# generated using pymatgen
data_FeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.78092126
_cell_length_b   36.86039329
_cell_length_c   48.30905188
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.40141104
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP2
_chemical_formula_sum   'Fe216 P432'
_cell_volume   25951.7686239
_cell_formula_units_Z   216
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  0.756249  0.761878  0.279182  1
  Fe  Fe2  1  0.639193  0.413889  0.325151  1
  Fe  Fe3  1  0.699447  0.592639  0.303446  1
  Fe  Fe4  1  0.256276  0.595058  0.278471  1
  Fe  Fe5  1  0.198989  0.758602  0.303290  1
  Fe  Fe6  1  0.756172  0.095073  0.279113  1
  Fe  Fe7  1  0.698840  0.258608  0.303347  1
  Fe  Fe8  1  0.256138  0.261726  0.279148  1
  Fe  Fe9  1  0.199563  0.425588  0.303407  1
  Fe  Fe10  1  0.698950  0.925291  0.303336  1
  Fe  Fe11  1  0.256251  0.928430  0.279147  1
  Fe  Fe12  1  0.198891  0.091899  0.303295  1
  Fe  Fe13  1  0.954844  0.839084  0.304970  1
  Fe  Fe14  1  0.957121  0.506367  0.305156  1
  Fe  Fe15  1  0.009856  0.678625  0.279924  1
  Fe  Fe16  1  0.455411  0.672709  0.304956  1
  Fe  Fe17  1  0.509699  0.844862  0.279988  1
  Fe  Fe18  1  0.954785  0.172300  0.304926  1
  Fe  Fe19  1  0.011163  0.344641  0.280041  1
  Fe  Fe20  1  0.453905  0.338469  0.304946  1
  Fe  Fe21  1  0.509580  0.511871  0.280056  1
  Fe  Fe22  1  0.009744  0.011466  0.279959  1
  Fe  Fe23  1  0.454689  0.005629  0.304943  1
  Fe  Fe24  1  0.509614  0.178060  0.279941  1
  Fe  Fe25  1  0.640512  0.747930  0.323953  1
  Fe  Fe26  1  0.515198  0.401398  0.371435  1
  Fe  Fe27  1  0.577728  0.576569  0.345173  1
  Fe  Fe28  1  0.145826  0.582874  0.321389  1
  Fe  Fe29  1  0.078228  0.743163  0.345207  1
  Fe  Fe30  1  0.640517  0.081039  0.323876  1
  Fe  Fe31  1  0.577786  0.242977  0.345243  1
  Fe  Fe32  1  0.140419  0.247598  0.323927  1
  Fe  Fe33  1  0.077971  0.409837  0.345265  1
  Fe  Fe34  1  0.577892  0.909801  0.345229  1
  Fe  Fe35  1  0.140569  0.914422  0.323908  1
  Fe  Fe36  1  0.077876  0.076423  0.345178  1
  Fe  Fe37  1  0.821476  0.828232  0.349204  1
  Fe  Fe38  1  0.820389  0.492757  0.347778  1
  Fe  Fe39  1  0.887476  0.666337  0.323465  1
  Fe  Fe40  1  0.321040  0.661480  0.349017  1
  Fe  Fe41  1  0.387373  0.832550  0.323287  1
  Fe  Fe42  1  0.821303  0.161458  0.349133  1
  Fe  Fe43  1  0.888390  0.332212  0.323312  1
  Fe  Fe44  1  0.320681  0.328117  0.349183  1
  Fe  Fe45  1  0.387326  0.499417  0.323269  1
  Fe  Fe46  1  0.887410  0.999189  0.323270  1
  Fe  Fe47  1  0.321285  0.994816  0.349173  1
  Fe  Fe48  1  0.387277  0.165806  0.323253  1
  Fe  Fe49  1  0.515800  0.735049  0.371489  1
  Fe  Fe50  1  0.363412  0.388200  0.426442  1
