# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70845205
_cell_length_b   13.74466874
_cell_length_c   45.86887993
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.04509063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe144 P72'
_cell_volume   5490.26418708
_cell_formula_units_Z   72
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  0.700515  0.698096  0.312687  1
  Fe  Fe2  1  0.700515  0.198096  0.312687  1
  Fe  Fe3  1  0.977027  0.922471  0.298467  1
  Fe  Fe4  1  0.977027  0.422471  0.298467  1
  Fe  Fe5  1  0.473515  0.978798  0.312234  1
  Fe  Fe6  1  0.473515  0.478798  0.312234  1
  Fe  Fe7  1  0.695488  0.868778  0.291527  1
  Fe  Fe8  1  0.695488  0.368778  0.291527  1
  Fe  Fe9  1  0.953256  0.111838  0.288828  1
  Fe  Fe10  1  0.953256  0.611838  0.288828  1
  Fe  Fe11  1  0.147645  0.768898  0.279764  1
  Fe  Fe12  1  0.147645  0.268898  0.279764  1
  Fe  Fe13  1  0.935979  0.580069  0.343061  1
  Fe  Fe14  1  0.935979  0.080069  0.343061  1
  Fe  Fe15  1  0.232285  0.830197  0.332148  1
  Fe  Fe16  1  0.232285  0.330197  0.332148  1
  Fe  Fe17  1  0.737543  0.888702  0.345112  1
  Fe  Fe18  1  0.737543  0.388702  0.345112  1
  Fe  Fe19  1  0.946168  0.770797  0.326494  1
  Fe  Fe20  1  0.946168  0.270797  0.326494  1
  Fe  Fe21  1  0.193488  0.010773  0.325608  1
  Fe  Fe22  1  0.193488  0.510773  0.325608  1
  Fe  Fe23  1  0.397901  0.667540  0.313127  1
  Fe  Fe24  1  0.397901  0.167540  0.313127  1
  Fe  Fe25  1  0.186586  0.486941  0.383432  1
  Fe  Fe26  1  0.186586  0.986941  0.383432  1
  Fe  Fe27  1  0.497968  0.724893  0.365645  1
  Fe  Fe28  1  0.497968  0.224893  0.365645  1
  Fe  Fe29  1  0.998292  0.797776  0.384017  1
  Fe  Fe30  1  0.998292  0.297776  0.384017  1
  Fe  Fe31  1  0.195991  0.670803  0.364891  1
  Fe  Fe32  1  0.195991  0.170803  0.364891  1
  Fe  Fe33  1  0.445519  0.910865  0.362340  1
  Fe  Fe34  1  0.445519  0.410865  0.362340  1
  Fe  Fe35  1  0.644936  0.568996  0.351785  1
  Fe  Fe36  1  0.644936  0.068996  0.351785  1
  Fe  Fe37  1  0.439368  0.397414  0.421702  1
  Fe  Fe38  1  0.439368  0.897414  0.421702  1
  Fe  Fe39  1  0.723682  0.624803  0.407914  1
  Fe  Fe40  1  0.723682  0.124803  0.407914  1
  Fe  Fe41  1  0.223768  0.682061  0.421493  1
  Fe  Fe42  1  0.223768  0.182061  0.421493  1
  Fe  Fe43  1  0.446044  0.571650  0.401655  1
  Fe  Fe44  1  0.446044  0.071650  0.401655  1
  Fe  Fe45  1  0.694647  0.811319  0.399441  1
  Fe  Fe46  1  0.694647  0.311319  0.399441  1
  Fe  Fe47  1  0.892556  0.471577  0.389379  1
  Fe  Fe48  1  0.892556  0.971577  0.389379  1
  Fe  Fe49  1  0.685255  0.287451  0.457216  1
  Fe  Fe50  1  0.685255  0.787451  0.457216  1
  Fe  Fe51  1  0.994705  0.525292  0.439588  1
  Fe  Fe52  1  0.994705  0.025292  0.439588  1
  Fe  Fe53  1  0.487496  0.588467  0.457065  1
  Fe  Fe54  1  0.487496  0.088467  0.457065  1
  Fe  Fe55  1  0.696748  0.471449  0.438511  1
  Fe  Fe56  1  0.696748  0.971449  0.438511  1
  Fe  Fe57  1  0.944114  0.711514  0.436440  1
  Fe  Fe58  1  0.944114  0.211514  0.436440  1
  Fe  Fe59  1  0.144076  0.370125  0.426451  1
  Fe  Fe60  1  0.144076  0.870125  0.426451  1
  Fe  Fe61  1  0.940028  0.196428  0.495579  1
  Fe  Fe62  1  0.940028  0.696428  0.495579  1
  Fe  Fe63  1  0.243740  0.425686  0.476827  1
  Fe  Fe64  1  0.243740  0.925686  0.476827  1
  Fe  Fe65  1  0.725933  0.481395  0.495492  1
  Fe  Fe66  1  0.725933  0.981395  0.495492  1
  Fe  Fe67  1  0.945594  0.372172  0.475454  1
