# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.70952769
_cell_length_b   6.88643212
_cell_length_c   49.67984661
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   122.69917510
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe96 P48'
_cell_volume   3659.04396462
_cell_formula_units_Z   48
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  0.272890  0.994323  0.301841  1
  Fe  Fe2  1  0.781646  0.120153  0.326415  1
  Fe  Fe3  1  0.991376  0.662135  0.305372  1
  Fe  Fe4  1  0.499026  0.770466  0.330814  1
  Fe  Fe5  1  0.183025  0.539783  0.325434  1
  Fe  Fe6  1  0.707077  0.422943  0.302431  1
  Fe  Fe7  1  0.359421  0.734031  0.291156  1
  Fe  Fe8  1  0.860330  0.838222  0.317417  1
  Fe  Fe9  1  0.486942  0.388603  0.323798  1
  Fe  Fe10  1  0.987762  0.285486  0.296604  1
  Fe  Fe11  1  0.117135  0.100891  0.316945  1
  Fe  Fe12  1  0.618948  0.996036  0.290297  1
  Fe  Fe13  1  0.286935  0.216100  0.354139  1
  Fe  Fe14  1  0.784221  0.305726  0.383864  1
  Fe  Fe15  1  0.001317  0.870326  0.359651  1
  Fe  Fe16  1  0.499994  0.963287  0.387061  1
  Fe  Fe17  1  0.180692  0.733049  0.381378  1
  Fe  Fe18  1  0.677881  0.636444  0.351841  1
  Fe  Fe19  1  0.363143  0.930667  0.343037  1
  Fe  Fe20  1  0.855720  0.026870  0.372835  1
  Fe  Fe21  1  0.486092  0.576975  0.377258  1
  Fe  Fe22  1  0.986810  0.481302  0.350392  1
  Fe  Fe23  1  0.123290  0.301259  0.372270  1
  Fe  Fe24  1  0.615607  0.189287  0.343099  1
  Fe  Fe25  1  0.285573  0.409550  0.410505  1
  Fe  Fe26  1  0.784821  0.507442  0.438444  1
  Fe  Fe27  1  0.999544  0.062431  0.414826  1
  Fe  Fe28  1  0.499774  0.162723  0.442487  1
  Fe  Fe29  1  0.180345  0.930390  0.436557  1
  Fe  Fe30  1  0.679118  0.830261  0.408717  1
  Fe  Fe31  1  0.357506  0.128086  0.400534  1
  Fe  Fe32  1  0.856832  0.225791  0.428283  1
  Fe  Fe33  1  0.485703  0.776328  0.433518  1
  Fe  Fe34  1  0.985834  0.678689  0.406381  1
  Fe  Fe35  1  0.122738  0.498971  0.427732  1
  Fe  Fe36  1  0.621373  0.398798  0.400138  1
  Fe  Fe37  1  0.285271  0.606957  0.466085  1
  Fe  Fe38  1  0.784938  0.705374  0.493922  1
  Fe  Fe39  1  0.999694  0.260689  0.470357  1
  Fe  Fe40  1  0.499717  0.360190  0.497993  1
  Fe  Fe41  1  0.179998  0.128124  0.492004  1
  Fe  Fe42  1  0.679451  0.028924  0.464200  1
  Fe  Fe43  1  0.357486  0.325499  0.455927  1
  Fe  Fe44  1  0.856786  0.423935  0.483794  1
  Fe  Fe45  1  0.485458  0.974203  0.489166  1
  Fe  Fe46  1  0.985502  0.875269  0.461448  1
  Fe  Fe47  1  0.122694  0.696959  0.483290  1
  Fe  Fe48  1  0.621781  0.596798  0.455455  1
  Fe  Fe49  1  0.285095  0.804577  0.521687  1
  Fe  Fe50  1  0.784624  0.902538  0.549505  1
  Fe  Fe51  1  0.999793  0.459056  0.525857  1
  Fe  Fe52  1  0.499315  0.557659  0.553575  1
  Fe  Fe53  1  0.180468  0.326173  0.547637  1
  Fe  Fe54  1  0.679478  0.226844  0.519799  1
  Fe  Fe55  1  0.357117  0.523272  0.511562  1
  Fe  Fe56  1  0.856867  0.622012  0.539285  1
  Fe  Fe57  1  0.485338  0.172149  0.544778  1
  Fe  Fe58  1  0.985419  0.073200  0.516961  1
  Fe  Fe59  1  0.122544  0.894830  0.538830  1
  Fe  Fe60  1  0.622041  0.795207  0.511033  1
  Fe  Fe61  1  0.284857  0.002835  0.577213  1
  Fe  Fe62  1  0.784119  0.099079  0.605004  1
  Fe  Fe63  1  0.999823  0.657007  0.581258  1
  Fe  Fe64  1  0.499794  0.757876  0.609175  1
  Fe  Fe65  1  0.180112  0.524492  0.603058  1
  Fe  Fe66  1  0.679513  0.424370  0.575294  1
  Fe  Fe67  1  0.356834  0.720911  0.567132  1
  Fe  Fe68  1  0.856638  0.819911  0.594640  1
