# generated using pymatgen
data_FeP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   29.84991058
_cell_length_b   9.55903327
_cell_length_c   52.39024778
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.71157052
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeP4
_chemical_formula_sum   'Fe60 P240'
_cell_volume   14752.8346157
_cell_formula_units_Z   60
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  0.280098  0.475420  0.326813  1
  Fe  Fe2  1  0.604690  0.313578  0.357220  1
  Fe  Fe3  1  0.956997  0.645451  0.297220  1
  Fe  Fe4  1  0.363342  0.934084  0.335121  1
  Fe  Fe5  1  0.713621  0.263671  0.276259  1
  Fe  Fe6  1  0.039058  0.100931  0.305571  1
  Fe  Fe7  1  0.456997  0.645451  0.297220  1
  Fe  Fe8  1  0.780098  0.475420  0.326813  1
  Fe  Fe9  1  0.104690  0.313578  0.357220  1
  Fe  Fe10  1  0.539058  0.100931  0.305571  1
  Fe  Fe11  1  0.863342  0.934084  0.335121  1
  Fe  Fe12  1  0.213621  0.263671  0.276259  1
  Fe  Fe13  1  0.253585  0.987347  0.417932  1
  Fe  Fe14  1  0.577970  0.824833  0.448338  1
  Fe  Fe15  1  0.928465  0.152577  0.387447  1
  Fe  Fe16  1  0.336887  0.445251  0.425678  1
  Fe  Fe17  1  0.688504  0.772417  0.365388  1
  Fe  Fe18  1  0.012492  0.608977  0.395583  1
  Fe  Fe19  1  0.428465  0.152577  0.387447  1
  Fe  Fe20  1  0.753585  0.987347  0.417932  1
  Fe  Fe21  1  0.077970  0.824833  0.448338  1
  Fe  Fe22  1  0.512492  0.608977  0.395583  1
  Fe  Fe23  1  0.836887  0.445251  0.425678  1
  Fe  Fe24  1  0.188504  0.772417  0.365388  1
  Fe  Fe25  1  0.226942  0.498229  0.509102  1
  Fe  Fe26  1  0.551212  0.335324  0.539292  1
  Fe  Fe27  1  0.902365  0.661602  0.478643  1
  Fe  Fe28  1  0.310289  0.956047  0.516866  1
  Fe  Fe29  1  0.661442  0.282325  0.456218  1
  Fe  Fe30  1  0.985712  0.119420  0.486407  1
  Fe  Fe31  1  0.402365  0.661602  0.478643  1
  Fe  Fe32  1  0.726942  0.498229  0.509102  1
  Fe  Fe33  1  0.051212  0.335324  0.539292  1
  Fe  Fe34  1  0.485712  0.119420  0.486407  1
  Fe  Fe35  1  0.810289  0.956047  0.516866  1
  Fe  Fe36  1  0.161442  0.282325  0.456218  1
  Fe  Fe37  1  0.200162  0.008672  0.599926  1
  Fe  Fe38  1  0.524150  0.845232  0.630122  1
  Fe  Fe39  1  0.875767  0.172398  0.569831  1
  Fe  Fe40  1  0.284189  0.465072  0.608062  1
  Fe  Fe41  1  0.634685  0.792816  0.547171  1
  Fe  Fe42  1  0.959069  0.630302  0.577578  1
  Fe  Fe43  1  0.375767  0.172398  0.569831  1
  Fe  Fe44  1  0.700162  0.008672  0.599926  1
  Fe  Fe45  1  0.024150  0.845232  0.630122  1
  Fe  Fe46  1  0.459069  0.630302  0.577578  1
  Fe  Fe47  1  0.784189  0.465072  0.608062  1
  Fe  Fe48  1  0.134685  0.792816  0.547171  1
  Fe  Fe49  1  0.173597  0.516718  0.689938  1
  Fe  Fe50  1  0.499034  0.353977  0.719250  1
  Fe  Fe51  1  0.849312  0.683565  0.660389  1
  Fe  Fe52  1  0.255658  0.972198  0.698289  1