  Fe  Fe68  1  0.945594  0.872172  0.475454  1
  Fe  Fe69  1  0.193694  0.611566  0.473517  1
  Fe  Fe70  1  0.193694  0.111566  0.473517  1
  Fe  Fe71  1  0.393240  0.269690  0.463217  1
  Fe  Fe72  1  0.393240  0.769690  0.463217  1
  Fe  Fe73  1  0.187280  0.096593  0.532665  1
  Fe  Fe74  1  0.187280  0.596593  0.532665  1
  Fe  Fe75  1  0.492162  0.326225  0.513533  1
  Fe  Fe76  1  0.492162  0.826225  0.513533  1
  Fe  Fe77  1  0.973419  0.382629  0.532518  1
  Fe  Fe78  1  0.973419  0.882629  0.532518  1
  Fe  Fe79  1  0.195061  0.272596  0.512394  1
  Fe  Fe80  1  0.195061  0.772596  0.512394  1
  Fe  Fe81  1  0.442353  0.512390  0.510447  1
  Fe  Fe82  1  0.442353  0.012390  0.510447  1
  Fe  Fe83  1  0.642705  0.169713  0.500098  1
  Fe  Fe84  1  0.642705  0.669713  0.500098  1
  Fe  Fe85  1  0.436378  0.997448  0.569334  1
  Fe  Fe86  1  0.436378  0.497448  0.569334  1
  Fe  Fe87  1  0.733987  0.229248  0.553336  1
  Fe  Fe88  1  0.733987  0.729248  0.553336  1
  Fe  Fe89  1  0.221638  0.283037  0.569052  1
  Fe  Fe90  1  0.221638  0.783037  0.569052  1
  Fe  Fe91  1  0.444224  0.172348  0.549362  1
  Fe  Fe92  1  0.444224  0.672348  0.549362  1
  Fe  Fe93  1  0.691710  0.412988  0.547254  1
  Fe  Fe94  1  0.691710  0.912988  0.547254  1
  Fe  Fe95  1  0.892784  0.069029  0.537206  1
  Fe  Fe96  1  0.892784  0.569029  0.537206  1
  Fe  Fe97  1  0.683987  0.879854  0.601457  1
  Fe  Fe98  1  0.683987  0.379854  0.601457  1
  Fe  Fe99  1  0.993822  0.125946  0.587598  1
  Fe  Fe100  1  0.993822  0.625946  0.587598  1
  Fe  Fe101  1  0.485449  0.188769  0.605015  1
  Fe  Fe102  1  0.485449  0.688769  0.605015  1
  Fe  Fe103  1  0.692374  0.072449  0.586422  1
  Fe  Fe104  1  0.692374  0.572449  0.586422  1
  Fe  Fe105  1  0.942335  0.312629  0.584259  1
  Fe  Fe106  1  0.942335  0.812629  0.584259  1
  Fe  Fe107  1  0.141036  0.969726  0.573991  1
  Fe  Fe108  1  0.141036  0.469726  0.573991  1
  Fe  Fe109  1  0.934499  0.793638  0.645737  1
  Fe  Fe110  1  0.934499  0.293638  0.645737  1
  Fe  Fe111  1  0.242155  0.026574  0.624531  1
  Fe  Fe112  1  0.242155  0.526574  0.624531  1
  Fe  Fe113  1  0.727830  0.095445  0.645441  1
  Fe  Fe114  1  0.727830  0.595445  0.645441  1
  Fe  Fe115  1  0.942077  0.971837  0.623764  1
  Fe  Fe116  1  0.942077  0.471837  0.623764  1
  Fe  Fe117  1  0.192029  0.214328  0.621509  1
  Fe  Fe118  1  0.192029  0.714328  0.621509  1
  Fe  Fe119  1  0.389113  0.871631  0.610608  1
  Fe  Fe120  1  0.389113  0.371631  0.610608  1
  Fe  Fe121  1  0.185766  0.702230  0.680680  1
  Fe  Fe122  1  0.185766  0.202230  0.680680  1
  Fe  Fe123  1  0.473370  0.931967  0.667237  1
  Fe  Fe124  1  0.473370  0.431967  0.667237  1
  Fe  Fe125  1  0.963583  0.982468  0.680363  1
  Fe  Fe126  1  0.963583  0.482468  0.680363  1
  Fe  Fe127  1  0.187675  0.872199  0.660609  1
  Fe  Fe128  1  0.187675  0.372199  0.660609  1
  Fe  Fe129  1  0.450247  0.115978  0.659207  1
  Fe  Fe130  1  0.450247  0.615978  0.659207  1
  Fe  Fe131  1  0.641384  0.766857  0.649956  1
  Fe  Fe132  1  0.641384  0.266857  0.649956  1
  Fe  Fe133  1  0.411271  0.582791  0.712383  1
  Fe  Fe134  1  0.411271  0.082791  0.712383  1
  Fe  Fe135  1  0.735849  0.838056  0.696558  1
  Fe  Fe136  1  0.735849  0.338056  0.696558  1
  Fe  Fe137  1  0.239911  0.901666  0.713023  1
  Fe  Fe138  1  0.239911  0.401666  0.713023  1
  Fe  Fe139  1  0.429484  0.776794  0.697230  1
  Fe  Fe140  1  0.429484  0.276794  0.697230  1