  Fe  Fe69  1  0.485365  0.370037  0.599808  1
  Fe  Fe70  1  0.985413  0.271002  0.572468  1
  Fe  Fe71  1  0.122825  0.093199  0.594345  1
  Fe  Fe72  1  0.621975  0.992719  0.566657  1
  Fe  Fe73  1  0.285617  0.201562  0.633009  1
  Fe  Fe74  1  0.781082  0.289059  0.660589  1
  Fe  Fe75  1  0.001086  0.855643  0.636329  1
  Fe  Fe76  1  0.499230  0.955868  0.665394  1
  Fe  Fe77  1  0.181862  0.726455  0.658543  1
  Fe  Fe78  1  0.678259  0.621427  0.630578  1
  Fe  Fe79  1  0.356831  0.919872  0.622918  1
  Fe  Fe80  1  0.855882  0.017387  0.649876  1
  Fe  Fe81  1  0.485424  0.569574  0.658077  1
  Fe  Fe82  1  0.985505  0.468728  0.627662  1
  Fe  Fe83  1  0.123225  0.292665  0.649927  1
  Fe  Fe84  1  0.621444  0.188273  0.622327  1
  Fe  Fe85  1  0.284383  0.392553  0.688516  1
  Fe  Fe86  1  0.794377  0.536532  0.711134  1
  Fe  Fe87  1  0.980250  0.018383  0.692560  1
  Fe  Fe88  1  0.509758  0.157338  0.717355  1
  Fe  Fe89  1  0.165836  0.913853  0.711795  1
  Fe  Fe90  1  0.692688  0.804557  0.687145  1
  Fe  Fe91  1  0.360600  0.118906  0.677339  1
  Fe  Fe92  1  0.867420  0.218325  0.706190  1
  Fe  Fe93  1  0.484988  0.770223  0.710019  1
  Fe  Fe94  1  0.984307  0.656499  0.683480  1
  Fe  Fe95  1  0.114689  0.475634  0.705321  1
  Fe  Fe96  1  0.619994  0.380176  0.676560  1
  P  P97  1  0.150740  0.629471  0.278401  1
  P  P98  1  0.658415  0.723325  0.303892  1
  P  P99  1  0.319171  0.390306  0.306464  1
  P  P100  1  0.828539  0.305058  0.279274  1
  P  P101  1  0.488534  0.105275  0.301402  1
  P  P102  1  0.988131  0.963321  0.278201  1
  P  P103  1  0.153877  0.833840  0.338122  1
  P  P104  1  0.656308  0.935352  0.364290  1
  P  P105  1  0.321392  0.601471  0.364758  1
  P  P106  1  0.822712  0.502761  0.339399  1
  P  P107  1  0.488128  0.263507  0.364818  1
  P  P108  1  0.987074  0.170712  0.337962  1
  P  P109  1  0.156577  0.036853  0.392830  1
  P  P110  1  0.654177  0.132717  0.420405  1
  P  P111  1  0.322277  0.800783  0.420388  1
  P  P112  1  0.820097  0.700510  0.392967  1
  P  P113  1  0.488011  0.468226  0.420296  1
  P  P114  1  0.988213  0.369157  0.392943  1
  P  P115  1  0.155137  0.233528  0.448410  1
  P  P116  1  0.654888  0.331749  0.476112  1
  P  P117  1  0.321801  0.998564  0.476100  1
  P  P118  1  0.821358  0.899673  0.448484  1
  P  P119  1  0.488027  0.665221  0.476104  1
  P  P120  1  0.988252  0.565511  0.448565  1
  P  P121  1  0.154976  0.431010  0.503944  1
  P  P122  1  0.654794  0.530021  0.531655  1
  P  P123  1  0.321602  0.196727  0.531674  1
  P  P124  1  0.821342  0.097264  0.503954  1
  P  P125  1  0.488060  0.863294  0.531700  1
  P  P126  1  0.988173  0.764069  0.503946  1
  P  P127  1  0.155035  0.629166  0.559486  1
  P  P128  1  0.654089  0.727153  0.587421  1
  P  P129  1  0.322032  0.395600  0.587585  1
  P  P130  1  0.821196  0.294695  0.559407  1
  P  P131  1  0.487722  0.060163  0.587342  1
  P  P132  1  0.988231  0.962274  0.559407  1
  P  P133  1  0.154935  0.827723  0.615156  1
  P  P134  1  0.653543  0.922882  0.643585  1
  P  P135  1  0.322264  0.595043  0.643213  1
  P  P136  1  0.821107  0.491608  0.614759  1
  P  P137  1  0.488016  0.266203  0.642400  1
  P  P138  1  0.988445  0.159549  0.614942  1
  P  P139  1  0.152756  0.032162  0.671138  1
  P  P140  1  0.666093  0.122799  0.702299  1
  P  P141  1  0.316876  0.796814  0.700628  1
  P  P142  1  0.821397  0.689601  0.669498  1
  P  P143  1  0.486642  0.455364  0.703973  1
  P  P144  1  0.988223  0.357927  0.670086  1
