# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   35.57358421
_cell_length_b   21.51613982
_cell_length_c   50.28390059
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   56.98037178
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe144 P576'
_cell_volume   32271.2426726
_cell_formula_units_Z   144
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  0.587268  0.994925  0.326407  1
  Fe  Fe2  1  0.253934  0.994925  0.326407  1
  Fe  Fe3  1  0.570575  0.709344  0.368824  1
  Fe  Fe4  1  0.920601  0.994925  0.326407  1
  Fe  Fe5  1  0.237241  0.709344  0.368824  1
  Fe  Fe6  1  0.601766  0.283205  0.287704  1
  Fe  Fe7  1  0.903908  0.709344  0.368824  1
  Fe  Fe8  1  0.268432  0.283205  0.287704  1
  Fe  Fe9  1  0.935099  0.283205  0.287704  1
  Fe  Fe10  1  0.683154  0.709086  0.298322  1
  Fe  Fe11  1  0.349821  0.709086  0.298322  1
  Fe  Fe12  1  0.667980  0.421911  0.337569  1
  Fe  Fe13  1  0.016487  0.709086  0.298322  1
  Fe  Fe14  1  0.334647  0.421911  0.337569  1
  Fe  Fe15  1  0.699564  0.998017  0.256978  1
  Fe  Fe16  1  0.001313  0.421911  0.337569  1
  Fe  Fe17  1  0.366230  0.998017  0.256978  1
  Fe  Fe18  1  0.032897  0.998017  0.256978  1
  Fe  Fe19  1  0.737241  0.709344  0.368824  1
  Fe  Fe20  1  0.403908  0.709344  0.368824  1
  Fe  Fe21  1  0.768432  0.283205  0.287704  1
  Fe  Fe22  1  0.070575  0.709344  0.368824  1
  Fe  Fe23  1  0.435099  0.283205  0.287704  1
  Fe  Fe24  1  0.753934  0.994925  0.326407  1
  Fe  Fe25  1  0.101766  0.283205  0.287704  1
  Fe  Fe26  1  0.420601  0.994925  0.326407  1
  Fe  Fe27  1  0.087268  0.994925  0.326407  1
  Fe  Fe28  1  0.849821  0.709086  0.298322  1
  Fe  Fe29  1  0.516487  0.709086  0.298322  1
  Fe  Fe30  1  0.834647  0.421911  0.337569  1
  Fe  Fe31  1  0.183154  0.709086  0.298322  1
  Fe  Fe32  1  0.501313  0.421911  0.337569  1
  Fe  Fe33  1  0.866230  0.998017  0.256978  1
  Fe  Fe34  1  0.167980  0.421911  0.337569  1
  Fe  Fe35  1  0.532897  0.998017  0.256978  1
  Fe  Fe36  1  0.199564  0.998017  0.256978  1
  Fe  Fe37  1  0.539933  0.136332  0.452538  1
  Fe  Fe38  1  0.206599  0.136332  0.452538  1
  Fe  Fe39  1  0.524241  0.849966  0.494137  1
  Fe  Fe40  1  0.873266  0.136332  0.452538  1
  Fe  Fe41  1  0.190908  0.849966  0.494137  1
  Fe  Fe42  1  0.555208  0.423306  0.410995  1
  Fe  Fe43  1  0.857575  0.849966  0.494137  1
  Fe  Fe44  1  0.221874  0.423306  0.410995  1
  Fe  Fe45  1  0.888541  0.423306  0.410995  1
  Fe  Fe46  1  0.636808  0.849371  0.421491  1
  Fe  Fe47  1  0.303474  0.849371  0.421491  1
  Fe  Fe48  1  0.621405  0.562889  0.463158  1
  Fe  Fe49  1  0.970141  0.849371  0.421491  1
  Fe  Fe50  1  0.288072  0.562889  0.463158  1
  Fe  Fe51  1  0.652403  0.135905  0.380006  1
