# generated using pymatgen
data_Fe7C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71723958
_cell_length_b   28.81135986
_cell_length_c   52.69979055
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe7C3
_chemical_formula_sum   'Fe280 C120'
_cell_volume   7162.43312984
_cell_formula_units_Z   40
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  0.616388  0.328996  0.341187  1
  Fe  Fe2  1  0.601779  0.906634  0.295164  1
  Fe  Fe3  1  0.118303  0.243115  0.362267  1
  Fe  Fe4  1  0.120334  0.819033  0.316842  1
  Fe  Fe5  1  0.383121  0.090246  0.304853  1
  Fe  Fe6  1  0.382274  0.513642  0.350335  1
  Fe  Fe7  1  0.879941  0.058761  0.353573  1
  Fe  Fe8  1  0.872259  0.635560  0.306681  1
  Fe  Fe9  1  0.228127  0.375594  0.313609  1
  Fe  Fe10  1  0.233038  0.799987  0.359456  1
  Fe  Fe11  1  0.750877  0.346072  0.299812  1
  Fe  Fe12  1  0.738458  0.771182  0.345415  1
  Fe  Fe13  1  0.749644  0.133764  0.277418  1
  Fe  Fe14  1  0.758587  0.558629  0.322943  1
  Fe  Fe15  1  0.269061  0.163549  0.291359  1
  Fe  Fe16  1  0.268537  0.587906  0.336638  1
  Fe  Fe17  1  0.284269  0.315025  0.280101  1
  Fe  Fe18  1  0.240924  0.738163  0.327845  1
  Fe  Fe19  1  0.739728  0.409091  0.330442  1
  Fe  Fe20  1  0.751286  0.988519  0.283864  1
  Fe  Fe21  1  0.760123  0.197581  0.307554  1
  Fe  Fe22  1  0.751724  0.622032  0.352744  1
  Fe  Fe23  1  0.255068  0.950515  0.350755  1
  Fe  Fe24  1  0.260398  0.526062  0.305415  1
  Fe  Fe25  1  0.411849  0.107599  0.346247  1
  Fe  Fe26  1  0.402286  0.683599  0.300543  1
  Fe  Fe27  1  0.909064  0.041559  0.312608  1
  Fe  Fe28  1  0.909500  0.464187  0.357640  1
  Fe  Fe29  1  0.589521  0.252553  0.334920  1
  Fe  Fe30  1  0.583134  0.827189  0.290100  1
  Fe  Fe31  1  0.100252  0.469290  0.277643  1
  Fe  Fe32  1  0.086141  0.896088  0.323533  1
  Fe  Fe33  1  0.122699  0.301866  0.327251  1
  Fe  Fe34  1  0.109492  0.881035  0.281442  1
  Fe  Fe35  1  0.620049  0.422394  0.284595  1
  Fe  Fe36  1  0.622086  0.847494  0.330937  1
  Fe  Fe37  1  0.884491  0.117693  0.318670  1
  Fe  Fe38  1  0.888216  0.693038  0.272436  1
  Fe  Fe39  1  0.383851  0.031342  0.339399  1
  Fe  Fe40  1  0.373411  0.606690  0.293886  1
  Fe  Fe41  1  0.749483  0.267908  0.288869  1
  Fe  Fe42  1  0.748753  0.692596  0.334754  1
  Fe  Fe43  1  0.252967  0.454390  0.323171  1
  Fe  Fe44  1  0.247044  0.031348  0.278079  1
  Fe  Fe45  1  0.244523  0.189231  0.332998  1
  Fe  Fe46  1  0.209571  0.763045  0.281884  1
  Fe  Fe47  1  0.738624  0.960615  0.325851  1
  Fe  Fe48  1  0.744478  0.536150  0.279337  1
  Fe  Fe49  1  0.250969  0.243387  0.300740  1
  Fe  Fe50  1  0.241492  0.666488  0.345519  1
  Fe  Fe51  1  0.742672  0.905563  0.357564  1
  Fe  Fe52  1  0.750009  0.479883  0.312509  1