  Fe  Fe51  1  0.433248  0.559721  0.401210  1
  Fe  Fe52  1  0.998884  0.566934  0.376996  1
  Fe  Fe53  1  0.933100  0.726539  0.401391  1
  Fe  Fe54  1  0.516188  0.068225  0.371402  1
  Fe  Fe55  1  0.432633  0.226452  0.401231  1
  Fe  Fe56  1  0.016104  0.234880  0.371425  1
  Fe  Fe57  1  0.932665  0.393290  0.400955  1
  Fe  Fe58  1  0.432847  0.893135  0.401318  1
  Fe  Fe59  1  0.016335  0.901640  0.371455  1
  Fe  Fe60  1  0.932846  0.059759  0.401272  1
  Fe  Fe61  1  0.697728  0.812178  0.395464  1
  Fe  Fe62  1  0.697161  0.478116  0.394788  1
  Fe  Fe63  1  0.765815  0.651940  0.370278  1
  Fe  Fe64  1  0.196672  0.644372  0.394805  1
  Fe  Fe65  1  0.265234  0.818390  0.370118  1
  Fe  Fe66  1  0.697457  0.145359  0.395374  1
  Fe  Fe67  1  0.765370  0.318345  0.370026  1
  Fe  Fe68  1  0.197072  0.312151  0.395345  1
  Fe  Fe69  1  0.265168  0.485166  0.370181  1
  Fe  Fe70  1  0.765291  0.985055  0.370107  1
  Fe  Fe71  1  0.197587  0.978744  0.395438  1
  Fe  Fe72  1  0.265187  0.151689  0.370089  1
  Fe  Fe73  1  0.363112  0.721355  0.426514  1
  Fe  Fe74  1  0.242780  0.374067  0.472184  1
  Fe  Fe75  1  0.307500  0.549569  0.446650  1
  Fe  Fe76  1  0.870004  0.555621  0.423833  1
  Fe  Fe77  1  0.807174  0.716349  0.446724  1
  Fe  Fe78  1  0.363077  0.054720  0.426556  1
  Fe  Fe79  1  0.306874  0.216228  0.446632  1
  Fe  Fe80  1  0.863384  0.221448  0.426393  1
  Fe  Fe81  1  0.807246  0.383029  0.446509  1
  Fe  Fe82  1  0.307195  0.882893  0.446700  1
  Fe  Fe83  1  0.863179  0.888112  0.426606  1
  Fe  Fe84  1  0.807106  0.049500  0.446638  1
  Fe  Fe85  1  0.543652  0.797739  0.452343  1
  Fe  Fe86  1  0.544000  0.464476  0.452284  1
  Fe  Fe87  1  0.614781  0.637693  0.426406  1
  Fe  Fe88  1  0.044423  0.632012  0.452939  1
  Fe  Fe89  1  0.114921  0.804219  0.426562  1
  Fe  Fe90  1  0.543504  0.130993  0.452262  1
  Fe  Fe91  1  0.614805  0.304176  0.426493  1
  Fe  Fe92  1  0.043638  0.297958  0.452352  1
  Fe  Fe93  1  0.114489  0.471087  0.426516  1
  Fe  Fe94  1  0.614797  0.970840  0.426543  1
  Fe  Fe95  1  0.043640  0.964390  0.452353  1
  Fe  Fe96  1  0.114830  0.137478  0.426493  1
  Fe  Fe97  1  0.243018  0.707388  0.472191  1
  Fe  Fe98  1  0.089635  0.359673  0.527666  1
  Fe  Fe99  1  0.158452  0.531919  0.502791  1
  Fe  Fe100  1  0.745198  0.540969  0.471176  1
  Fe  Fe101  1  0.658243  0.698685  0.502648  1
  Fe  Fe102  1  0.242477  0.040639  0.472311  1
  Fe  Fe103  1  0.158028  0.198573  0.502605  1
  Fe  Fe104  1  0.742708  0.207192  0.471992  1
  Fe  Fe105  1  0.658284  0.365354  0.502589  1
  Fe  Fe106  1  0.158134  0.865355  0.502735  1
  Fe  Fe107  1  0.742514  0.874024  0.472350  1
  Fe  Fe108  1  0.657973  0.032011  0.502694  1
  Fe  Fe109  1  0.417313  0.783670  0.499560  1
