# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.73822567
_cell_length_b   6.62504161
_cell_length_c   55.90995102
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe24 P96'
_cell_volume   5829.52931241
_cell_formula_units_Z   24
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  0.604762  0.404847  0.299655  1
  Fe  Fe2  1  0.104553  0.160517  0.349166  1
  Fe  Fe3  1  0.907760  0.660517  0.349166  1
  Fe  Fe4  1  0.407551  0.904847  0.299655  1
  Fe  Fe5  1  0.762341  0.885441  0.372142  1
  Fe  Fe6  1  0.249972  0.385441  0.372142  1
  Fe  Fe7  1  0.597907  0.156434  0.399346  1
  Fe  Fe8  1  0.097273  0.908318  0.459343  1
  Fe  Fe9  1  0.915040  0.408318  0.459343  1
  Fe  Fe10  1  0.414406  0.656434  0.399346  1
  Fe  Fe11  1  0.749464  0.682913  0.487094  1
  Fe  Fe12  1  0.262849  0.182913  0.487094  1
  Fe  Fe13  1  0.604855  0.907372  0.508802  1
  Fe  Fe14  1  0.099333  0.717256  0.572232  1
  Fe  Fe15  1  0.912980  0.217256  0.572232  1
  Fe  Fe16  1  0.407458  0.407372  0.508802  1
  Fe  Fe17  1  0.764273  0.470139  0.594016  1
  Fe  Fe18  1  0.248040  0.970139  0.594016  1
  Fe  Fe19  1  0.589465  0.754240  0.624669  1
  Fe  Fe20  1  0.093423  0.623923  0.682788  1
  Fe  Fe21  1  0.918890  0.123923  0.682788  1
  Fe  Fe22  1  0.422848  0.254240  0.624669  1
  Fe  Fe23  1  0.753732  0.305363  0.694397  1
  Fe  Fe24  1  0.258581  0.805363  0.694397  1
  P  P25  1  0.497159  0.402825  0.324087  1
  P  P26  1  0.007211  0.154579  0.314283  1
  P  P27  1  1.005102  0.654579  0.314283  1
  P  P28  1  0.515155  0.902825  0.324087  1
  P  P29  1  0.507079  0.905037  0.382337  1
  P  P30  1  1.005775  0.402689  0.364983  1
  P  P31  1  0.138322  0.402405  0.278236  1
  P  P32  1  0.663710  0.151760  0.358086  1
  P  P33  1  0.348603  0.651760  0.358086  1
  P  P34  1  0.873991  0.902405  0.278236  1
  P  P35  1  0.322088  0.647694  0.297205  1
  P  P36  1  0.828745  0.912617  0.333547  1
  P  P37  1  0.183568  0.412617  0.333547  1
  P  P38  1  0.690225  0.147694  0.297205  1
  P  P39  1  0.145898  0.905075  0.280444  1
  P  P40  1  0.664522  0.651365  0.358431  1
  P  P41  1  0.347791  0.151365  0.358431  1
  P  P42  1  0.866415  0.405075  0.280444  1
  P  P43  1  0.692140  0.659791  0.298477  1
  P  P44  1  0.187001  0.903424  0.335589  1
  P  P45  1  0.825312  0.403424  0.335589  1
  P  P46  1  0.320173  0.159791  0.298477  1
  P  P47  1  0.505234  0.405037  0.382337  1
  P  P48  1  0.006538  0.902689  0.364983  1
  P  P49  1  0.505106  0.158852  0.434334  1
  P  P50  1  1.004918  0.908148  0.424383  1
  P  P51  1  0.007395  0.408148  0.424383  1
  P  P52  1  0.507207  0.658852  0.434334  1
  P  P53  1  0.506943  0.672512  0.494263  1
  P  P54  1  0.006770  0.156005  0.476491  1
  P  P55  1  0.159967  0.143798  0.390024  1
  P  P56  1  0.659685  0.928382  0.468313  1
  P  P57  1  0.352628  0.428382  0.468313  1
