# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.46619771
_cell_length_b   6.61451560
_cell_length_c   47.96236175
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.20635182
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe280 C112'
_cell_volume   6791.75975669
_cell_formula_units_Z   56
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  0.638695  0.397675  0.326810  1
  Fe  Fe2  1  0.121093  0.654056  0.292877  1
  Fe  Fe3  1  0.458695  0.406864  0.279587  1
  Fe  Fe4  1  0.976889  0.151690  0.313216  1
  Fe  Fe5  1  0.526974  0.921472  0.299262  1
  Fe  Fe6  1  0.046403  0.665356  0.332497  1
  Fe  Fe7  1  0.581838  0.693711  0.332879  1
  Fe  Fe8  1  0.062203  0.956981  0.298852  1
  Fe  Fe9  1  0.553806  0.566699  0.284593  1
  Fe  Fe10  1  0.073549  0.307770  0.318213  1
  Fe  Fe11  1  0.538219  0.277688  0.318695  1
  Fe  Fe12  1  0.018800  0.530106  0.285152  1
  Fe  Fe13  1  0.623947  0.079196  0.303524  1
  Fe  Fe14  1  0.106790  0.330008  0.269669  1
  Fe  Fe15  1  0.482253  0.571725  0.324468  1
  Fe  Fe16  1  0.961649  0.826825  0.290538  1
  Fe  Fe17  1  0.659054  0.576015  0.282288  1
  Fe  Fe18  1  0.179181  0.317639  0.315246  1
  Fe  Fe19  1  0.681780  0.785083  0.319348  1
  Fe  Fe20  1  0.163358  0.037402  0.286455  1
  Fe  Fe21  1  0.379162  0.527310  0.310316  1
  Fe  Fe22  1  0.859178  0.778029  0.276489  1
  Fe  Fe23  1  0.235876  0.021550  0.330877  1
  Fe  Fe24  1  0.717004  0.281951  0.295902  1
  Fe  Fe25  1  0.268344  0.053809  0.282843  1
  Fe  Fe26  1  0.786207  0.796772  0.315911  1
  Fe  Fe27  1  0.322170  0.822548  0.316183  1
  Fe  Fe28  1  0.803240  0.081034  0.282147  1
  Fe  Fe29  1  0.294493  0.689697  0.268148  1
  Fe  Fe30  1  0.814071  0.437920  0.300971  1
  Fe  Fe31  1  0.279323  0.404681  0.301897  1
  Fe  Fe32  1  0.759308  0.662014  0.268505  1
  Fe  Fe33  1  0.366438  0.205811  0.286385  1
  Fe  Fe34  1  0.884412  0.951905  0.320239  1
  Fe  Fe35  1  0.222960  0.700992  0.307400  1
  Fe  Fe36  1  0.700194  0.955478  0.273908  1
  Fe  Fe37  1  0.439073  0.188890  0.331755  1
  Fe  Fe38  1  0.918163  0.451489  0.299098  1
  Fe  Fe39  1  0.421550  0.910794  0.302016  1
  Fe  Fe40  1  0.912769  0.158855  0.272561  1
  Fe  Fe41  1  0.677268  0.883005  0.393514  1
  Fe  Fe42  1  0.157441  0.141371  0.360051  1
  Fe  Fe43  1  0.495900  0.892211  0.347413  1
  Fe  Fe44  1  0.014982  0.635158  0.380512  1
  Fe  Fe45  1  0.566024  0.406228  0.366428  1
  Fe  Fe46  1  0.085311  0.148734  0.399540  1
  Fe  Fe47  1  0.620830  0.179501  0.399130  1
  Fe  Fe48  1  0.101443  0.439139  0.365471  1
  Fe  Fe49  1  0.593092  0.049152  0.351444  1
  Fe  Fe50  1  0.112459  0.791696  0.384404  1
  Fe  Fe51  1  0.577292  0.761065  0.385314  1
  Fe  Fe52  1  0.057247  0.017254  0.351582  1