  Fe  Fe53  1  0.757379  0.171560  0.348265  1
  Fe  Fe54  1  0.755192  0.749336  0.302282  1
  Fe  Fe55  1  0.253194  0.400786  0.355663  1
  Fe  Fe56  1  0.256908  0.977054  0.309419  1
  Fe  Fe57  1  0.619953  0.176670  0.432254  1
  Fe  Fe58  1  0.618238  0.752813  0.386622  1
  Fe  Fe59  1  0.119708  0.090657  0.453321  1
  Fe  Fe60  1  0.116637  0.666862  0.407554  1
  Fe  Fe61  1  0.379800  0.937149  0.395665  1
  Fe  Fe62  1  0.380355  0.361188  0.441068  1
  Fe  Fe63  1  0.881063  0.906148  0.444422  1
  Fe  Fe64  1  0.879702  0.482507  0.398880  1
  Fe  Fe65  1  0.233181  0.223778  0.404461  1
  Fe  Fe66  1  0.232380  0.647526  0.449882  1
  Fe  Fe67  1  0.729015  0.195877  0.390196  1
  Fe  Fe68  1  0.728568  0.619798  0.435500  1
  Fe  Fe69  1  0.772267  0.984184  0.367431  1
  Fe  Fe70  1  0.769360  0.407745  0.412876  1
  Fe  Fe71  1  0.267433  0.011735  0.381749  1
  Fe  Fe72  1  0.267955  0.435777  0.427140  1
  Fe  Fe73  1  0.245186  0.162403  0.373503  1
  Fe  Fe74  1  0.244513  0.586004  0.418821  1
  Fe  Fe75  1  0.744210  0.257507  0.421243  1
  Fe  Fe76  1  0.746416  0.833815  0.375769  1
  Fe  Fe77  1  0.755538  0.045531  0.398535  1
  Fe  Fe78  1  0.756368  0.469440  0.443959  1
  Fe  Fe79  1  0.256420  0.797739  0.441536  1
  Fe  Fe80  1  0.254828  0.374073  0.396041  1
  Fe  Fe81  1  0.412016  0.955376  0.436907  1
  Fe  Fe82  1  0.410985  0.531424  0.391604  1
  Fe  Fe83  1  0.912780  0.888032  0.403209  1
  Fe  Fe84  1  0.911718  0.312018  0.448556  1
  Fe  Fe85  1  0.588810  0.099939  0.425894  1
  Fe  Fe86  1  0.586831  0.676226  0.380205  1
  Fe  Fe87  1  0.088716  0.319373  0.368870  1
  Fe  Fe88  1  0.089341  0.743225  0.414267  1
  Fe  Fe89  1  0.119107  0.149126  0.418418  1
  Fe  Fe90  1  0.117380  0.725459  0.372929  1
  Fe  Fe91  1  0.620882  0.270588  0.376169  1
  Fe  Fe92  1  0.620853  0.694239  0.421521  1
  Fe  Fe93  1  0.881211  0.964718  0.409485  1
  Fe  Fe94  1  0.881628  0.540859  0.363970  1
  Fe  Fe95  1  0.382050  0.878688  0.430598  1
  Fe  Fe96  1  0.381358  0.454939  0.385126  1
  Fe  Fe97  1  0.754361  0.116840  0.380484  1
  Fe  Fe98  1  0.754726  0.540804  0.425847  1
  Fe  Fe99  1  0.255185  0.302730  0.414176  1
  Fe  Fe100  1  0.256648  0.879015  0.368752  1
  Fe  Fe101  1  0.246059  0.036569  0.423844  1
  Fe  Fe102  1  0.243838  0.612969  0.378253  1
  Fe  Fe103  1  0.745790  0.806890  0.416300  1
  Fe  Fe104  1  0.745010  0.383153  0.370822  1
  Fe  Fe105  1  0.245856  0.090743  0.391549  1
  Fe  Fe106  1  0.244653  0.514661  0.436897  1
  Fe  Fe107  1  0.745890  0.752602  0.448515  1
  Fe  Fe108  1  0.745244  0.328809  0.403093  1
  Fe  Fe109  1  0.754669  0.018675  0.438979  1
  Fe  Fe110  1  0.754864  0.595202  0.393561  1
  Fe  Fe111  1  0.254691  0.248660  0.446567  1