  P  P58  1  0.852346  0.643798  0.390024  1
  P  P59  1  0.327219  0.395622  0.411248  1
  P  P60  1  0.827356  0.671483  0.447381  1
  P  P61  1  0.184957  0.171483  0.447381  1
  P  P62  1  0.685094  0.895622  0.411248  1
  P  P63  1  0.164478  0.646461  0.388148  1
  P  P64  1  0.663723  0.428286  0.469988  1
  P  P65  1  0.348590  0.928286  0.469988  1
  P  P66  1  0.847835  0.146461  0.388148  1
  P  P67  1  0.684896  0.402806  0.411839  1
  P  P68  1  0.185124  0.665300  0.446533  1
  P  P69  1  0.827189  0.165300  0.446533  1
  P  P70  1  0.327417  0.902806  0.411839  1
  P  P71  1  0.505370  0.172512  0.494263  1
  P  P72  1  1.005543  0.656005  0.476491  1
  P  P73  1  0.516167  0.945567  0.546205  1
  P  P74  1  0.008770  0.706691  0.535645  1
  P  P75  1  1.003543  0.206691  0.535645  1
  P  P76  1  0.496146  0.445567  0.546205  1
  P  P77  1  0.492135  0.551172  0.605569  1
  P  P78  1  0.999911  0.922269  0.589445  1
  P  P79  1  0.164055  0.914054  0.500332  1
  P  P80  1  0.672254  0.772524  0.585165  1
  P  P81  1  0.340059  0.272524  0.585165  1
  P  P82  1  0.848258  0.414054  0.500332  1
  P  P83  1  0.329845  0.163536  0.526742  1
  P  P84  1  0.840082  0.496901  0.558189  1
  P  P85  1  0.172231  0.996901  0.558189  1
  P  P86  1  0.682468  0.663536  0.526742  1
  P  P87  1  0.164473  0.412003  0.499576  1
  P  P88  1  0.662421  0.280291  0.576002  1
  P  P89  1  0.349892  0.780291  0.576002  1
  P  P90  1  0.847840  0.912003  0.499576  1
  P  P91  1  0.684266  0.176263  0.521010  1
  P  P92  1  0.184478  0.481581  0.556062  1
  P  P93  1  0.827835  0.981581  0.556062  1
  P  P94  1  0.328047  0.676263  0.521010  1
  P  P95  1  0.520178  0.051172  0.605569  1
  P  P96  1  0.012402  0.422269  0.589445  1
  P  P97  1  0.499769  0.744610  0.659873  1
  P  P98  1  0.014895  0.570860  0.646388  1
  P  P99  1  0.997418  0.070860  0.646388  1
  P  P100  1  0.512544  0.244610  0.659873  1
  P  P101  1  0.513124  0.319308  0.717330  1
  P  P102  1  0.030902  0.929789  0.702352  1
  P  P103  1  0.179550  0.672923  0.608764  1
  P  P104  1  0.663679  0.558592  0.688459  1
  P  P105  1  0.348634  0.058592  0.688459  1
  P  P106  1  0.832763  0.172923  0.608764  1
  P  P107  1  0.345560  0.944736  0.630802  1
  P  P108  1  0.830846  0.331374  0.661801  1
  P  P109  1  0.181467  0.831374  0.661801  1
  P  P110  1  0.666753  0.444736  0.630802  1
  P  P111  1  0.166536  0.180971  0.615797  1
  P  P112  1  0.671658  0.043926  0.698078  1
  P  P113  1  0.340655  0.543926  0.698078  1
  P  P114  1  0.845778  0.680971  0.615797  1
  P  P115  1  0.687159  0.949551  0.641897  1
  P  P116  1  0.160625  0.311522  0.676032  1
  P  P117  1  0.851688  0.811522  0.676032  1
  P  P118  1  0.325154  0.449551  0.641897  1
  P  P119  1  0.499189  0.819308  0.717330  1
  P  P120  1  0.981411  0.429789  0.702352  1
