# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.78934098
_cell_length_b   14.13247458
_cell_length_c   45.78932713
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.57667544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe120 C48'
_cell_volume   3056.06979181
_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  0.038191  0.881918  0.279359  1
  Fe  Fe2  1  0.875157  0.576106  0.316631  1
  Fe  Fe3  1  0.731320  0.276378  0.355900  1
  Fe  Fe4  1  0.283942  0.682078  0.381220  1
  Fe  Fe5  1  0.591643  0.291295  0.307348  1
  Fe  Fe6  1  0.434187  0.985853  0.343787  1
  Fe  Fe7  1  0.255730  0.703246  0.332398  1
  Fe  Fe8  1  0.108072  0.401506  0.368492  1
  Fe  Fe9  1  0.410437  0.008640  0.294221  1
  Fe  Fe10  1  0.556378  0.854661  0.312971  1
  Fe  Fe11  1  0.399841  0.552459  0.350356  1
  Fe  Fe12  1  0.719610  0.161173  0.276881  1
  Fe  Fe13  1  0.764946  0.709441  0.349095  1
  Fe  Fe14  1  0.611097  0.404898  0.385939  1
  Fe  Fe15  1  0.919539  0.013604  0.311637  1
  Fe  Fe16  1  0.804020  0.728475  0.297975  1
  Fe  Fe17  1  0.657607  0.428493  0.337728  1
  Fe  Fe18  1  0.505186  0.123151  0.373887  1
  Fe  Fe19  1  0.995515  0.902985  0.377243  1
  Fe  Fe20  1  0.313568  0.511494  0.303362  1
  Fe  Fe21  1  0.156636  0.205702  0.341209  1
  Fe  Fe22  1  0.510826  0.834548  0.362303  1
  Fe  Fe23  1  0.828341  0.441060  0.287022  1
  Fe  Fe24  1  0.664786  0.138969  0.326469  1
  Fe  Fe25  1  0.060613  0.861496  0.330474  1
  Fe  Fe26  1  0.906475  0.557210  0.367054  1
  Fe  Fe27  1  0.211677  0.167221  0.293380  1
  Fe  Fe28  1  0.332177  0.670885  0.285022  1
  Fe  Fe29  1  0.163978  0.355739  0.321569  1
  Fe  Fe30  1  0.019015  0.054878  0.358672  1
  Fe  Fe31  1  0.580196  0.970727  0.392036  1
  Fe  Fe32  1  0.428434  0.666402  0.429316  1
  Fe  Fe33  1  0.276391  0.361725  0.466360  1
  Fe  Fe34  1  0.825953  0.768062  0.491910  1
  Fe  Fe35  1  0.128155  0.377363  0.417809  1
  Fe  Fe36  1  0.978119  0.072728  0.454973  1
  Fe  Fe37  1  0.804189  0.791092  0.442886  1
  Fe  Fe38  1  0.652168  0.486133  0.479898  1
  Fe  Fe39  1  0.956440  0.095137  0.406018  1
  Fe  Fe40  1  0.098369  0.943411  0.424197  1
  Fe  Fe41  1  0.946980  0.638464  0.461361  1
  Fe  Fe42  1  0.252036  0.248666  0.387511  1
  Fe  Fe43  1  0.307503  0.795786  0.459942  1
  Fe  Fe44  1  0.155335  0.490997  0.496921  1
  Fe  Fe45  1  0.458870  0.100538  0.422934  1
  Fe  Fe46  1  0.351737  0.818529  0.410941  1
  Fe  Fe47  1  0.200611  0.513196  0.447716  1
  Fe  Fe48  1  0.048143  0.208733  0.484760  1
  Fe  Fe49  1  0.540489  0.988746  0.488363  1
  Fe  Fe50  1  0.845880  0.598100  0.414468  1
  Fe  Fe51  1  0.692315  0.293528  0.451362  1
