# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78766979
_cell_length_b   22.49319894
_cell_length_c   52.77652926
_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   'Fe36 P144'
_cell_volume   8057.73085941
_cell_formula_units_Z   36
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  1.002142  0.218907  0.325287  1
  Fe  Fe2  1  1.002142  0.948807  0.270913  1
  Fe  Fe3  1  1.002142  0.490264  0.380834  1
  Fe  Fe4  1  0.502142  0.131372  0.256636  1
  Fe  Fe5  1  0.502142  0.674218  0.365523  1
  Fe  Fe6  1  0.502142  0.404135  0.311029  1
  Fe  Fe7  1  0.502142  0.125925  0.408878  1
  Fe  Fe8  1  0.502142  0.854703  0.353246  1
  Fe  Fe9  1  0.502142  0.583593  0.297852  1
  Fe  Fe10  1  1.002142  0.039271  0.338280  1
  Fe  Fe11  1  1.002142  0.769698  0.284012  1
  Fe  Fe12  1  1.002142  0.309704  0.393929  1
  Fe  Fe13  1  1.002142  0.032563  0.492267  1
  Fe  Fe14  1  1.002142  0.761019  0.436353  1
  Fe  Fe15  1  1.002142  0.303390  0.547923  1
  Fe  Fe16  1  0.502142  0.945161  0.421766  1
  Fe  Fe17  1  0.502142  0.487207  0.532736  1
  Fe  Fe18  1  0.502142  0.216345  0.477310  1
  Fe  Fe19  1  0.502142  0.939010  0.575412  1
  Fe  Fe20  1  0.502142  0.667827  0.519868  1
  Fe  Fe21  1  0.502142  0.396965  0.464442  1
  Fe  Fe22  1  1.002142  0.851608  0.504911  1
  Fe  Fe23  1  1.002142  0.580781  0.449255  1
  Fe  Fe24  1  1.002142  0.123152  0.560825  1
  Fe  Fe25  1  1.002142  0.844900  0.658898  1
  Fe  Fe26  1  1.002142  0.574467  0.603249  1
  Fe  Fe27  1  1.002142  0.114473  0.713166  1
  Fe  Fe28  1  0.502142  0.758246  0.588300  1
  Fe  Fe29  1  0.502142  0.300579  0.699326  1
  Fe  Fe30  1  0.502142  0.029468  0.643932  1
  Fe  Fe31  1  0.502142  0.752799  0.740542  1
  Fe  Fe32  1  0.502142  0.480037  0.686149  1
  Fe  Fe33  1  0.502142  0.209953  0.631655  1
  Fe  Fe34  1  1.002142  0.665265  0.671891  1
  Fe  Fe35  1  1.002142  0.393907  0.616344  1
  Fe  Fe36  1  1.002142  0.935364  0.726264  1
  P  P37  1  0.502142  0.079727  0.372401  1
  P  P38  1  0.502142  0.807879  0.316800  1
  P  P39  1  0.502142  0.538386  0.261190  1
  P  P40  1  0.257829  0.194695  0.347958  1
  P  P41  1  0.260100  0.924519  0.292813  1
  P  P42  1  0.258396  0.465664  0.403358  1
  P  P43  1  0.502142  0.308088  0.318408  1
  P  P44  1  0.502142  0.034801  0.260784  1
  P  P45  1  0.502142  0.578706  0.373062  1
  P  P46  1  0.257978  0.063361  0.315701  1
  P  P47  1  0.253249  0.796075  0.260508  1
  P  P48  1  0.258057  0.334632  0.371527  1
  P  P49  1  0.502142  0.178087  0.292471  1
  P  P50  1  0.502142  0.720193  0.402075  1
  P  P51  1  0.502142  0.450355  0.347224  1
  P  P52  1  0.502142  0.950598  0.346394  1
  P  P53  1  0.502142  0.678578  0.288166  1
  P  P54  1  0.502142  0.221660  0.401674  1
  P  P55  1  0.746306  0.063361  0.315701  1