  Fe  Fe110  1  0.417583  0.450341  0.499479  1
  Fe  Fe111  1  0.491286  0.624607  0.471901  1
  Fe  Fe112  1  0.917408  0.616942  0.499496  1
  Fe  Fe113  1  0.990911  0.791284  0.472071  1
  Fe  Fe114  1  0.417136  0.116971  0.499510  1
  Fe  Fe115  1  0.490669  0.291319  0.471914  1
  Fe  Fe116  1  0.917356  0.283705  0.499370  1
  Fe  Fe117  1  0.990878  0.457789  0.472102  1
  Fe  Fe118  1  0.490758  0.957887  0.472027  1
  Fe  Fe119  1  0.917253  0.950357  0.499584  1
  Fe  Fe120  1  0.990854  0.124483  0.471930  1
  Fe  Fe121  1  0.091622  0.693365  0.527129  1
  Fe  Fe122  1  0.963991  0.345433  0.574785  1
  Fe  Fe123  1  0.032696  0.518974  0.550058  1
  Fe  Fe124  1  0.591706  0.526686  0.526851  1
  Fe  Fe125  1  0.532756  0.685633  0.550075  1
  Fe  Fe126  1  0.091661  0.026615  0.526934  1
  Fe  Fe127  1  0.032459  0.185549  0.550069  1
  Fe  Fe128  1  0.591295  0.193255  0.526803  1
  Fe  Fe129  1  0.532765  0.352382  0.550055  1
  Fe  Fe130  1  0.032545  0.852369  0.550178  1
  Fe  Fe131  1  0.591747  0.859994  0.526951  1
  Fe  Fe132  1  0.532421  0.019041  0.550164  1
  Fe  Fe133  1  0.289472  0.770100  0.546749  1
  Fe  Fe134  1  0.289550  0.436692  0.546588  1
  Fe  Fe135  1  0.343047  0.608928  0.526600  1
  Fe  Fe136  1  0.789612  0.603188  0.546443  1
  Fe  Fe137  1  0.842911  0.775675  0.526674  1
  Fe  Fe138  1  0.289205  0.103398  0.546693  1
  Fe  Fe139  1  0.342381  0.275705  0.526599  1
  Fe  Fe140  1  0.788873  0.269011  0.545763  1
  Fe  Fe141  1  0.843136  0.442539  0.526207  1
  Fe  Fe142  1  0.342864  0.942304  0.526657  1
  Fe  Fe143  1  0.789313  0.936780  0.546757  1
  Fe  Fe144  1  0.842727  0.108938  0.526551  1
  Fe  Fe145  1  0.970421  0.679570  0.572832  1
  Fe  Fe146  1  0.835702  0.334589  0.621626  1
  Fe  Fe147  1  0.903937  0.508023  0.597084  1
  Fe  Fe148  1  0.470732  0.512930  0.572690  1
  Fe  Fe149  1  0.403860  0.674648  0.597152  1
  Fe  Fe150  1  0.970449  0.012994  0.572776  1
  Fe  Fe151  1  0.903278  0.174653  0.597109  1
  Fe  Fe152  1  0.470614  0.179616  0.572463  1
  Fe  Fe153  1  0.403313  0.341567  0.596972  1
  Fe  Fe154  1  0.903581  0.841375  0.597206  1
  Fe  Fe155  1  0.470602  0.846318  0.572783  1
  Fe  Fe156  1  0.403587  0.008090  0.597223  1
  Fe  Fe157  1  0.136994  0.755652  0.603735  1
  Fe  Fe158  1  0.137188  0.422671  0.603653  1
  Fe  Fe159  1  0.219912  0.597597  0.573212  1
  Fe  Fe160  1  0.637171  0.588955  0.603666  1
  Fe  Fe161  1  0.719734  0.764322  0.573202  1
  Fe  Fe162  1  0.136537  0.088977  0.603710  1
  Fe  Fe163  1  0.219883  0.264269  0.573167  1
  Fe  Fe164  1  0.638194  0.256441  0.603556  1
  Fe  Fe165  1  0.720409  0.431120  0.572830  1
  Fe  Fe166  1  0.219695  0.931019  0.573228  1
  Fe  Fe167  1  0.636832  0.922385  0.603744  1