  Fe  Fe53  1  0.607965  0.304071  0.638289  1
  Fe  Fe54  1  0.932557  0.142229  0.668696  1
  Fe  Fe55  1  0.349312  0.683565  0.660389  1
  Fe  Fe56  1  0.673597  0.516718  0.689938  1
  Fe  Fe57  1  0.999034  0.353977  0.719250  1
  Fe  Fe58  1  0.432557  0.142229  0.668696  1
  Fe  Fe59  1  0.755658  0.972198  0.698289  1
  Fe  Fe60  1  0.107965  0.304071  0.638289  1
  P  P61  1  0.492774  0.754215  0.325075  1
  P  P62  1  0.815903  0.588178  0.354482  1
  P  P63  1  0.165138  0.910118  0.294913  1
  P  P64  1  0.568568  0.463202  0.329997  1
  P  P65  1  0.892085  0.298214  0.359662  1
  P  P66  1  0.244706  0.624529  0.298986  1
  P  P67  1  0.313493  0.090385  0.354417  1
  P  P68  1  0.663004  0.419857  0.293972  1
  P  P69  1  0.988856  0.256165  0.324591  1
  P  P70  1  0.238340  0.874132  0.345338  1
  P  P71  1  0.589094  0.200169  0.284732  1
  P  P72  1  0.912915  0.038850  0.314879  1
  P  P73  1  0.330504  0.817888  0.306233  1
  P  P74  1  0.653061  0.658680  0.337805  1
  P  P75  1  0.004783  0.986545  0.277010  1
  P  P76  1  0.506711  0.487970  0.277294  1
  P  P77  1  0.828489  0.318926  0.305588  1
  P  P78  1  0.154144  0.156898  0.337277  1
  P  P79  1  0.250710  0.108045  0.301361  1
  P  P80  1  0.575628  0.952476  0.332813  1
  P  P81  1  0.928539  0.284311  0.272892  1
  P  P82  1  0.583191  0.710700  0.287313  1
  P  P83  1  0.906343  0.537525  0.315497  1
  P  P84  1  0.229869  0.372379  0.346153  1
  P  P85  1  0.315903  0.588178  0.354482  1
  P  P86  1  0.665138  0.910118  0.294913  1
  P  P87  1  0.992774  0.754215  0.325075  1
  P  P88  1  0.392085  0.298214  0.359662  1
  P  P89  1  0.744706  0.624529  0.298986  1
  P  P90  1  0.068568  0.463202  0.329997  1
  P  P91  1  0.488856  0.256165  0.324591  1
  P  P92  1  0.813493  0.090385  0.354417  1
  P  P93  1  0.163004  0.419857  0.293972  1
  P  P94  1  0.412915  0.038850  0.314879  1
  P  P95  1  0.738340  0.874132  0.345338  1
  P  P96  1  0.089094  0.200169  0.284732  1
  P  P97  1  0.504783  0.986545  0.277010  1
  P  P98  1  0.830504  0.817888  0.306233  1
  P  P99  1  0.153061  0.658680  0.337805  1
  P  P100  1  0.328489  0.318926  0.305588  1
  P  P101  1  0.654144  0.156898  0.337277  1
  P  P102  1  0.006711  0.487970  0.277294  1
  P  P103  1  0.428539  0.284311  0.272892  1
  P  P104  1  0.750710  0.108045  0.301361  1
  P  P105  1  0.075628  0.952476  0.332813  1
  P  P106  1  0.406343  0.537525  0.315497  1
  P  P107  1  0.729869  0.372379  0.346153  1
  P  P108  1  0.083191  0.710700  0.287313  1
  P  P109  1  0.464427  0.263128  0.415428  1
  P  P110  1  0.789122  0.099612  0.445850  1
  P  P111  1  0.140272  0.425241  0.385268  1
  P  P112  1  0.541387  0.972436  0.420964  1
  P  P113  1  0.865852  0.808952  0.451253  1
  P  P114  1  0.217121  0.134840  0.390554  1