  Fe  Fe112  1  0.255416  0.824759  0.401120  1
  Fe  Fe113  1  0.619468  0.024589  0.523052  1
  Fe  Fe114  1  0.618786  0.600642  0.477619  1
  Fe  Fe115  1  0.119323  0.938605  0.544190  1
  Fe  Fe116  1  0.118894  0.514721  0.498767  1
  Fe  Fe117  1  0.380714  0.785118  0.486508  1
  Fe  Fe118  1  0.380479  0.209083  0.531949  1
  Fe  Fe119  1  0.880745  0.754158  0.535226  1
  Fe  Fe120  1  0.880112  0.330217  0.489802  1
  Fe  Fe121  1  0.231587  0.071749  0.495271  1
  Fe  Fe122  1  0.230911  0.495765  0.540700  1
  Fe  Fe123  1  0.732180  0.043506  0.481097  1
  Fe  Fe124  1  0.731105  0.467542  0.526512  1
  Fe  Fe125  1  0.769246  0.831537  0.458356  1
  Fe  Fe126  1  0.768570  0.255554  0.503785  1
  Fe  Fe127  1  0.269052  0.859761  0.472544  1
  Fe  Fe128  1  0.267977  0.283797  0.517959  1
  Fe  Fe129  1  0.244661  0.009825  0.464266  1
  Fe  Fe130  1  0.243803  0.433865  0.509674  1
  Fe  Fe131  1  0.744597  0.105401  0.512080  1
  Fe  Fe132  1  0.744219  0.681486  0.466613  1
  Fe  Fe133  1  0.756354  0.893438  0.489382  1
  Fe  Fe134  1  0.755496  0.317477  0.534790  1
  Fe  Fe135  1  0.255938  0.645817  0.532443  1
  Fe  Fe136  1  0.255560  0.221902  0.486976  1
  Fe  Fe137  1  0.411673  0.803341  0.527750  1
  Fe  Fe138  1  0.411298  0.379390  0.482317  1
  Fe  Fe139  1  0.911445  0.735867  0.493988  1
  Fe  Fe140  1  0.911880  0.159899  0.539444  1
  Fe  Fe141  1  0.588859  0.947913  0.516739  1
  Fe  Fe142  1  0.588484  0.523962  0.471306  1
  Fe  Fe143  1  0.088277  0.167403  0.459612  1
  Fe  Fe144  1  0.088712  0.591436  0.505067  1
  Fe  Fe145  1  0.120045  0.997086  0.509254  1
  Fe  Fe146  1  0.119412  0.573144  0.463830  1
  Fe  Fe147  1  0.619678  0.118219  0.467107  1
  Fe  Fe148  1  0.619443  0.542185  0.512548  1
  Fe  Fe149  1  0.881263  0.812582  0.500289  1
  Fe  Fe150  1  0.880834  0.388698  0.454866  1
  Fe  Fe151  1  0.381371  0.726660  0.521437  1
  Fe  Fe152  1  0.380689  0.302714  0.476004  1
  Fe  Fe153  1  0.755201  0.964657  0.471295  1
  Fe  Fe154  1  0.754434  0.388698  0.516680  1
  Fe  Fe155  1  0.254527  0.150646  0.505081  1
  Fe  Fe156  1  0.254973  0.726475  0.459565  1
  Fe  Fe157  1  0.246081  0.884552  0.514661  1
  Fe  Fe158  1  0.245705  0.460611  0.469266  1
  Fe  Fe159  1  0.745779  0.654760  0.507107  1
  Fe  Fe160  1  0.745336  0.230741  0.461693  1
  Fe  Fe161  1  0.245723  0.938604  0.482376  1
  Fe  Fe162  1  0.244956  0.362646  0.527761  1
  Fe  Fe163  1  0.745184  0.600827  0.539491  1
  Fe  Fe164  1  0.745630  0.176657  0.493975  1
  Fe  Fe165  1  0.754452  0.866692  0.529790  1
  Fe  Fe166  1  0.754076  0.442751  0.484395  1
  Fe  Fe167  1  0.254821  0.096562  0.537363  1
  Fe  Fe168  1  0.254378  0.672543  0.491949  1
