# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22789913
_cell_length_b   20.49237396
_cell_length_c   45.66679557
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.31353508
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe24 P96'
_cell_volume   5780.78321206
_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  0.442491  0.294614  0.379727  1
  Fe  Fe2  1  0.956858  0.597716  0.291091  1
  Fe  Fe3  1  0.883620  0.599280  0.376685  1
  Fe  Fe4  1  0.465212  0.082284  0.359243  1
  Fe  Fe5  1  0.653854  0.437558  0.377517  1
  Fe  Fe6  1  0.706808  0.842285  0.326021  1
  Fe  Fe7  1  0.344171  0.487029  0.492855  1
  Fe  Fe8  1  0.865651  0.808281  0.387258  1
  Fe  Fe9  1  0.777570  0.792099  0.486301  1
  Fe  Fe10  1  0.366526  0.276957  0.479376  1
  Fe  Fe11  1  0.567976  0.648223  0.489498  1
  Fe  Fe12  1  0.613210  0.043016  0.437453  1
  Fe  Fe13  1  0.261551  0.692375  0.603447  1
  Fe  Fe14  1  0.762752  0.008094  0.499877  1
  Fe  Fe15  1  0.685660  0.990327  0.599150  1
  Fe  Fe16  1  0.270752  0.477480  0.593134  1
  Fe  Fe17  1  0.471281  0.840945  0.600641  1
  Fe  Fe18  1  0.514501  0.242129  0.542093  1
  Fe  Fe19  1  0.287274  0.872331  0.714112  1
  Fe  Fe20  1  0.669074  0.202919  0.618945  1
  Fe  Fe21  1  0.673468  0.174239  0.706023  1
  Fe  Fe22  1  0.198380  0.688565  0.689512  1
  Fe  Fe23  1  0.530084  0.051394  0.710638  1
  Fe  Fe24  1  0.426449  0.442553  0.654210  1
  P  P25  1  0.168396  0.021956  0.286302  1
  P  P26  1  0.269449  0.567187  0.304528  1
  P  P27  1  0.217309  0.665413  0.362472  1
  P  P28  1  0.135921  0.121564  0.340640  1
  P  P29  1  0.640714  0.082076  0.312803  1
  P  P30  1  0.774617  0.512922  0.268736  1
  P  P31  1  0.515212  0.837638  0.370051  1
  P  P32  1  0.812633  0.339690  0.366336  1
  P  P33  1  0.888760  0.857826  0.277365  1
  P  P34  1  0.585638  0.347508  0.277783  1
  P  P35  1  0.405459  0.884494  0.297857  1
  P  P36  1  0.015180  0.500614  0.364659  1
  P  P37  1  0.041273  0.805933  0.342408  1
  P  P38  1  0.358072  0.187371  0.283598  1
  P  P39  1  0.560888  0.739033  0.312536  1
  P  P40  1  0.842517  0.240051  0.310292  1
  P  P41  1  0.839968  0.951311  0.333229  1
  P  P42  1  0.550130  0.450077  0.330318  1
  P  P43  1  0.321280  0.292094  0.333913  1
  P  P44  1  0.058344  0.707574  0.285889  1
  P  P45  1  0.043496  0.407894  0.307616  1
  P  P46  1  0.336181  0.975837  0.353978  1
  P  P47  1  0.600479  0.188595  0.370135  1
  P  P48  1  0.751949  0.606717  0.329594  1
  P  P49  1  0.106717  0.222447  0.394806  1
  P  P50  1  0.159656  0.766210  0.417195  1
  P  P51  1  0.113762  0.865320  0.473179  1
  P  P52  1  0.068389  0.320167  0.451260  1
  P  P53  1  0.555875  0.284492  0.428942  1
  P  P54  1  0.718698  0.701769  0.383739  1
  P  P55  1  0.423461  0.038528  0.482007  1
  P  P56  1  0.713723  0.539682  0.482049  1