  Fe  Fe52  1  0.954739  0.562889  0.463158  1
  Fe  Fe53  1  0.319069  0.135905  0.380006  1
  Fe  Fe54  1  0.985736  0.135905  0.380006  1
  Fe  Fe55  1  0.690908  0.849966  0.494137  1
  Fe  Fe56  1  0.357575  0.849966  0.494137  1
  Fe  Fe57  1  0.721874  0.423306  0.410995  1
  Fe  Fe58  1  0.024241  0.849966  0.494137  1
  Fe  Fe59  1  0.388541  0.423306  0.410995  1
  Fe  Fe60  1  0.706599  0.136332  0.452538  1
  Fe  Fe61  1  0.055208  0.423306  0.410995  1
  Fe  Fe62  1  0.373266  0.136332  0.452538  1
  Fe  Fe63  1  0.039933  0.136332  0.452538  1
  Fe  Fe64  1  0.803474  0.849371  0.421491  1
  Fe  Fe65  1  0.470141  0.849371  0.421491  1
  Fe  Fe66  1  0.788072  0.562889  0.463158  1
  Fe  Fe67  1  0.136808  0.849371  0.421491  1
  Fe  Fe68  1  0.454739  0.562889  0.463158  1
  Fe  Fe69  1  0.819069  0.135905  0.380006  1
  Fe  Fe70  1  0.121405  0.562889  0.463158  1
  Fe  Fe71  1  0.485736  0.135905  0.380006  1
  Fe  Fe72  1  0.152403  0.135905  0.380006  1
  Fe  Fe73  1  0.493383  0.277192  0.577676  1
  Fe  Fe74  1  0.160050  0.277192  0.577676  1
  Fe  Fe75  1  0.477788  0.990658  0.619161  1
  Fe  Fe76  1  0.826716  0.277192  0.577676  1
  Fe  Fe77  1  0.144455  0.990658  0.619161  1
  Fe  Fe78  1  0.508786  0.563674  0.536010  1
  Fe  Fe79  1  0.811121  0.990658  0.619161  1
  Fe  Fe80  1  0.175452  0.563674  0.536010  1
  Fe  Fe81  1  0.842119  0.563674  0.536010  1
  Fe  Fe82  1  0.590258  0.990231  0.546629  1
  Fe  Fe83  1  0.256925  0.990231  0.546629  1
  Fe  Fe84  1  0.574983  0.703257  0.588172  1
  Fe  Fe85  1  0.923591  0.990231  0.546629  1
  Fe  Fe86  1  0.241650  0.703257  0.588172  1
  Fe  Fe87  1  0.605950  0.276597  0.505030  1
  Fe  Fe88  1  0.908316  0.703257  0.588172  1
  Fe  Fe89  1  0.272616  0.276597  0.505030  1
  Fe  Fe90  1  0.939283  0.276597  0.505030  1
  Fe  Fe91  1  0.644455  0.990658  0.619161  1
  Fe  Fe92  1  0.311121  0.990658  0.619161  1
  Fe  Fe93  1  0.675452  0.563674  0.536010  1
  Fe  Fe94  1  0.977788  0.990658  0.619161  1
  Fe  Fe95  1  0.342119  0.563674  0.536010  1
  Fe  Fe96  1  0.660050  0.277192  0.577676  1
  Fe  Fe97  1  0.008786  0.563674  0.536010  1
  Fe  Fe98  1  0.326716  0.277192  0.577676  1
  Fe  Fe99  1  0.993383  0.277192  0.577676  1
  Fe  Fe100  1  0.756925  0.990231  0.546629  1
  Fe  Fe101  1  0.423591  0.990231  0.546629  1
  Fe  Fe102  1  0.741650  0.703257  0.588172  1
  Fe  Fe103  1  0.090258  0.990231  0.546629  1
  Fe  Fe104  1  0.408316  0.703257  0.588172  1
  Fe  Fe105  1  0.772616  0.276597  0.505030  1
  Fe  Fe106  1  0.074983  0.703257  0.588172  1
  Fe  Fe107  1  0.439283  0.276597  0.505030  1
  Fe  Fe108  1  0.105950  0.276597  0.505030  1