  P  P115  1  0.287405  0.600596  0.445726  1
  P  P116  1  0.638733  0.927296  0.385289  1
  P  P117  1  0.962779  0.764565  0.415369  1
  P  P118  1  0.211615  0.386317  0.436935  1
  P  P119  1  0.562946  0.712780  0.376518  1
  P  P120  1  0.886943  0.549750  0.406417  1
  P  P121  1  0.301275  0.333048  0.397811  1
  P  P122  1  0.625869  0.170150  0.428361  1
  P  P123  1  0.976935  0.497045  0.367648  1
  P  P124  1  0.478149  0.996638  0.367796  1
  P  P125  1  0.803077  0.831897  0.397947  1
  P  P126  1  0.127738  0.669107  0.428548  1
  P  P127  1  0.224766  0.623415  0.392536  1
  P  P128  1  0.548992  0.461309  0.422929  1
  P  P129  1  0.900293  0.786877  0.362213  1
  P  P130  1  0.554462  0.211105  0.376864  1
  P  P131  1  0.878745  0.046803  0.406779  1
  P  P132  1  0.203576  0.883275  0.437372  1
  P  P133  1  0.289122  0.099612  0.445850  1
  P  P134  1  0.640272  0.425241  0.385268  1
  P  P135  1  0.964427  0.263128  0.415428  1
  P  P136  1  0.365852  0.808952  0.451253  1
  P  P137  1  0.717121  0.134840  0.390554  1
  P  P138  1  0.041387  0.972436  0.420964  1
  P  P139  1  0.462779  0.764565  0.415369  1
  P  P140  1  0.787405  0.600596  0.445726  1
  P  P141  1  0.138733  0.927296  0.385289  1
  P  P142  1  0.386943  0.549750  0.406417  1
  P  P143  1  0.711615  0.386317  0.436935  1
  P  P144  1  0.062946  0.712780  0.376518  1
  P  P145  1  0.476935  0.497045  0.367648  1
  P  P146  1  0.801275  0.333048  0.397811  1
  P  P147  1  0.125869  0.170150  0.428361  1
  P  P148  1  0.303077  0.831897  0.397947  1
  P  P149  1  0.627738  0.669107  0.428548  1
  P  P150  1  0.978149  0.996638  0.367796  1
  P  P151  1  0.400293  0.786877  0.362213  1
  P  P152  1  0.724766  0.623415  0.392536  1
  P  P153  1  0.048992  0.461309  0.422929  1
  P  P154  1  0.378745  0.046803  0.406779  1
  P  P155  1  0.703576  0.883275  0.437372  1
  P  P156  1  0.054462  0.211105  0.376864  1
  P  P157  1  0.437953  0.773825  0.506509  1
  P  P158  1  0.762598  0.610197  0.536986  1
  P  P159  1  0.113604  0.936728  0.476234  1
  P  P160  1  0.514707  0.482893  0.511935  1
  P  P161  1  0.839366  0.319560  0.542377  1
  P  P162  1  0.190441  0.645693  0.481730  1
  P  P163  1  0.260763  0.111499  0.536820  1
  P  P164  1  0.611810  0.437812  0.476098  1
  P  P165  1  0.936148  0.274803  0.506360  1
  P  P166  1  0.184881  0.897071  0.527945  1
  P  P167  1  0.535904  0.223664  0.467189  1
  P  P168  1  0.860367  0.060471  0.497581  1
  P  P169  1  0.274702  0.843824  0.489000  1
  P  P170  1  0.599050  0.680921  0.519275  1
  P  P171  1  0.950057  0.007452  0.458523  1
  P  P172  1  0.451892  0.506150  0.458689  1
  P  P173  1  0.776507  0.342846  0.489149  1
  P  P174  1  0.100845  0.179837  0.519411  1
  P  P175  1  0.197948  0.134756  0.483575  1
  P  P176  1  0.522213  0.971956  0.513779  1