  P  P56  1  0.751035  0.796075  0.260508  1
  P  P57  1  0.746227  0.334632  0.371527  1
  P  P58  1  0.746455  0.194695  0.347958  1
  P  P59  1  0.744184  0.924519  0.292813  1
  P  P60  1  0.745889  0.465664  0.403358  1
  P  P61  1  1.002142  0.174130  0.288413  1
  P  P62  1  1.002142  0.714870  0.399823  1
  P  P63  1  1.002142  0.443769  0.344354  1
  P  P64  1  0.749003  0.287699  0.265850  1
  P  P65  1  0.758214  0.829973  0.375714  1
  P  P66  1  0.760770  0.558937  0.319639  1
  P  P67  1  1.002142  0.214048  0.401204  1
  P  P68  1  1.002142  0.943767  0.345975  1
  P  P69  1  1.002142  0.672514  0.288133  1
  P  P70  1  0.758818  0.970183  0.399490  1
  P  P71  1  0.758241  0.698395  0.342917  1
  P  P72  1  0.756309  0.427101  0.287645  1
  P  P73  1  1.002142  0.085164  0.374792  1
  P  P74  1  1.002142  0.815459  0.320143  1
  P  P75  1  1.002142  0.541298  0.265122  1
  P  P76  1  1.002142  0.043232  0.261535  1
  P  P77  1  1.002142  0.585948  0.373594  1
  P  P78  1  1.002142  0.314547  0.317638  1
  P  P79  1  0.245466  0.970183  0.399490  1
  P  P80  1  0.246043  0.698395  0.342917  1
  P  P81  1  0.247976  0.427101  0.287645  1
  P  P82  1  0.255281  0.287699  0.265850  1
  P  P83  1  0.246070  0.829973  0.375714  1
  P  P84  1  0.243514  0.558937  0.319639  1
  P  P85  1  0.502142  0.892467  0.539046  1
  P  P86  1  0.502142  0.621485  0.483454  1
  P  P87  1  0.502142  0.350632  0.428021  1
  P  P88  1  0.258849  0.007687  0.514578  1
  P  P89  1  0.258869  0.736491  0.458758  1
  P  P90  1  0.258859  0.278669  0.570298  1
  P  P91  1  0.502142  0.120678  0.484565  1
  P  P92  1  0.502142  0.849377  0.428851  1
  P  P93  1  0.502142  0.391557  0.540050  1
  P  P94  1  0.258849  0.876484  0.482600  1
  P  P95  1  0.258859  0.605502  0.426880  1
  P  P96  1  0.258869  0.147680  0.538420  1
  P  P97  1  0.502142  0.991705  0.458132  1
  P  P98  1  0.502142  0.533539  0.569157  1
  P  P99  1  0.502142  0.262687  0.513724  1
  P  P100  1  0.502142  0.763493  0.512613  1
  P  P101  1  0.502142  0.492614  0.457128  1
  P  P102  1  0.502142  0.034794  0.568327  1
  P  P103  1  0.745435  0.876484  0.482600  1
  P  P104  1  0.745425  0.605502  0.426880  1
  P  P105  1  0.745415  0.147680  0.538420  1
  P  P106  1  0.745435  0.007687  0.514578  1
  P  P107  1  0.745415  0.736491  0.458758  1
  P  P108  1  0.745425  0.278669  0.570298  1
  P  P109  1  1.002142  0.986078  0.455891  1
  P  P110  1  1.002142  0.527975  0.566880  1
  P  P111  1  1.002142  0.257123  0.511494  1
  P  P112  1  0.758715  0.101198  0.431282  1
  P  P113  1  0.758816  0.643036  0.542223  1
  P  P114  1  0.758890  0.372120  0.486781  1
  P  P115  1  1.002142  0.027269  0.567769  1
  P  P116  1  1.002142  0.755911  0.512059  1
  P  P117  1  1.002142  0.485131  0.456607  1
  P  P118  1  0.758715  0.782973  0.565895  1