  Fe  Fe53  1  0.663506  0.563060  0.370229  1
  Fe  Fe54  1  0.144374  0.821533  0.336808  1
  Fe  Fe55  1  0.520862  0.057178  0.390911  1
  Fe  Fe56  1  0.001366  0.313921  0.357408  1
  Fe  Fe57  1  0.698569  0.059938  0.348124  1
  Fe  Fe58  1  0.217937  0.801679  0.381659  1
  Fe  Fe59  1  0.720324  0.267465  0.385977  1
  Fe  Fe60  1  0.200743  0.524705  0.352516  1
  Fe  Fe61  1  0.417418  0.011227  0.376839  1
  Fe  Fe62  1  0.897425  0.269317  0.343316  1
  Fe  Fe63  1  0.274579  0.506022  0.397434  1
  Fe  Fe64  1  0.755512  0.764421  0.363774  1
  Fe  Fe65  1  0.306491  0.535522  0.349736  1
  Fe  Fe66  1  0.825531  0.278275  0.382875  1
  Fe  Fe67  1  0.361162  0.307377  0.382516  1
  Fe  Fe68  1  0.841523  0.565106  0.349278  1
  Fe  Fe69  1  0.333676  0.177437  0.334612  1
  Fe  Fe70  1  0.852583  0.920736  0.368003  1
  Fe  Fe71  1  0.317424  0.889015  0.368495  1
  Fe  Fe72  1  0.797107  0.146067  0.334817  1
  Fe  Fe73  1  0.403969  0.691343  0.353551  1
  Fe  Fe74  1  0.923386  0.434785  0.386725  1
  Fe  Fe75  1  0.261300  0.185939  0.374122  1
  Fe  Fe76  1  0.741828  0.443235  0.340735  1
  Fe  Fe77  1  0.477523  0.672733  0.398475  1
  Fe  Fe78  1  0.958219  0.931046  0.364813  1
  Fe  Fe79  1  0.460637  0.395556  0.369415  1
  Fe  Fe80  1  0.940841  0.656138  0.335889  1
  Fe  Fe81  1  0.715679  0.367352  0.460186  1
  Fe  Fe82  1  0.196213  0.625223  0.426726  1
  Fe  Fe83  1  0.534304  0.377136  0.414190  1
  Fe  Fe84  1  0.053536  0.119590  0.447262  1
  Fe  Fe85  1  0.604772  0.890836  0.433095  1
  Fe  Fe86  1  0.123906  0.633279  0.466258  1
  Fe  Fe87  1  0.659370  0.663926  0.465754  1
  Fe  Fe88  1  0.140029  0.922090  0.432272  1
  Fe  Fe89  1  0.631819  0.533783  0.417961  1
  Fe  Fe90  1  0.151037  0.275992  0.451135  1
  Fe  Fe91  1  0.615741  0.245232  0.451951  1
  Fe  Fe92  1  0.096379  0.503104  0.418439  1
  Fe  Fe93  1  0.702193  0.047439  0.436903  1
  Fe  Fe94  1  0.182904  0.305366  0.403426  1
  Fe  Fe95  1  0.559421  0.541528  0.457515  1
  Fe  Fe96  1  0.040170  0.799850  0.423965  1
  Fe  Fe97  1  0.737140  0.544090  0.414947  1
  Fe  Fe98  1  0.256507  0.286025  0.448308  1
  Fe  Fe99  1  0.758982  0.751970  0.452640  1
  Fe  Fe100  1  0.239438  0.009612  0.419173  1
  Fe  Fe101  1  0.455949  0.496161  0.443530  1
  Fe  Fe102  1  0.936643  0.754532  0.410057  1
  Fe  Fe103  1  0.313125  0.990486  0.464084  1
  Fe  Fe104  1  0.793968  0.248578  0.430616  1
  Fe  Fe105  1  0.345017  0.019720  0.416395  1
  Fe  Fe106  1  0.864331  0.762279  0.449578  1
  Fe  Fe107  1  0.399704  0.792619  0.449113  1
  Fe  Fe108  1  0.880367  0.051173  0.415617  1
  Fe  Fe109  1  0.372139  0.662307  0.401278  1
  Fe  Fe110  1  0.891396  0.405057  0.434476  1
  Fe  Fe111  1  0.356002  0.373790  0.435221  1