  P  P177  1  0.873288  0.298089  0.453132  1
  P  P178  1  0.527773  0.720578  0.467564  1
  P  P179  1  0.852288  0.557178  0.497929  1
  P  P180  1  0.176751  0.393984  0.528320  1
  P  P181  1  0.262598  0.610197  0.536986  1
  P  P182  1  0.613604  0.936728  0.476234  1
  P  P183  1  0.937953  0.773825  0.506509  1
  P  P184  1  0.339366  0.319560  0.542377  1
  P  P185  1  0.690441  0.645693  0.481730  1
  P  P186  1  0.014707  0.482893  0.511935  1
  P  P187  1  0.436148  0.274803  0.506360  1
  P  P188  1  0.760763  0.111499  0.536820  1
  P  P189  1  0.111810  0.437812  0.476098  1
  P  P190  1  0.360367  0.060471  0.497581  1
  P  P191  1  0.684881  0.897071  0.527945  1
  P  P192  1  0.035904  0.223664  0.467189  1
  P  P193  1  0.450057  0.007452  0.458523  1
  P  P194  1  0.774702  0.843824  0.489000  1
  P  P195  1  0.099050  0.680921  0.519275  1
  P  P196  1  0.276507  0.342846  0.489149  1
  P  P197  1  0.600845  0.179837  0.519411  1
  P  P198  1  0.951892  0.506150  0.458689  1
  P  P199  1  0.373288  0.298089  0.453132  1
  P  P200  1  0.697948  0.134756  0.483575  1
  P  P201  1  0.022213  0.971956  0.513779  1
  P  P202  1  0.352288  0.557178  0.497929  1
  P  P203  1  0.676751  0.393984  0.528320  1
  P  P204  1  0.027773  0.720578  0.467564  1
  P  P205  1  0.411380  0.284601  0.597698  1
  P  P206  1  0.735720  0.120604  0.627861  1
  P  P207  1  0.086785  0.447498  0.567148  1
  P  P208  1  0.487889  0.994234  0.602973  1
  P  P209  1  0.812362  0.830772  0.633297  1
  P  P210  1  0.163662  0.156340  0.572581  1
  P  P211  1  0.234505  0.621011  0.627713  1
  P  P212  1  0.584917  0.948542  0.566961  1
  P  P213  1  0.909578  0.785752  0.597562  1
  P  P214  1  0.158193  0.406544  0.618645  1
  P  P215  1  0.509079  0.734374  0.558137  1
  P  P216  1  0.833909  0.570845  0.588730  1
  P  P217  1  0.248228  0.354521  0.580081  1
  P  P218  1  0.572383  0.192408  0.610241  1
  P  P219  1  0.923533  0.518037  0.549659  1
  P  P220  1  0.425249  0.017053  0.549784  1
  P  P221  1  0.749876  0.853083  0.580140  1
  P  P222  1  0.073921  0.690353  0.610220  1
  P  P223  1  0.171268  0.645213  0.574546  1
  P  P224  1  0.495534  0.482809  0.604956  1
  P  P225  1  0.846802  0.808697  0.544256  1
  P  P226  1  0.501040  0.231332  0.558574  1
  P  P227  1  0.825712  0.067899  0.589092  1
  P  P228  1  0.149708  0.904869  0.618992  1
  P  P229  1  0.235720  0.120604  0.627861  1
  P  P230  1  0.586785  0.447498  0.567148  1
  P  P231  1  0.911380  0.284601  0.597698  1
  P  P232  1  0.312362  0.830772  0.633297  1
  P  P233  1  0.663662  0.156340  0.572581  1
  P  P234  1  0.987889  0.994234  0.602973  1
  P  P235  1  0.409578  0.785752  0.597562  1
  P  P236  1  0.734505  0.621011  0.627713  1
  P  P237  1  0.084917  0.948542  0.566961  1
  P  P238  1  0.333909  0.570845  0.588730  1