  Fe  Fe168  1  0.719719  0.097674  0.573134  1
  Fe  Fe169  1  0.820344  0.665496  0.628005  1
  Fe  Fe170  1  0.689795  0.315705  0.678125  1
  Fe  Fe171  1  0.755213  0.491106  0.653262  1
  Fe  Fe172  1  0.320523  0.498776  0.628083  1
  Fe  Fe173  1  0.254915  0.657923  0.653330  1
  Fe  Fe174  1  0.819899  0.998976  0.628090  1
  Fe  Fe175  1  0.754274  0.158153  0.653476  1
  Fe  Fe176  1  0.319886  0.165648  0.627959  1
  Fe  Fe177  1  0.254579  0.324731  0.653397  1
  Fe  Fe178  1  0.754706  0.824657  0.653376  1
  Fe  Fe179  1  0.320245  0.832257  0.628096  1
  Fe  Fe180  1  0.254837  0.991419  0.653391  1
  Fe  Fe181  1  0.013488  0.740888  0.650306  1
  Fe  Fe182  1  0.013393  0.407877  0.650613  1
  Fe  Fe183  1  0.070587  0.581803  0.628007  1
  Fe  Fe184  1  0.513801  0.574153  0.650234  1
  Fe  Fe185  1  0.570436  0.748535  0.628039  1
  Fe  Fe186  1  0.013045  0.074309  0.650339  1
  Fe  Fe187  1  0.068572  0.248793  0.627965  1
  Fe  Fe188  1  0.513249  0.239517  0.649241  1
  Fe  Fe189  1  0.571348  0.415123  0.627749  1
  Fe  Fe190  1  0.070250  0.915258  0.628088  1
  Fe  Fe191  1  0.513438  0.907662  0.650347  1
  Fe  Fe192  1  0.570272  0.082225  0.628080  1
  Fe  Fe193  1  0.697550  0.651469  0.674193  1
  Fe  Fe194  1  0.568621  0.308162  0.719549  1
  Fe  Fe195  1  0.635509  0.475254  0.694891  1
  Fe  Fe196  1  0.197604  0.484410  0.674294  1
  Fe  Fe197  1  0.135378  0.641852  0.694942  1
  Fe  Fe198  1  0.697060  0.985057  0.674249  1
  Fe  Fe199  1  0.634784  0.143044  0.695098  1
  Fe  Fe200  1  0.197290  0.151670  0.674145  1
  Fe  Fe201  1  0.134275  0.308645  0.694903  1
  Fe  Fe202  1  0.635173  0.808658  0.695008  1
  Fe  Fe203  1  0.197368  0.818191  0.674226  1
  Fe  Fe204  1  0.135171  0.975378  0.695024  1
  Fe  Fe205  1  0.878395  0.730215  0.693874  1
  Fe  Fe206  1  0.874999  0.394220  0.692904  1
  Fe  Fe207  1  0.948108  0.568675  0.673919  1
  Fe  Fe208  1  0.378674  0.563566  0.693803  1
  Fe  Fe209  1  0.447964  0.735420  0.673957  1
  Fe  Fe210  1  0.877854  0.063560  0.693918  1
  Fe  Fe211  1  0.946995  0.235222  0.674007  1
  Fe  Fe212  1  0.378085  0.229487  0.693434  1
  Fe  Fe213  1  0.451187  0.401476  0.673750  1
  Fe  Fe214  1  0.947690  0.902182  0.674000  1
  Fe  Fe215  1  0.378380  0.896978  0.693901  1
  Fe  Fe216  1  0.447983  0.069227  0.674027  1
  P  P217  1  0.112635  0.817040  0.287746  1
  P  P218  1  0.113025  0.484013  0.287704  1
  P  P219  1  0.051287  0.642739  0.315391  1
  P  P220  1  0.613454  0.650554  0.287802  1
  P  P221  1  0.551063  0.809181  0.315587  1
  P  P222  1  0.112458  0.150257  0.287718  1
  P  P223  1  0.051604  0.309040  0.315745  1
  P  P224  1  0.611616  0.316778  0.287902  1
  P  P225  1  0.551780  0.475152  0.315027  1