  Fe  Fe112  1  0.836649  0.631755  0.401766  1
  Fe  Fe113  1  0.442617  0.176031  0.420240  1
  Fe  Fe114  1  0.961819  0.918748  0.453406  1
  Fe  Fe115  1  0.299850  0.670563  0.440772  1
  Fe  Fe116  1  0.780445  0.929157  0.407302  1
  Fe  Fe117  1  0.516101  0.157046  0.465039  1
  Fe  Fe118  1  0.996863  0.415183  0.431523  1
  Fe  Fe119  1  0.499223  0.880775  0.435986  1
  Fe  Fe120  1  0.979833  0.139272  0.402413  1
  Fe  Fe121  1  0.754108  0.851756  0.526853  1
  Fe  Fe122  1  0.234722  0.109580  0.493409  1
  Fe  Fe123  1  0.572788  0.861549  0.480810  1
  Fe  Fe124  1  0.091980  0.603921  0.513969  1
  Fe  Fe125  1  0.643220  0.375233  0.499742  1
  Fe  Fe126  1  0.162394  0.117599  0.532935  1
  Fe  Fe127  1  0.697848  0.148355  0.532433  1
  Fe  Fe128  1  0.178560  0.406288  0.498964  1
  Fe  Fe129  1  0.670279  0.018058  0.484616  1
  Fe  Fe130  1  0.189514  0.760305  0.517817  1
  Fe  Fe131  1  0.654163  0.729387  0.518611  1
  Fe  Fe132  1  0.134846  0.987300  0.485101  1
  Fe  Fe133  1  0.740649  0.531733  0.503562  1
  Fe  Fe134  1  0.221459  0.789650  0.470111  1
  Fe  Fe135  1  0.597894  0.025932  0.524167  1
  Fe  Fe136  1  0.078636  0.283898  0.490668  1
  Fe  Fe137  1  0.775649  0.028261  0.481561  1
  Fe  Fe138  1  0.295001  0.770404  0.514977  1
  Fe  Fe139  1  0.797413  0.236207  0.519311  1
  Fe  Fe140  1  0.278061  0.494064  0.485895  1
  Fe  Fe141  1  0.494426  0.980570  0.510204  1
  Fe  Fe142  1  0.975169  0.238536  0.476705  1
  Fe  Fe143  1  0.351603  0.474818  0.530761  1
  Fe  Fe144  1  0.832413  0.732735  0.497310  1
  Fe  Fe145  1  0.383548  0.504163  0.483055  1
  Fe  Fe146  1  0.902783  0.246410  0.516256  1
  Fe  Fe147  1  0.438216  0.277168  0.515771  1
  Fe  Fe148  1  0.918899  0.535081  0.482261  1
  Fe  Fe149  1  0.410669  0.146869  0.467937  1
  Fe  Fe150  1  0.929842  0.889235  0.501130  1
  Fe  Fe151  1  0.394502  0.858180  0.501908  1
  Fe  Fe152  1  0.875215  0.116113  0.468439  1
  Fe  Fe153  1  0.481082  0.660547  0.486903  1
  Fe  Fe154  1  0.000274  0.402919  0.520062  1
  Fe  Fe155  1  0.338340  0.154889  0.507463  1
  Fe  Fe156  1  0.818954  0.412712  0.474019  1
  Fe  Fe157  1  0.554562  0.641361  0.531694  1
  Fe  Fe158  1  0.035318  0.899343  0.498203  1
  Fe  Fe159  1  0.537745  0.365125  0.502669  1
  Fe  Fe160  1  0.018500  0.623107  0.469178  1
  Fe  Fe161  1  0.792618  0.335311  0.593570  1
  Fe  Fe162  1  0.273212  0.593905  0.560100  1
  Fe  Fe163  1  0.611243  0.345720  0.547466  1
  Fe  Fe164  1  0.130445  0.088437  0.580632  1
  Fe  Fe165  1  0.681667  0.859412  0.566396  1
  Fe  Fe166  1  0.200924  0.602161  0.599594  1
  Fe  Fe167  1  0.736413  0.632713  0.599106  1
  Fe  Fe168  1  0.217060  0.890678  0.565651  1
  Fe  Fe169  1  0.708731  0.502189  0.551294  1
