# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.71517373
_cell_length_b   7.80810984
_cell_length_c   58.39002735
_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   'Fe30 P120'
_cell_volume   7164.7951729
_cell_formula_units_Z   30
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  0.591893  0.399839  0.276281  1
  Fe  Fe2  1  0.104575  0.570587  0.325995  1
  Fe  Fe3  1  0.908313  0.829994  0.281246  1
  Fe  Fe4  1  0.426249  0.119533  0.311088  1
  Fe  Fe5  1  0.761725  0.065902  0.277853  1
  Fe  Fe6  1  0.251348  0.821444  0.319972  1
  Fe  Fe7  1  0.598004  0.853914  0.358143  1
  Fe  Fe8  1  0.105198  0.058038  0.418191  1
  Fe  Fe9  1  0.911139  0.313588  0.372453  1
  Fe  Fe10  1  0.416462  0.592118  0.403639  1
  Fe  Fe11  1  0.762501  0.560529  0.365982  1
  Fe  Fe12  1  0.253296  0.303802  0.411853  1
  Fe  Fe13  1  0.605381  0.317673  0.449482  1
  Fe  Fe14  1  0.097841  0.521758  0.509446  1
  Fe  Fe15  1  0.911004  0.799855  0.463837  1
  Fe  Fe16  1  0.411288  0.061711  0.495039  1
  Fe  Fe17  1  0.758027  0.059424  0.456632  1
  Fe  Fe18  1  0.263763  0.817143  0.501435  1
  Fe  Fe19  1  0.605270  0.806206  0.541148  1
  Fe  Fe20  1  0.102868  1.018215  0.600490  1
  Fe  Fe21  1  0.918088  0.259131  0.555305  1
  Fe  Fe22  1  0.415832  0.568472  0.587176  1
  Fe  Fe23  1  0.752609  0.560407  0.547268  1
  Fe  Fe24  1  0.250242  0.264295  0.593504  1
  Fe  Fe25  1  0.600794  0.315728  0.632513  1
  Fe  Fe26  1  0.097693  0.459305  0.683356  1
  Fe  Fe27  1  0.910163  0.750394  0.647450  1
  Fe  Fe28  1  0.399995  1.019351  0.671679  1
  Fe  Fe29  1  0.764156  1.000951  0.639225  1
  Fe  Fe30  1  0.263686  0.790334  0.676736  1
  P  P31  1  0.500020  0.570618  0.293012  1
  P  P32  1  0.009642  0.360910  0.305834  1
  P  P33  1  0.999722  0.616247  0.261621  1
  P  P34  1  0.506000  0.803624  0.248252  1
  P  P35  1  0.506371  0.165379  0.274969  1
  P  P36  1  0.007609  0.784045  0.312757  1
  P  P37  1  0.164502  0.302294  0.260632  1
  P  P38  1  0.663657  0.622065  0.334005  1
  P  P39  1  0.350278  0.888676  0.288198  1
  P  P40  1  0.855128  0.044968  0.306871  1
  P  P41  1  0.341101  0.548904  0.255184  1
  P  P42  1  0.819358  0.864331  0.249394  1
  P  P43  1  0.186955  0.612538  0.295189  1
  P  P44  1  0.681986  0.286246  0.300673  1
  P  P45  1  0.163184  0.048391  0.305853  1
  P  P46  1  0.660611  0.875400  0.287487  1
  P  P47  1  0.349671  0.624296  0.334659  1
  P  P48  1  0.838077  0.290229  0.260811  1
  P  P49  1  0.672217  0.538756  0.252163  1
  P  P50  1  0.183990  0.866791  0.254108  1
  P  P51  1  0.824317  0.612033  0.296432  1
  P  P52  1  0.327614  0.305539  0.298929  1
  P  P53  1  0.509321  0.900629  0.324759  1
  P  P54  1  1.003625  0.041356  0.266019  1
  P  P55  1  0.507212  0.043031  0.380233  1
  P  P56  1  0.010308  0.850881  0.397131  1
  P  P57  1  1.005804  0.106695  0.351518  1
  P  P58  1  0.507126  0.303438  0.335894  1
  P  P59  1  0.509078  0.627474  0.371211  1
  P  P60  1  0.008765  0.273026  0.404565  1
  P  P61  1  0.161423  0.792184  0.351529  1
  P  P62  1  0.663553  0.097644  0.424681  1
  P  P63  1  0.351577  0.359772  0.380022  1
  P  P64  1  0.854300  0.534699  0.397485  1
  P  P65  1  0.329944  0.044768  0.342959  1
  P  P66  1  0.830829  0.361418  0.341230  1
  P  P67  1  0.185670  0.103132  0.386824  1
  P  P68  1  0.686984  0.782920  0.389000  1
  P  P69  1  0.166357  0.531824  0.397068  1
  P  P70  1  0.665347  0.358787  0.379717  1
  P  P71  1  0.350254  0.099955  0.425563  1
  P  P72  1  0.850499  0.785575  0.351250  1