  P  P119  1  0.758890  0.512051  0.510396  1
  P  P120  1  0.758816  0.241135  0.454955  1
  P  P121  1  1.002142  0.898093  0.541287  1
  P  P122  1  1.002142  0.627048  0.485683  1
  P  P123  1  1.002142  0.356196  0.430298  1
  P  P124  1  1.002142  0.856902  0.429409  1
  P  P125  1  1.002142  0.399040  0.540570  1
  P  P126  1  1.002142  0.128260  0.485118  1
  P  P127  1  0.245569  0.782973  0.565895  1
  P  P128  1  0.245394  0.512051  0.510396  1
  P  P129  1  0.245468  0.241135  0.454955  1
  P  P130  1  0.245569  0.101198  0.431282  1
  P  P131  1  0.245468  0.643036  0.542223  1
  P  P132  1  0.245394  0.372120  0.486781  1
  P  P133  1  0.502142  0.706084  0.704707  1
  P  P134  1  0.502142  0.433817  0.649954  1
  P  P135  1  0.502142  0.163978  0.595102  1
  P  P136  1  0.257978  0.820810  0.681476  1
  P  P137  1  0.258057  0.549539  0.625650  1
  P  P138  1  0.253249  0.088096  0.736669  1
  P  P139  1  0.502142  0.933573  0.650783  1
  P  P140  1  0.502142  0.662512  0.595504  1
  P  P141  1  0.502142  0.205594  0.709011  1
  P  P142  1  0.257829  0.689476  0.649219  1
  P  P143  1  0.258396  0.418507  0.593820  1
  P  P144  1  0.260100  0.959652  0.704364  1
  P  P145  1  0.502142  0.804445  0.624777  1
  P  P146  1  0.502142  0.345786  0.735988  1
  P  P147  1  0.502142  0.076292  0.680378  1
  P  P148  1  0.502142  0.576083  0.678770  1
  P  P149  1  0.502142  0.305465  0.624116  1
  P  P150  1  0.502142  0.849371  0.736394  1
  P  P151  1  0.746455  0.689476  0.649219  1
  P  P152  1  0.745889  0.418507  0.593820  1
  P  P153  1  0.744184  0.959652  0.704364  1
  P  P154  1  0.746306  0.820810  0.681476  1
  P  P155  1  0.746227  0.549539  0.625650  1
  P  P156  1  0.751035  0.088096  0.736669  1
  P  P157  1  1.002142  0.799007  0.622386  1
  P  P158  1  1.002142  0.342873  0.732056  1
  P  P159  1  1.002142  0.068712  0.677035  1
  P  P160  1  0.758818  0.913988  0.597688  1
  P  P161  1  0.756309  0.457071  0.709532  1
  P  P162  1  0.758241  0.185776  0.654261  1
  P  P163  1  1.002142  0.840939  0.735643  1
  P  P164  1  1.002142  0.569625  0.679539  1
  P  P165  1  1.002142  0.298223  0.623584  1
  P  P166  1  0.749003  0.596473  0.731327  1
  P  P167  1  0.760770  0.325234  0.677539  1
  P  P168  1  0.758214  0.054198  0.621464  1
  P  P169  1  1.002142  0.710041  0.708764  1
  P  P170  1  1.002142  0.440402  0.652823  1
  P  P171  1  1.002142  0.169302  0.597354  1
  P  P172  1  1.002142  0.670123  0.595974  1
  P  P173  1  1.002142  0.211657  0.709045  1
  P  P174  1  1.002142  0.940404  0.651203  1
  P  P175  1  0.255281  0.596473  0.731327  1
  P  P176  1  0.243514  0.325234  0.677539  1
  P  P177  1  0.246070  0.054198  0.621464  1
  P  P178  1  0.245466  0.913988  0.597688  1
  P  P179  1  0.247976  0.457071  0.709532  1
  P  P180  1  0.246043  0.185776  0.654261  1