  Fe  Fe170  1  0.228045  0.244748  0.584477  1
  Fe  Fe171  1  0.692696  0.213295  0.585255  1
  Fe  Fe172  1  0.173358  0.471850  0.551759  1
  Fe  Fe173  1  0.779094  0.015891  0.570256  1
  Fe  Fe174  1  0.259937  0.273982  0.536788  1
  Fe  Fe175  1  0.636419  0.509936  0.590815  1
  Fe  Fe176  1  0.117113  0.768307  0.557342  1
  Fe  Fe177  1  0.814080  0.512498  0.548232  1
  Fe  Fe178  1  0.333624  0.254856  0.581699  1
  Fe  Fe179  1  0.835922  0.720378  0.585925  1
  Fe  Fe180  1  0.316555  0.978444  0.552564  1
  Fe  Fe181  1  0.532892  0.464618  0.576907  1
  Fe  Fe182  1  0.013641  0.722940  0.543357  1
  Fe  Fe183  1  0.390158  0.959102  0.597446  1
  Fe  Fe184  1  0.870869  0.217029  0.563969  1
  Fe  Fe185  1  0.422025  0.988477  0.549737  1
  Fe  Fe186  1  0.941244  0.730686  0.582911  1
  Fe  Fe187  1  0.476683  0.761364  0.582433  1
  Fe  Fe188  1  0.957321  0.019236  0.548921  1
  Fe  Fe189  1  0.449156  0.631190  0.534614  1
  Fe  Fe190  1  0.968290  0.373632  0.567777  1
  Fe  Fe191  1  0.433033  0.342379  0.568600  1
  Fe  Fe192  1  0.913693  0.600542  0.535118  1
  Fe  Fe193  1  0.519526  0.144878  0.553610  1
  Fe  Fe194  1  0.038758  0.887332  0.586682  1
  Fe  Fe195  1  0.376850  0.639245  0.574146  1
  Fe  Fe196  1  0.857383  0.897116  0.540686  1
  Fe  Fe197  1  0.593229  0.125196  0.598459  1
  Fe  Fe198  1  0.073839  0.383693  0.564886  1
  Fe  Fe199  1  0.576199  0.849285  0.569349  1
  Fe  Fe200  1  0.056961  0.107422  0.535833  1
  Fe  Fe201  1  0.831234  0.821233  0.660137  1
  Fe  Fe202  1  0.311763  0.078529  0.626750  1
  Fe  Fe203  1  0.649676  0.829683  0.614147  1
  Fe  Fe204  1  0.169094  0.573125  0.647321  1
  Fe  Fe205  1  0.720479  0.343732  0.632869  1
  Fe  Fe206  1  0.239386  0.087032  0.666260  1
  Fe  Fe207  1  0.775955  0.118401  0.666055  1
  Fe  Fe208  1  0.255638  0.375454  0.632377  1
  Fe  Fe209  1  0.747531  0.986194  0.617997  1
  Fe  Fe210  1  0.266572  0.728947  0.651136  1
  Fe  Fe211  1  0.731539  0.699363  0.651594  1
  Fe  Fe212  1  0.211900  0.957092  0.618356  1
  Fe  Fe213  1  0.817550  0.500048  0.637098  1
  Fe  Fe214  1  0.298483  0.758446  0.603438  1
  Fe  Fe215  1  0.675637  0.995151  0.657556  1
  Fe  Fe216  1  0.155644  0.253241  0.624033  1
  Fe  Fe217  1  0.852738  0.997003  0.614895  1
  Fe  Fe218  1  0.372319  0.739764  0.648355  1
  Fe  Fe219  1  0.874493  0.204530  0.652748  1
  Fe  Fe220  1  0.355125  0.462790  0.619213  1
  Fe  Fe221  1  0.571696  0.950547  0.643464  1
  Fe  Fe222  1  0.052201  0.207290  0.609961  1
  Fe  Fe223  1  0.428688  0.442935  0.664064  1
  Fe  Fe224  1  0.909556  0.701408  0.630643  1
  Fe  Fe225  1  0.460604  0.472772  0.616468  1
  Fe  Fe226  1  0.979970  0.215316  0.649428  1
  Fe  Fe227  1  0.515816  0.247215  0.649290  1