  Fe  Fe52  1  0.054098  0.920804  0.473438  1
  Fe  Fe53  1  0.357426  0.530208  0.399604  1
  Fe  Fe54  1  0.205463  0.225658  0.436520  1
  Fe  Fe55  1  0.601922  0.948095  0.441282  1
  Fe  Fe56  1  0.450166  0.643518  0.478315  1
  Fe  Fe57  1  0.753047  0.253215  0.404490  1
  Fe  Fe58  1  0.864405  0.749880  0.396023  1
  Fe  Fe59  1  0.713816  0.445694  0.432851  1
  Fe  Fe60  1  0.561246  0.140766  0.469883  1
  Fe  Fe61  1  0.124113  0.056778  0.503289  1
  Fe  Fe62  1  0.971947  0.752113  0.540227  1
  Fe  Fe63  1  0.821911  0.447478  0.577391  1
  Fe  Fe64  1  0.369869  0.854114  0.603164  1
  Fe  Fe65  1  0.673675  0.463116  0.528839  1
  Fe  Fe66  1  0.521632  0.158439  0.565883  1
  Fe  Fe67  1  0.348144  0.876746  0.553918  1
  Fe  Fe68  1  0.197019  0.571626  0.590709  1
  Fe  Fe69  1  0.499900  0.181322  0.516884  1
  Fe  Fe70  1  0.642563  0.029055  0.535258  1
  Fe  Fe71  1  0.491196  0.724302  0.572265  1
  Fe  Fe72  1  0.794731  0.333844  0.498279  1
  Fe  Fe73  1  0.851697  0.881430  0.571003  1
  Fe  Fe74  1  0.698030  0.576174  0.607688  1
  Fe  Fe75  1  0.003085  0.186376  0.533838  1
  Fe  Fe76  1  0.895968  0.904037  0.521762  1
  Fe  Fe77  1  0.744603  0.599183  0.558680  1
  Fe  Fe78  1  0.592640  0.294632  0.595596  1
  Fe  Fe79  1  0.085661  0.074960  0.599177  1
  Fe  Fe80  1  0.388820  0.684074  0.525317  1
  Fe  Fe81  1  0.236250  0.379146  0.562348  1
  Fe  Fe82  1  0.598329  0.006312  0.584259  1
  Fe  Fe83  1  0.901923  0.616108  0.510440  1
  Fe  Fe84  1  0.749455  0.311645  0.547483  1
  Fe  Fe85  1  0.145877  0.033749  0.552314  1
  Fe  Fe86  1  0.993625  0.729703  0.589181  1
  Fe  Fe87  1  0.297898  0.338707  0.515302  1
  Fe  Fe88  1  0.409577  0.836095  0.506836  1
  Fe  Fe89  1  0.257751  0.531313  0.543838  1
  Fe  Fe90  1  0.104185  0.226741  0.580732  1
  Fe  Fe91  1  0.666124  0.142762  0.613979  1
  Fe  Fe92  1  0.515879  0.838988  0.651413  1
  Fe  Fe93  1  0.358423  0.533546  0.687851  1
  Fe  Fe94  1  0.911875  0.942922  0.715840  1
  Fe  Fe95  1  0.218746  0.548463  0.639300  1
  Fe  Fe96  1  0.074908  0.248734  0.678568  1
  Fe  Fe97  1  0.889453  0.963344  0.664726  1
  Fe  Fe98  1  0.738389  0.657620  0.701819  1
  Fe  Fe99  1  0.043591  0.267630  0.628145  1
  Fe  Fe100  1  0.185120  0.115400  0.646105  1
  Fe  Fe101  1  0.030527  0.811237  0.683563  1
  Fe  Fe102  1  0.338969  0.419942  0.609260  1
  Fe  Fe103  1  0.393688  0.970179  0.682228  1
  Fe  Fe104  1  0.230456  0.663667  0.718319  1
  Fe  Fe105  1  0.550225  0.272382  0.644843  1
  Fe  Fe106  1  0.439240  0.990292  0.632896  1
  Fe  Fe107  1  0.285280  0.685872  0.668731  1
  Fe  Fe108  1  0.121725  0.383780  0.708178  1
  Fe  Fe109  1  0.617889  0.153956  0.710177  1