  P  P239  1  0.658193  0.406544  0.618645  1
  P  P240  1  0.009079  0.734374  0.558137  1
  P  P241  1  0.423533  0.518037  0.549659  1
  P  P242  1  0.748228  0.354521  0.580081  1
  P  P243  1  0.072383  0.192408  0.610241  1
  P  P244  1  0.249876  0.853083  0.580140  1
  P  P245  1  0.573921  0.690353  0.610220  1
  P  P246  1  0.925249  0.017053  0.549784  1
  P  P247  1  0.346802  0.808697  0.544256  1
  P  P248  1  0.671268  0.645213  0.574546  1
  P  P249  1  0.995534  0.482809  0.604956  1
  P  P250  1  0.325712  0.067899  0.589092  1
  P  P251  1  0.649708  0.904869  0.618992  1
  P  P252  1  1.001040  0.231332  0.558574  1
  P  P253  1  0.382151  0.799761  0.689276  1
  P  P254  1  0.707872  0.631104  0.718499  1
  P  P255  1  0.059594  0.958968  0.657704  1
  P  P256  1  0.461944  0.509604  0.694148  1
  P  P257  1  0.784116  0.333338  0.722618  1
  P  P258  1  0.137027  0.665173  0.662696  1
  P  P259  1  0.205944  0.129679  0.718215  1
  P  P260  1  0.558511  0.460751  0.658232  1
  P  P261  1  0.884166  0.298722  0.689921  1
  P  P262  1  0.129463  0.906949  0.708196  1
  P  P263  1  0.482785  0.245270  0.649356  1
  P  P264  1  0.806311  0.080124  0.680012  1
  P  P265  1  0.219881  0.863434  0.670434  1
  P  P266  1  0.547516  0.707531  0.700596  1
  P  P267  1  0.896751  0.029470  0.641027  1
  P  P268  1  0.399161  0.527264  0.641092  1
  P  P269  1  0.723798  0.361484  0.670919  1
  P  P270  1  0.049651  0.197792  0.701537  1
  P  P271  1  0.144087  0.154447  0.665513  1
  P  P272  1  0.467949  0.993120  0.696523  1
  P  P273  1  0.820569  0.319435  0.635847  1
  P  P274  1  0.474315  0.743517  0.650171  1
  P  P275  1  0.799740  0.578799  0.680630  1
  P  P276  1  0.123560  0.417480  0.710778  1
  P  P277  1  0.207872  0.631104  0.718499  1
  P  P278  1  0.559594  0.958968  0.657704  1
  P  P279  1  0.882151  0.799761  0.689276  1
  P  P280  1  0.284116  0.333338  0.722618  1
  P  P281  1  0.637027  0.665173  0.662696  1
  P  P282  1  0.961944  0.509604  0.694148  1
  P  P283  1  0.384166  0.298722  0.689921  1
  P  P284  1  0.705944  0.129679  0.718215  1
  P  P285  1  0.058511  0.460751  0.658232  1
  P  P286  1  0.306311  0.080124  0.680012  1
  P  P287  1  0.629463  0.906949  0.708196  1
  P  P288  1  0.982785  0.245270  0.649356  1
  P  P289  1  0.396751  0.029470  0.641027  1
  P  P290  1  0.719881  0.863434  0.670434  1
  P  P291  1  0.047516  0.707531  0.700596  1
  P  P292  1  0.223798  0.361484  0.670919  1
  P  P293  1  0.549651  0.197792  0.701537  1
  P  P294  1  0.899161  0.527264  0.641092  1
  P  P295  1  0.320569  0.319435  0.635847  1
  P  P296  1  0.644087  0.154447  0.665513  1
  P  P297  1  0.967949  0.993120  0.696523  1
  P  P298  1  0.299740  0.578799  0.680630  1
  P  P299  1  0.623560  0.417480  0.710778  1
  P  P300  1  0.974315  0.743517  0.650171  1