  Fe  Fe228  1  0.995770  0.503404  0.615558  1
  Fe  Fe229  1  0.487751  0.115734  0.601332  1
  Fe  Fe230  1  0.007038  0.858241  0.634444  1
  Fe  Fe231  1  0.471620  0.825330  0.635401  1
  Fe  Fe232  1  0.952232  0.084967  0.601742  1
  Fe  Fe233  1  0.558080  0.629310  0.620360  1
  Fe  Fe234  1  0.077163  0.372257  0.653459  1
  Fe  Fe235  1  0.415622  0.123097  0.640821  1
  Fe  Fe236  1  0.895794  0.381463  0.607358  1
  Fe  Fe237  1  0.632221  0.608330  0.664983  1
  Fe  Fe238  1  0.112425  0.868912  0.631457  1
  Fe  Fe239  1  0.614843  0.333422  0.636059  1
  Fe  Fe240  1  0.095540  0.591735  0.602397  1
  Fe  Fe241  1  0.872869  0.308990  0.726964  1
  Fe  Fe242  1  0.350102  0.563476  0.693472  1
  Fe  Fe243  1  0.688650  0.312563  0.680633  1
  Fe  Fe244  1  0.206625  0.058658  0.714487  1
  Fe  Fe245  1  0.758991  0.826548  0.699901  1
  Fe  Fe246  1  0.278569  0.574771  0.732724  1
  Fe  Fe247  1  0.813754  0.602455  0.732367  1
  Fe  Fe248  1  0.293740  0.859788  0.698974  1
  Fe  Fe249  1  0.786855  0.467696  0.684961  1
  Fe  Fe250  1  0.304718  0.210660  0.718029  1
  Fe  Fe251  1  0.769823  0.183434  0.718725  1
  Fe  Fe252  1  0.250892  0.441920  0.684689  1
  Fe  Fe253  1  0.856058  0.982517  0.704970  1
  Fe  Fe254  1  0.337187  0.242919  0.669995  1
  Fe  Fe255  1  0.713884  0.486439  0.724383  1
  Fe  Fe256  1  0.193901  0.737159  0.690556  1
  Fe  Fe257  1  0.891282  0.479385  0.681524  1
  Fe  Fe258  1  0.409705  0.227066  0.714417  1
  Fe  Fe259  1  0.914009  0.688453  0.718584  1
  Fe  Fe260  1  0.393881  0.946830  0.685626  1
  Fe  Fe261  1  0.611413  0.437643  0.710334  1
  Fe  Fe262  1  0.090809  0.692744  0.676404  1
  Fe  Fe263  1  0.466272  0.934461  0.731203  1
  Fe  Fe264  1  0.949115  0.185272  0.697348  1
  Fe  Fe265  1  0.499513  0.956699  0.682659  1
  Fe  Fe266  1  0.019257  0.697769  0.716279  1
  Fe  Fe267  1  0.554263  0.734362  0.715720  1
  Fe  Fe268  1  0.034844  0.986781  0.682177  1
  Fe  Fe269  1  0.526659  0.599113  0.668375  1
  Fe  Fe270  1  0.046088  0.342995  0.701610  1
  Fe  Fe271  1  0.510859  0.307487  0.702020  1
  Fe  Fe272  1  0.991224  0.570757  0.667993  1
  Fe  Fe273  1  0.596173  0.112778  0.687656  1
  Fe  Fe274  1  0.114367  0.857602  0.721285  1
  Fe  Fe275  1  0.451970  0.610412  0.707995  1
  Fe  Fe276  1  0.934367  0.866793  0.674062  1
  Fe  Fe277  1  0.660293  0.105613  0.728311  1
  Fe  Fe278  1  0.151512  0.353673  0.698856  1
  Fe  Fe279  1  0.654899  0.812979  0.701774  1
  Fe  Fe280  1  0.133989  0.075578  0.669117  1
  C  C281  1  0.473011  0.690481  0.288281  1
  C  C282  1  0.992051  0.435480  0.321406  1
  C  C283  1  0.603909  0.341508  0.290449  1
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  C  C392  1  0.969154  0.922960  0.710422  1