  Fe  Fe109  1  0.447037  0.417477  0.700845  1
  Fe  Fe110  1  0.113704  0.417477  0.700845  1
  Fe  Fe111  1  0.430627  0.128546  0.742189  1
  Fe  Fe112  1  0.780370  0.417477  0.700845  1
  Fe  Fe113  1  0.097294  0.128546  0.742189  1
  Fe  Fe114  1  0.462211  0.704653  0.661598  1
  Fe  Fe115  1  0.763960  0.128546  0.742189  1
  Fe  Fe116  1  0.128877  0.704653  0.661598  1
  Fe  Fe117  1  0.795544  0.704653  0.661598  1
  Fe  Fe118  1  0.542923  0.131638  0.672760  1
  Fe  Fe119  1  0.209590  0.131638  0.672760  1
  Fe  Fe120  1  0.528425  0.843358  0.711463  1
  Fe  Fe121  1  0.876257  0.131638  0.672760  1
  Fe  Fe122  1  0.195092  0.843358  0.711463  1
  Fe  Fe123  1  0.559616  0.417219  0.630344  1
  Fe  Fe124  1  0.861758  0.843358  0.711463  1
  Fe  Fe125  1  0.226283  0.417219  0.630344  1
  Fe  Fe126  1  0.892950  0.417219  0.630344  1
  Fe  Fe127  1  0.597294  0.128546  0.742189  1
  Fe  Fe128  1  0.263960  0.128546  0.742189  1
  Fe  Fe129  1  0.628877  0.704653  0.661598  1
  Fe  Fe130  1  0.930627  0.128546  0.742189  1
  Fe  Fe131  1  0.295544  0.704653  0.661598  1
  Fe  Fe132  1  0.613704  0.417477  0.700845  1
  Fe  Fe133  1  0.962211  0.704653  0.661598  1
  Fe  Fe134  1  0.280370  0.417477  0.700845  1
  Fe  Fe135  1  0.947037  0.417477  0.700845  1
  Fe  Fe136  1  0.709590  0.131638  0.672760  1
  Fe  Fe137  1  0.376257  0.131638  0.672760  1
  Fe  Fe138  1  0.695092  0.843358  0.711463  1
  Fe  Fe139  1  0.042923  0.131638  0.672760  1
  Fe  Fe140  1  0.361758  0.843358  0.711463  1
  Fe  Fe141  1  0.726283  0.417219  0.630344  1
  Fe  Fe142  1  0.028425  0.843358  0.711463  1
  Fe  Fe143  1  0.392950  0.417219  0.630344  1
  Fe  Fe144  1  0.059616  0.417219  0.630344  1
  P  P145  1  0.813914  0.567720  0.282940  1
  P  P146  1  0.480580  0.567720  0.282940  1
  P  P147  1  0.798915  0.281667  0.325140  1
  P  P148  1  0.147247  0.567720  0.282940  1
  P  P149  1  0.465582  0.281667  0.325140  1
  P  P150  1  0.782304  0.995037  0.365130  1
  P  P151  1  0.132249  0.281667  0.325140  1
  P  P152  1  0.448971  0.995037  0.365130  1
  P  P153  1  0.115638  0.995037  0.365130  1
  P  P154  1  0.898515  0.394119  0.269831  1
  P  P155  1  0.565181  0.394119  0.269831  1
  P  P156  1  0.881029  0.108507  0.311496  1
  P  P157  1  0.231848  0.394119  0.269831  1
  P  P158  1  0.547695  0.108507  0.311496  1
  P  P159  1  0.865250  0.821567  0.352812  1
  P  P160  1  0.214362  0.108507  0.311496  1
  P  P161  1  0.531917  0.821567  0.352812  1
  P  P162  1  0.198584  0.821567  0.352812  1
  P  P163  1  0.628080  0.784948  0.324094  1
  P  P164  1  0.294747  0.784948  0.324094  1
  P  P165  1  0.614447  0.496002  0.365249  1
  P  P166  1  0.961414  0.784948  0.324094  1