  Fe  Fe169  1  0.618799  0.872363  0.613930  1
  Fe  Fe170  1  0.618107  0.448614  0.568458  1
  Fe  Fe171  1  0.118529  0.786443  0.635086  1
  Fe  Fe172  1  0.118946  0.362585  0.589571  1
  Fe  Fe173  1  0.379304  0.633063  0.577535  1
  Fe  Fe174  1  0.379275  0.056714  0.622887  1
  Fe  Fe175  1  0.882777  0.601844  0.626127  1
  Fe  Fe176  1  0.881050  0.178176  0.580638  1
  Fe  Fe177  1  0.230797  0.919558  0.586180  1
  Fe  Fe178  1  0.227890  0.343119  0.631625  1
  Fe  Fe179  1  0.732202  0.891525  0.571916  1
  Fe  Fe180  1  0.732724  0.315567  0.617307  1
  Fe  Fe181  1  0.767777  0.679777  0.549174  1
  Fe  Fe182  1  0.766976  0.103525  0.594595  1
  Fe  Fe183  1  0.271590  0.707505  0.563556  1
  Fe  Fe184  1  0.271142  0.131425  0.608860  1
  Fe  Fe185  1  0.243789  0.857863  0.555097  1
  Fe  Fe186  1  0.244619  0.281771  0.600521  1
  Fe  Fe187  1  0.745329  0.953230  0.603015  1
  Fe  Fe188  1  0.743737  0.529564  0.557520  1
  Fe  Fe189  1  0.755644  0.741299  0.580235  1
  Fe  Fe190  1  0.754971  0.164900  0.625553  1
  Fe  Fe191  1  0.253741  0.493488  0.623287  1
  Fe  Fe192  1  0.255947  0.069796  0.577813  1
  Fe  Fe193  1  0.413326  0.651077  0.618851  1
  Fe  Fe194  1  0.411347  0.227363  0.573162  1
  Fe  Fe195  1  0.910816  0.584077  0.584789  1
  Fe  Fe196  1  0.911441  0.007929  0.630186  1
  Fe  Fe197  1  0.589172  0.795878  0.607452  1
  Fe  Fe198  1  0.588141  0.371927  0.562149  1
  Fe  Fe199  1  0.088439  0.015285  0.550500  1
  Fe  Fe200  1  0.087377  0.439271  0.595846  1
  Fe  Fe201  1  0.120456  0.844796  0.600176  1
  Fe  Fe202  1  0.119094  0.421154  0.554634  1
  Fe  Fe203  1  0.619802  0.966115  0.557988  1
  Fe  Fe204  1  0.620357  0.390153  0.603390  1
  Fe  Fe205  1  0.883520  0.660441  0.591502  1
  Fe  Fe206  1  0.880449  0.236645  0.545735  1
  Fe  Fe207  1  0.381919  0.574490  0.612434  1
  Fe  Fe208  1  0.380204  0.150632  0.566802  1
  Fe  Fe209  1  0.755504  0.812642  0.562159  1
  Fe  Fe210  1  0.754301  0.236559  0.607507  1
  Fe  Fe211  1  0.254913  0.998493  0.595963  1
  Fe  Fe212  1  0.254267  0.574701  0.550540  1
  Fe  Fe213  1  0.245293  0.732101  0.605495  1
  Fe  Fe214  1  0.245488  0.308627  0.560077  1
  Fe  Fe215  1  0.744741  0.502544  0.597936  1
  Fe  Fe216  1  0.745466  0.078643  0.552489  1
  Fe  Fe217  1  0.245431  0.786499  0.573209  1
  Fe  Fe218  1  0.245796  0.210463  0.618572  1
  Fe  Fe219  1  0.743509  0.448288  0.630304  1
  Fe  Fe220  1  0.744972  0.024573  0.584880  1
  Fe  Fe221  1  0.756319  0.714334  0.620803  1
  Fe  Fe222  1  0.754098  0.290734  0.575211  1
  Fe  Fe223  1  0.255147  0.944150  0.628234  1
  Fe  Fe224  1  0.254367  0.520412  0.582756  1
  Fe  Fe225  1  0.626746  0.720613  0.705170  1
  Fe  Fe226  1  0.616306  0.295961  0.659657  1