  Fe  Fe141  1  0.690764  0.017624  0.694034  1
  Fe  Fe142  1  0.690764  0.517624  0.694034  1
  Fe  Fe143  1  0.884830  0.667694  0.685054  1
  Fe  Fe144  1  0.884830  0.167694  0.685054  1
  P  P145  1  0.249560  0.924195  0.283586  1
  P  P146  1  0.249560  0.424195  0.283586  1
  P  P147  1  0.745703  0.024818  0.306455  1
  P  P148  1  0.745703  0.524818  0.306455  1
  P  P149  1  0.874109  0.770433  0.274009  1
  P  P150  1  0.874109  0.270433  0.274009  1
  P  P151  1  0.505368  0.814919  0.322059  1
  P  P152  1  0.505368  0.314919  0.322059  1
  P  P153  1  0.007816  0.918200  0.348072  1
  P  P154  1  0.007816  0.418200  0.348072  1
  P  P155  1  0.139161  0.669105  0.317445  1
  P  P156  1  0.139161  0.169105  0.317445  1
  P  P157  1  0.767059  0.718043  0.360934  1
  P  P158  1  0.767059  0.218043  0.360934  1
  P  P159  1  0.266747  0.816682  0.384527  1
  P  P160  1  0.266747  0.316682  0.384527  1
  P  P161  1  0.386140  0.569044  0.354345  1
  P  P162  1  0.386140  0.069044  0.354345  1
  P  P163  1  0.008060  0.618741  0.395877  1
  P  P164  1  0.008060  0.118741  0.395877  1
  P  P165  1  0.508180  0.719687  0.421337  1
  P  P166  1  0.508180  0.219687  0.421337  1
  P  P167  1  0.636850  0.466910  0.390322  1
  P  P168  1  0.636850  0.966910  0.390322  1
  P  P169  1  0.261869  0.518551  0.433542  1
  P  P170  1  0.261869  0.018551  0.433542  1
  P  P171  1  0.765063  0.617068  0.459177  1
  P  P172  1  0.765063  0.117068  0.459177  1
  P  P173  1  0.884943  0.367310  0.427755  1
  P  P174  1  0.884943  0.867310  0.427755  1
  P  P175  1  0.512277  0.418916  0.470533  1
  P  P176  1  0.512277  0.918916  0.470533  1
  P  P177  1  0.011328  0.517781  0.495363  1
  P  P178  1  0.011328  0.017781  0.495363  1
  P  P179  1  0.135415  0.267971  0.464716  1
  P  P180  1  0.135415  0.767971  0.464716  1
  P  P181  1  0.759531  0.316903  0.507607  1
  P  P182  1  0.759531  0.816903  0.507607  1
  P  P183  1  0.259263  0.418655  0.532154  1
  P  P184  1  0.259263  0.918655  0.532154  1
  P  P185  1  0.384783  0.167907  0.501580  1
  P  P186  1  0.384783  0.667907  0.501580  1
  P  P187  1  0.007309  0.217764  0.544750  1
  P  P188  1  0.007309  0.717764  0.544750  1
  P  P189  1  0.504524  0.318984  0.568594  1
  P  P190  1  0.504524  0.818984  0.568594  1
  P  P191  1  0.635492  0.069210  0.538417  1
  P  P192  1  0.635492  0.569210  0.538417  1
  P  P193  1  0.260993  0.119498  0.582093  1
  P  P194  1  0.260993  0.619498  0.582093  1
  P  P195  1  0.762644  0.217244  0.606443  1
  P  P196  1  0.762644  0.717244  0.606443  1
  P  P197  1  0.882731  0.969810  0.576254  1
  P  P198  1  0.882731  0.469810  0.576254  1
  P  P199  1  0.510452  0.016856  0.619161  1
  P  P200  1  0.510452  0.516856  0.619161  1
  P  P201  1  0.011275  0.119735  0.642517  1
  P  P202  1  0.011275  0.619735  0.642517  1
  P  P203  1  0.131602  0.869032  0.612885  1
  P  P204  1  0.131602  0.369032  0.612885  1
  P  P205  1  0.753903  0.916349  0.653325  1
  P  P206  1  0.753903  0.416349  0.653325  1
  P  P207  1  0.249340  0.023349  0.679168  1
  P  P208  1  0.249340  0.523349  0.679168  1
  P  P209  1  0.387515  0.769868  0.648810  1
  P  P210  1  0.387515  0.269868  0.648810  1
  P  P211  1  0.006586  0.816532  0.699005  1
  P  P212  1  0.006586  0.316532  0.699005  1
  P  P213  1  0.525268  0.917134  0.721123  1
  P  P214  1  0.525268  0.417134  0.721123  1
  P  P215  1  0.636182  0.675160  0.696853  1
  P  P216  1  0.636182  0.175160  0.696853  1