  P  P167  1  0.281114  0.496002  0.365249  1
  P  P168  1  0.643695  0.072743  0.282362  1
  P  P169  1  0.947781  0.496002  0.365249  1
  P  P170  1  0.310361  0.072743  0.282362  1
  P  P171  1  0.977028  0.072743  0.282362  1
  P  P172  1  0.563473  0.743169  0.291103  1
  P  P173  1  0.230139  0.743169  0.291103  1
  P  P174  1  0.547653  0.457690  0.333015  1
  P  P175  1  0.896806  0.743169  0.291103  1
  P  P176  1  0.214319  0.457690  0.333015  1
  P  P177  1  0.578332  0.034641  0.249549  1
  P  P178  1  0.880986  0.457690  0.333015  1
  P  P179  1  0.244998  0.034641  0.249549  1
  P  P180  1  0.911665  0.034641  0.249549  1
  P  P181  1  0.658662  0.702902  0.259087  1
  P  P182  1  0.325328  0.702902  0.259087  1
  P  P183  1  0.639638  0.421879  0.298851  1
  P  P184  1  0.991995  0.702902  0.259087  1
  P  P185  1  0.306305  0.421879  0.298851  1
  P  P186  1  0.622897  0.136896  0.341727  1
  P  P187  1  0.972972  0.421879  0.298851  1
  P  P188  1  0.289564  0.136896  0.341727  1
  P  P189  1  0.956230  0.136896  0.341727  1
  P  P190  1  0.791319  0.634510  0.341583  1
  P  P191  1  0.457986  0.634510  0.341583  1
  P  P192  1  0.818768  0.210067  0.257978  1
  P  P193  1  0.124652  0.634510  0.341583  1
  P  P194  1  0.485434  0.210067  0.257978  1
  P  P195  1  0.808045  0.920373  0.298680  1
  P  P196  1  0.152101  0.210067  0.257978  1
  P  P197  1  0.474711  0.920373  0.298680  1
  P  P198  1  0.141378  0.920373  0.298680  1
  P  P199  1  0.572512  0.883131  0.270264  1
  P  P200  1  0.239178  0.883131  0.270264  1
  P  P201  1  0.555574  0.595370  0.312731  1
  P  P202  1  0.905845  0.883131  0.270264  1
  P  P203  1  0.222241  0.595370  0.312731  1
  P  P204  1  0.539830  0.310914  0.354626  1
  P  P205  1  0.888907  0.595370  0.312731  1
  P  P206  1  0.206497  0.310914  0.354626  1
  P  P207  1  0.873164  0.310914  0.354626  1
  P  P208  1  0.857590  0.673960  0.374338  1
  P  P209  1  0.524256  0.673960  0.374338  1
  P  P210  1  0.887843  0.248448  0.290147  1
  P  P211  1  0.190923  0.673960  0.374338  1
  P  P212  1  0.554510  0.248448  0.290147  1
  P  P213  1  0.873345  0.961330  0.332391  1
  P  P214  1  0.221177  0.248448  0.290147  1
  P  P215  1  0.540012  0.961330  0.332391  1
  P  P216  1  0.206679  0.961330  0.332391  1
  P  P217  1  0.615638  0.995037  0.365130  1
  P  P218  1  0.282304  0.995037  0.365130  1
  P  P219  1  0.647247  0.567720  0.282940  1
  P  P220  1  0.948971  0.995037  0.365130  1
  P  P221  1  0.313914  0.567720  0.282940  1
  P  P222  1  0.632249  0.281667  0.325140  1
  P  P223  1  0.980580  0.567720  0.282940  1
  P  P224  1  0.298915  0.281667  0.325140  1
  P  P225  1  0.965582  0.281667  0.325140  1
