.561306  0.310111  1
  P  P248  1  0.265456  0.561306  0.310111  1
  P  P249  1  0.708513  0.840740  0.384235  1
  P  P250  1  0.738614  0.199691  0.348151  1
  P  P251  1  0.208513  0.840740  0.384235  1
  P  P252  1  0.238614  0.199691  0.348151  1
  P  P253  1  0.471443  0.659064  0.290163  1
  P  P254  1  0.971443  0.659064  0.290163  1
  P  P255  1  0.412845  0.941032  0.362232  1
  P  P256  1  0.444102  0.298578  0.325780  1
  P  P257  1  0.912845  0.941032  0.362232  1
  P  P258  1  0.944102  0.298578  0.325780  1
  P  P259  1  0.238418  0.700706  0.348261  1
  P  P260  1  0.738418  0.700706  0.348261  1
  P  P261  1  0.268484  0.061194  0.309891  1
  P  P262  1  0.211803  0.341269  0.384866  1
  P  P263  1  0.768484  0.061194  0.309891  1
  P  P264  1  0.711803  0.341269  0.384866  1
  P  P265  1  0.383265  0.720032  0.319930  1
  P  P266  1  0.883265  0.720032  0.319930  1
  P  P267  1  0.410668  0.083175  0.282848  1
  P  P268  1  0.357349  0.356724  0.360914  1
  P  P269  1  0.910668  0.083175  0.282848  1
  P  P270  1  0.857349  0.356724  0.360914  1
  P  P271  1  0.458031  0.481317  0.304475  1
  P  P272  1  0.958031  0.481317  0.304475  1
  P  P273  1  0.403422  0.758070  0.380440  1
  P  P274  1  0.433705  0.115555  0.345280  1
  P  P275  1  0.903422  0.758070  0.380440  1
  P  P276  1  0.933705  0.115555  0.345280  1
  P  P277  1  0.411128  0.581883  0.284530  1
  P  P278  1  0.911128  0.581883  0.284530  1
  P  P279  1  0.354606  0.863360  0.357101  1
  P  P280  1  0.382713  0.222860  0.319750  1
  P  P281  1  0.854606  0.863360  0.357101  1
  P  P282  1  0.882713  0.222860  0.319750  1
  P  P283  1  0.342007  0.683917  0.377000  1
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