  Fe  Fe227  1  0.111941  0.634265  0.726620  1
  Fe  Fe228  1  0.115666  0.209610  0.680386  1
  Fe  Fe229  1  0.378072  0.479808  0.668119  1
  Fe  Fe230  1  0.380108  0.904909  0.714461  1
  Fe  Fe231  1  0.890666  0.446268  0.717614  1
  Fe  Fe232  1  0.877458  0.025436  0.671805  1
  Fe  Fe233  1  0.241570  0.768674  0.676113  1
  Fe  Fe234  1  0.250513  0.193539  0.721638  1
  Fe  Fe235  1  0.731621  0.739397  0.662418  1
  Fe  Fe236  1  0.731096  0.163753  0.707696  1
  Fe  Fe237  1  0.767119  0.527315  0.639600  1
  Fe  Fe238  1  0.772030  0.951709  0.685447  1
  Fe  Fe239  1  0.261699  0.556121  0.653641  1
  Fe  Fe240  1  0.249281  0.981231  0.699244  1
  Fe  Fe241  1  0.248433  0.705271  0.646312  1
  Fe  Fe242  1  0.240034  0.129721  0.691502  1
  Fe  Fe243  1  0.739759  0.801241  0.693641  1
  Fe  Fe244  1  0.745089  0.376788  0.648301  1
  Fe  Fe245  1  0.759233  0.589139  0.671211  1
  Fe  Fe246  1  0.715888  0.012277  0.718954  1
  Fe  Fe247  1  0.248872  0.338784  0.715192  1
  Fe  Fe248  1  0.260429  0.918212  0.668614  1
  Fe  Fe249  1  0.417023  0.500113  0.708956  1
  Fe  Fe250  1  0.410636  0.074750  0.664136  1
  Fe  Fe251  1  0.914016  0.431214  0.675523  1
  Fe  Fe252  1  0.899906  0.858013  0.721413  1
  Fe  Fe253  1  0.597871  0.643704  0.698513  1
  Fe  Fe254  1  0.588308  0.219704  0.652809  1
  Fe  Fe255  1  0.090657  0.863116  0.641416  1
  Fe  Fe256  1  0.091093  0.285743  0.686448  1
  Fe  Fe257  1  0.127898  0.691743  0.692375  1
  Fe  Fe258  1  0.120216  0.268541  0.645483  1
  Fe  Fe259  1  0.617883  0.813661  0.648721  1
  Fe  Fe260  1  0.617036  0.237057  0.694203  1
  Fe  Fe261  1  0.879823  0.508270  0.682214  1
  Fe  Fe262  1  0.881854  0.084187  0.636789  1
  Fe  Fe263  1  0.398378  0.420669  0.703892  1
  Fe  Fe264  1  0.383769  0.998307  0.657869  1
  Fe  Fe265  1  0.758665  0.660815  0.653537  1
  Fe  Fe266  1  0.749189  0.083915  0.698316  1
  Fe  Fe267  1  0.250149  0.847420  0.686547  1
  Fe  Fe268  1  0.257485  0.421740  0.641492  1
  Fe  Fe269  1  0.244965  0.577967  0.696774  1
  Fe  Fe270  1  0.242779  0.155743  0.650791  1
  Fe  Fe271  1  0.743249  0.350249  0.689637  1
  Fe  Fe272  1  0.746963  0.926517  0.643393  1
  Fe  Fe273  1  0.251405  0.634707  0.664302  1
  Fe  Fe274  1  0.250674  0.059395  0.710187  1
  Fe  Fe275  1  0.753113  0.295954  0.720977  1
  Fe  Fe276  1  0.747191  0.872913  0.675885  1
  Fe  Fe277  1  0.790586  0.564258  0.717172  1
  Fe  Fe278  1  0.755634  0.138072  0.666058  1
  Fe  Fe279  1  0.255679  0.791153  0.719719  1
  Fe  Fe280  1  0.261533  0.366688  0.673205  1
  C  C281  1  0.487045  0.485445  0.284831  1
  C  C282  1  0.478229  0.909837  0.329882  1
  C  C283  1  0.981073  0.239327  0.327986  1
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