  Fe  Fe110  1  0.931051  0.769962  0.636528  1
  Fe  Fe111  1  0.786088  0.469102  0.673631  1
  Fe  Fe112  1  0.146046  0.096366  0.697225  1
  Fe  Fe113  1  0.444880  0.701690  0.621312  1
  Fe  Fe114  1  0.292459  0.396347  0.657472  1
  Fe  Fe115  1  0.694336  0.121595  0.662801  1
  Fe  Fe116  1  0.539629  0.816201  0.700978  1
  Fe  Fe117  1  0.841994  0.423334  0.626708  1
  Fe  Fe118  1  0.954551  0.921855  0.617956  1
  Fe  Fe119  1  0.793429  0.619138  0.653990  1
  Fe  Fe120  1  0.636498  0.313346  0.691838  1
  C  C121  1  0.196409  0.785746  0.300422  1
  C  C122  1  0.054214  0.480070  0.335344  1
  C  C123  1  0.901426  0.176532  0.373620  1
  C  C124  1  0.779354  0.933371  0.344150  1
  C  C125  1  0.627678  0.628722  0.381572  1
  C  C126  1  0.935421  0.238126  0.308798  1
  C  C127  1  0.538102  0.633225  0.317917  1
  C  C128  1  0.385161  0.328225  0.354641  1
  C  C129  1  0.702342  0.939409  0.281725  1
  C  C130  1  0.114316  0.781687  0.363311  1
  C  C131  1  0.429473  0.394391  0.290582  1
  C  C132  1  0.268191  0.086243  0.325863  1
  C  C133  1  0.748376  0.871165  0.410174  1
  C  C134  1  0.596812  0.566572  0.447264  1
  C  C135  1  0.444582  0.261745  0.484246  1
  C  C136  1  0.322859  0.019980  0.455494  1
  C  C137  1  0.170643  0.715286  0.492486  1
  C  C138  1  0.473647  0.325106  0.418614  1
  C  C139  1  0.083522  0.719056  0.428827  1
  C  C140  1  0.931337  0.414260  0.465705  1
  C  C141  1  0.235782  0.023690  0.391618  1
  C  C142  1  0.657588  0.867920  0.473973  1
  C  C143  1  0.960769  0.477487  0.399904  1
  C  C144  1  0.809195  0.172406  0.437007  1
  C  C145  1  0.292478  0.956921  0.521227  1
  C  C146  1  0.140871  0.652434  0.558193  1
  C  C147  1  0.989297  0.347353  0.595295  1
  C  C148  1  0.866544  0.105785  0.566372  1
  C  C149  1  0.714284  0.801150  0.603581  1
  C  C150  1  0.018729  0.410580  0.529494  1
  C  C151  1  0.627207  0.804861  0.539706  1
  C  C152  1  0.476419  0.499735  0.576585  1
  C  C153  1  0.779423  0.109555  0.502713  1
  C  C154  1  0.201690  0.953675  0.585026  1
  C  C155  1  0.505484  0.563096  0.510953  1
  C  C156  1  0.353254  0.258269  0.547935  1
  C  C157  1  0.835750  0.043154  0.631889  1
  C  C158  1  0.681875  0.738597  0.669337  1
  C  C159  1  0.520593  0.430449  0.704617  1
  C  C160  1  0.411964  0.191616  0.677283  1
  C  C161  1  0.247724  0.885431  0.713474  1
  C  C162  1  0.564905  0.496616  0.640558  1
  C  C163  1  0.170712  0.891469  0.651050  1
  C  C164  1  0.014645  0.586715  0.686401  1
  C  C165  1  0.322388  0.196119  0.613628  1
  C  C166  1  0.753657  0.039094  0.694777  1
  C  C167  1  0.048640  0.648309  0.621579  1
  C  C168  1  0.895852  0.344771  0.659855  1