  P  P226  1  0.698584  0.821567  0.352812  1
  P  P227  1  0.365250  0.821567  0.352812  1
  P  P228  1  0.731848  0.394119  0.269831  1
  P  P229  1  0.031917  0.821567  0.352812  1
  P  P230  1  0.398515  0.394119  0.269831  1
  P  P231  1  0.714362  0.108507  0.311496  1
  P  P232  1  0.065181  0.394119  0.269831  1
  P  P233  1  0.381029  0.108507  0.311496  1
  P  P234  1  0.047695  0.108507  0.311496  1
  P  P235  1  0.794747  0.784948  0.324094  1
  P  P236  1  0.461414  0.784948  0.324094  1
  P  P237  1  0.781114  0.496002  0.365249  1
  P  P238  1  0.128080  0.784948  0.324094  1
  P  P239  1  0.447781  0.496002  0.365249  1
  P  P240  1  0.810361  0.072743  0.282362  1
  P  P241  1  0.114447  0.496002  0.365249  1
  P  P242  1  0.477028  0.072743  0.282362  1
  P  P243  1  0.143695  0.072743  0.282362  1
  P  P244  1  0.730139  0.743169  0.291103  1
  P  P245  1  0.396806  0.743169  0.291103  1
  P  P246  1  0.714319  0.457690  0.333015  1
  P  P247  1  0.063473  0.743169  0.291103  1
  P  P248  1  0.380986  0.457690  0.333015  1
  P  P249  1  0.744998  0.034641  0.249549  1
  P  P250  1  0.047653  0.457690  0.333015  1
  P  P251  1  0.411665  0.034641  0.249549  1
  P  P252  1  0.078332  0.034641  0.249549  1
  P  P253  1  0.825328  0.702902  0.259087  1
  P  P254  1  0.491995  0.702902  0.259087  1
  P  P255  1  0.806305  0.421879  0.298851  1
  P  P256  1  0.158662  0.702902  0.259087  1
  P  P257  1  0.472972  0.421879  0.298851  1
  P  P258  1  0.789564  0.136896  0.341727  1
  P  P259  1  0.139638  0.421879  0.298851  1
  P  P260  1  0.456230  0.136896  0.341727  1
  P  P261  1  0.122897  0.136896  0.341727  1
  P  P262  1  0.641378  0.920373  0.298680  1
  P  P263  1  0.308045  0.920373  0.298680  1
  P  P264  1  0.624652  0.634510  0.341583  1
  P  P265  1  0.974711  0.920373  0.298680  1
  P  P266  1  0.291319  0.634510  0.341583  1
  P  P267  1  0.652101  0.210067  0.257978  1
  P  P268  1  0.957986  0.634510  0.341583  1
  P  P269  1  0.318768  0.210067  0.257978  1
  P  P270  1  0.985434  0.210067  0.257978  1
  P  P271  1  0.722241  0.595370  0.312731  1
  P  P272  1  0.388907  0.595370  0.312731  1
  P  P273  1  0.706497  0.310914  0.354626  1
  P  P274  1  0.055574  0.595370  0.312731  1
  P  P275  1  0.373164  0.310914  0.354626  1
  P  P276  1  0.739178  0.883131  0.270264  1
  P  P277  1  0.039830  0.310914  0.354626  1
  P  P278  1  0.405845  0.883131  0.270264  1
  P  P279  1  0.072512  0.883131  0.270264  1
  P  P280  1  0.690923  0.673960  0.374338  1
  P  P281  1  0.357590  0.673960  0.374338  1
  P  P282  1  0.721177  0.248448  0.290147  1
  P  P283  1  0.024256  0.673960  0.374338  1
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