  P  P226  1  0.051095  0.975736  0.315528  1
  P  P227  1  0.612506  0.983610  0.287761  1
  P  P228  1  0.550955  0.142321  0.315508  1
  P  P229  1  0.795094  0.862270  0.304241  1
  P  P230  1  0.798017  0.530580  0.304867  1
  P  P231  1  0.859021  0.703821  0.279790  1
  P  P232  1  0.294767  0.695532  0.304103  1
  P  P233  1  0.359262  0.870460  0.279791  1
  P  P234  1  0.795066  0.195564  0.304205  1
  P  P235  1  0.863492  0.369707  0.280568  1
  P  P236  1  0.294874  0.362239  0.304259  1
  P  P237  1  0.359434  0.536885  0.279442  1
  P  P238  1  0.859286  0.037100  0.279770  1
  P  P239  1  0.294990  0.028851  0.304206  1
  P  P240  1  0.359177  0.203747  0.279775  1
  P  P241  1  0.126310  0.906415  0.273173  1
  P  P242  1  0.124819  0.573339  0.272187  1
  P  P243  1  0.062315  0.732320  0.296132  1
  P  P244  1  0.626188  0.739931  0.273222  1
  P  P245  1  0.562596  0.898725  0.296168  1
  P  P246  1  0.126138  0.239726  0.273203  1
  P  P247  1  0.064578  0.398684  0.296204  1
  P  P248  1  0.637007  0.406158  0.275937  1
  P  P249  1  0.563387  0.565468  0.296167  1
  P  P250  1  0.062562  0.065351  0.296126  1
  P  P251  1  0.626307  0.072997  0.273151  1
  P  P252  1  0.562647  0.231866  0.296179  1
  P  P253  1  0.783530  0.775611  0.322399  1
  P  P254  1  0.781011  0.442516  0.319854  1
  P  P255  1  0.845154  0.615399  0.295793  1
  P  P256  1  0.285684  0.608992  0.321764  1
  P  P257  1  0.342861  0.782060  0.295202  1
  P  P258  1  0.783354  0.108824  0.322326  1
  P  P259  1  0.842841  0.282038  0.295173  1
  P  P260  1  0.283100  0.275396  0.322401  1
  P  P261  1  0.342312  0.449067  0.295303  1
  P  P262  1  0.842844  0.948711  0.295223  1
  P  P263  1  0.283388  0.942160  0.322372  1
  P  P264  1  0.342751  0.115319  0.295193  1
  P  P265  1  0.982690  0.801755  0.341055  1
  P  P266  1  0.982675  0.468300  0.340889  1
  P  P267  1  0.918260  0.627797  0.364768  1
  P  P268  1  0.482699  0.635206  0.341018  1
  P  P269  1  0.418114  0.794374  0.364601  1
  P  P270  1  0.982489  0.134959  0.341001  1
  P  P271  1  0.918336  0.294368  0.364584  1
  P  P272  1  0.482213  0.301509  0.341164  1
  P  P273  1  0.418455  0.461145  0.364495  1
  P  P274  1  0.918253  0.961005  0.364571  1
  P  P275  1  0.482483  0.968307  0.341031  1
  P  P276  1  0.418135  0.127604  0.364538  1
  P  P277  1  0.665427  0.850713  0.356809  1
  P  P278  1  0.664360  0.517199  0.356322  1
  P  P279  1  0.731127  0.689433  0.331703  1
  P  P280  1  0.165409  0.683831  0.356724  1
  P  P281  1  0.230925  0.855781  0.331577  1
  P  P282  1  0.665273  0.183922  0.356722  1
  P  P283  1  0.731782  0.355861  0.331514  1
  P  P284  1  0.164939  0.350847  0.356777  1
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