  P  P73  1  0.690171  0.043762  0.344137  1
  P  P74  1  0.185947  0.362784  0.342838  1
  P  P75  1  0.830769  0.102844  0.388323  1
  P  P76  1  0.328313  0.790802  0.388547  1
  P  P77  1  0.506897  0.364121  0.417377  1
  P  P78  1  0.008247  0.529115  0.358864  1
  P  P79  1  0.510413  0.523851  0.470604  1
  P  P80  1  0.006975  0.332526  0.488035  1
  P  P81  1  1.005994  0.594114  0.442779  1
  P  P82  1  0.508501  0.783790  0.425300  1
  P  P83  1  0.509418  0.103958  0.463067  1
  P  P84  1  0.009389  0.753829  0.495840  1
  P  P85  1  0.161550  0.279731  0.443355  1
  P  P86  1  0.662468  0.584560  0.515818  1
  P  P87  1  0.354788  0.839280  0.469980  1
  P  P88  1  0.852562  1.019954  0.488568  1
  P  P89  1  0.329315  0.527608  0.434390  1
  P  P90  1  0.829430  0.846491  0.432762  1
  P  P91  1  0.186925  0.591691  0.478866  1
  P  P92  1  0.686755  0.271120  0.480691  1
  P  P93  1  0.165983  1.018747  0.487927  1
  P  P94  1  0.666000  0.843693  0.470817  1
  P  P95  1  0.350167  0.587332  0.515952  1
  P  P96  1  0.850423  0.274395  0.442434  1
  P  P97  1  0.687031  0.527790  0.434054  1
  P  P98  1  0.185869  0.846654  0.433970  1
  P  P99  1  0.829331  0.589352  0.479424  1
  P  P100  1  0.330462  0.272324  0.479270  1
  P  P101  1  0.508235  0.847314  0.508590  1
  P  P102  1  0.006923  1.014392  0.450140  1
  P  P103  1  0.509935  1.013021  0.561923  1
  P  P104  1  0.009017  0.813746  0.579039  1
  P  P105  1  0.008145  0.071990  0.533415  1
  P  P106  1  0.505978  0.267947  0.516258  1
  P  P107  1  0.507713  0.592047  0.553708  1
  P  P108  1  1.006267  0.227530  0.588627  1
  P  P109  1  0.164694  0.752742  0.533026  1
  P  P110  1  0.664879  0.077299  0.608187  1
  P  P111  1  0.350978  0.332970  0.562252  1
  P  P112  1  0.851211  0.493368  0.578795  1
  P  P113  1  0.331552  1.016508  0.526659  1
  P  P114  1  0.829071  0.332814  0.524675  1
  P  P115  1  0.182794  0.069545  0.568281  1
  P  P116  1  0.684989  0.757845  0.572658  1
  P  P117  1  0.163794  0.490147  0.579474  1
  P  P118  1  0.665988  0.330760  0.561746  1
  P  P119  1  0.350940  0.069668  0.605971  1
  P  P120  1  0.850957  0.760126  0.533665  1
  P  P121  1  0.686062  1.014842  0.525186  1
  P  P122  1  0.187753  0.328260  0.524484  1
  P  P123  1  0.827406  0.067207  0.570418  1
  P  P124  1  0.327863  0.755721  0.570457  1
  P  P125  1  0.508536  0.339441  0.599049  1
  P  P126  1  1.006587  0.491116  0.542080  1
  P  P127  1  0.505389  0.501896  0.653424  1
  P  P128  1  1.000969  0.288899  0.668405  1
  P  P129  1  1.002375  0.553352  0.624403  1
  P  P130  1  0.510549  0.757575  0.607179  1
  P  P131  1  0.505808  0.089138  0.644203  1
  P  P132  1  0.007010  0.704596  0.681897  1
  P  P133  1  0.162985  0.229502  0.626567  1
  P  P134  1  0.647833  0.558292  0.693936  1
  P  P135  1  0.356330  0.806668  0.647838  1
  P  P136  1  0.847997  0.969161  0.672716  1
  P  P137  1  0.328007  0.482363  0.616471  1
  P  P138  1  0.832812  0.808826  0.614774  1
  P  P139  1  0.181266  0.572191  0.657425  1
  P  P140  1  0.685424  0.224138  0.663440  1
  P  P141  1  0.163213  0.985641  0.673985  1
  P  P142  1  0.660177  0.809290  0.651616  1
  P  P143  1  0.331146  0.595081  0.697844  1
  P  P144  1  0.850444  0.228650  0.625774  1
  P  P145  1  0.690774  0.498449  0.616718  1
  P  P146  1  0.187093  0.810725  0.613852  1
  P  P147  1  0.824753  0.545953  0.662105  1
  P  P148  1  0.325075  0.252404  0.663606  1
  P  P149  1  0.498362  0.862135  0.691213  1
  P  P150  1  0.011309  0.957741  0.634752  1