  P  P57  1  0.784151  0.050511  0.386856  1
  P  P58  1  0.509556  0.545032  0.387441  1
  P  P59  1  0.295875  0.079250  0.409281  1
  P  P60  1  0.927572  0.698512  0.476900  1
  P  P61  1  0.944871  0.008808  0.455808  1
  P  P62  1  0.291392  0.388119  0.391170  1
  P  P63  1  0.475454  0.938758  0.425373  1
  P  P64  1  0.765741  0.438264  0.425267  1
  P  P65  1  0.747468  0.149748  0.442029  1
  P  P66  1  0.461173  0.646564  0.442130  1
  P  P67  1  0.259404  0.486265  0.445441  1
  P  P68  1  0.983056  0.911379  0.400546  1
  P  P69  1  0.966328  0.598274  0.423694  1
  P  P70  1  0.241669  0.174628  0.466325  1
  P  P71  1  0.510356  0.385041  0.485450  1
  P  P72  1  0.671419  0.802792  0.437637  1
  P  P73  1  0.012900  0.419909  0.506561  1
  P  P74  1  0.061065  0.965097  0.527996  1
  P  P75  1  0.020387  0.061969  0.583787  1
  P  P76  1  0.976899  0.519948  0.563518  1
  P  P77  1  0.460155  0.482576  0.542428  1
  P  P78  1  0.620821  0.899427  0.493906  1
  P  P79  1  0.343492  0.234594  0.592892  1
  P  P80  1  0.631116  0.739357  0.591135  1
  P  P81  1  0.705962  0.246680  0.497347  1
  P  P82  1  0.408289  0.747161  0.498234  1
  P  P83  1  0.185165  0.277022  0.523677  1
  P  P84  1  0.835733  0.896491  0.587812  1
  P  P85  1  0.834623  0.205991  0.569776  1
  P  P86  1  0.209328  0.585699  0.502363  1
  P  P87  1  0.381619  0.135649  0.537262  1
  P  P88  1  0.667669  0.637847  0.537359  1
  P  P89  1  0.654402  0.346011  0.554527  1
  P  P90  1  0.361052  0.846593  0.553827  1
  P  P91  1  0.162945  0.686222  0.556796  1
  P  P92  1  0.887101  0.110614  0.512922  1
  P  P93  1  0.871712  0.798488  0.533429  1
  P  P94  1  0.147244  0.374216  0.579665  1
  P  P95  1  0.418106  0.584678  0.597524  1
  P  P96  1  0.572147  0.999891  0.549987  1
  P  P97  1  0.926852  0.622328  0.619091  1
  P  P98  1  0.986216  0.160036  0.638391  1
  P  P99  1  0.956240  0.258555  0.695956  1
  P  P100  1  0.884774  0.721750  0.679535  1
  P  P101  1  0.403488  0.682081  0.650977  1
  P  P102  1  0.525016  0.095962  0.608272  1
  P  P103  1  0.245602  0.428168  0.702791  1
  P  P104  1  0.613787  0.937546  0.709931  1
  P  P105  1  0.617888  0.446774  0.610034  1
  P  P106  1  0.320334  0.942815  0.611887  1
  P  P107  1  0.091858  0.478657  0.637768  1
  P  P108  1  0.900759  0.093643  0.704468  1
  P  P109  1  0.726752  0.399673  0.682295  1
  P  P110  1  0.115420  0.784940  0.616567  1
  P  P111  1  0.291455  0.333054  0.647192  1
  P  P112  1  0.595174  0.836467  0.648846  1
  P  P113  1  0.578137  0.546009  0.667536  1
  P  P114  1  0.329110  0.036606  0.670625  1
  P  P115  1  0.102637  0.879056  0.674206  1
  P  P116  1  0.794791  0.307975  0.626335  1
  P  P117  1  0.815338  0.993754  0.645309  1
  P  P118  1  0.086743  0.579210  0.693485  1
  P  P119  1  0.401559  0.770868  0.714040  1
  P  P120  1  0.480034  0.199226  0.666772  1
