# generated using pymatgen
data_Fe7C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.81749834
_cell_length_b   11.61368672
_cell_length_c   49.14313365
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.03442993
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe7C3
_chemical_formula_sum   'Fe280 C120'
_cell_volume   7810.01282518
_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  0.126662  0.661128  0.297000  1
  Fe  Fe2  1  0.569658  0.599595  0.337204  1
  Fe  Fe3  1  0.884333  0.712348  0.330812  1
  Fe  Fe4  1  0.336575  0.638247  0.371735  1
  Fe  Fe5  1  0.807612  0.186946  0.344957  1
  Fe  Fe6  1  0.326768  0.271157  0.303390  1
  Fe  Fe7  1  0.599011  0.055435  0.361788  1
  Fe  Fe8  1  0.147701  0.128590  0.320322  1
  Fe  Fe9  1  0.775859  0.657755  0.298815  1
  Fe  Fe10  1  0.215760  0.593576  0.342687  1
  Fe  Fe11  1  0.710065  0.682143  0.349403  1
  Fe  Fe12  1  0.256233  0.754928  0.308101  1
  Fe  Fe13  1  0.987367  0.220646  0.326087  1
  Fe  Fe14  1  0.437126  0.149694  0.366127  1
  Fe  Fe15  1  0.948313  0.059318  0.358735  1
  Fe  Fe16  1  0.495169  0.132145  0.317885  1
  Fe  Fe17  1  0.745051  0.860191  0.316071  1
  Fe  Fe18  1  0.197442  0.788531  0.357738  1
  Fe  Fe19  1  0.735251  0.491026  0.332445  1
  Fe  Fe20  1  0.182493  0.413295  0.371048  1
  Fe  Fe21  1  0.006119  0.024333  0.307514  1
  Fe  Fe22  1  0.458351  0.951842  0.348762  1
  Fe  Fe23  1  0.020621  0.395014  0.294725  1
  Fe  Fe24  1  0.473053  0.327331  0.336580  1
  Fe  Fe25  1  0.744006  0.056526  0.318330  1
  Fe  Fe26  1  0.194106  0.982816  0.360785  1
  Fe  Fe27  1  0.767353  0.344166  0.298402  1
  Fe  Fe28  1  0.218553  0.268173  0.340434  1
  Fe  Fe29  1  0.012709  0.831244  0.302966  1
  Fe  Fe30  1  0.462354  0.756029  0.346331  1
  Fe  Fe31  1  0.991428  0.547346  0.323495  1
  Fe  Fe32  1  0.437364  0.473363  0.366500  1
  Fe  Fe33  1  0.058589  0.683854  0.346483  1
  Fe  Fe34  1  0.598746  0.750258  0.302917  1
  Fe  Fe35  1  0.846541  0.554862  0.363801  1
  Fe  Fe36  1  0.390026  0.622351  0.320435  1
  Fe  Fe37  1  0.864907  0.171172  0.294638  1
  Fe  Fe38  1  0.319780  0.101013  0.335900  1
  Fe  Fe39  1  0.637368  0.216956  0.328273  1
  Fe  Fe40  1  0.086531  0.140083  0.370330  1
  Fe  Fe41  1  0.612292  0.859789  0.354872  1
  Fe  Fe42  1  0.160965  0.931059  0.314718  1
  Fe  Fe43  1  0.769608  0.345480  0.371968  1
  Fe  Fe44  1  0.320742  0.425098  0.330385  1
  Fe  Fe45  1  0.884775  0.906103  0.337082  1
  Fe  Fe46  1  0.430646  0.978293  0.294099  1
  Fe  Fe47  1  0.044654  0.368004  0.350728  1
  Fe  Fe48  1  0.598053  0.444003  0.308555  1
  Fe  Fe49  1  0.044356  0.880458  0.351506  1
  Fe  Fe50  1  0.591035  0.953948  0.310826  1
  Fe  Fe51  1  0.886589  0.393121  0.335977  1
  Fe  Fe52  1  0.444688  0.446074  0.293903  1
  Fe  Fe53  1  0.771107  0.834285  0.370289  1
  Fe  Fe54  1  0.319826  0.904837  0.329495  1
  Fe  Fe55  1  0.610174  0.372973  0.356916  1
  Fe  Fe56  1  0.159066  0.441722  0.316072  1
  Fe  Fe57  1  0.018087  0.525033  0.379356  1
  Fe  Fe58  1  0.469014  0.450913  0.420373  1
  Fe  Fe59  1  0.785885  0.566064  0.413015  1
  Fe  Fe60  1  0.236836  0.491225  0.454728  1
  Fe  Fe61  1  0.709284  0.039374  0.428137  1
  Fe  Fe62  1  0.260786  0.112616  0.386290  1
  Fe  Fe63  1  0.496837  0.907185  0.445169  1
  Fe  Fe64  1  0.048328  0.980180  0.403472  1
  Fe  Fe65  1  0.668355  0.518522  0.382476  1
  Fe  Fe66  1  0.119229  0.443492  0.424051  1
  Fe  Fe67  1  0.608875  0.532189  0.432537  1
  Fe  Fe68  1  0.158649  0.605055  0.391310  1
  Fe  Fe69  1  0.887388  0.074107  0.408859  1
  Fe  Fe70  1  0.338230  0.000651  0.450243  1
  Fe  Fe71  1  0.848089  0.913247  0.441460  1
  Fe  Fe72  1  0.397937  0.986889  0.399571  1
  Fe  Fe73  1  0.646603  0.713388  0.400305  1
  Fe  Fe74  1  0.097735  0.638872  0.442178  1
  Fe  Fe75  1  0.632005  0.340905  0.412266  1
  Fe  Fe76  1  0.083265  0.266011  0.454265  1
  Fe  Fe77  1  0.908110  0.880181  0.391063  1
  Fe  Fe78  1  0.359330  0.805342  0.432456  1
  Fe  Fe79  1  0.922790  0.251607  0.378645  1
  Fe  Fe80  1  0.373649  0.177602  0.419784  1
  Fe  Fe81  1  0.643191  0.909921  0.402940  1
  Fe  Fe82  1  0.094725  0.835290  0.444798  1
  Fe  Fe83  1  0.668907  0.194736  0.381839  1
  Fe  Fe84  1  0.119694  0.119608  0.423550  1
  Fe  Fe85  1  0.911722  0.683920  0.388627  1
  Fe  Fe86  1  0.362426  0.609897  0.429544  1
  Fe  Fe87  1  0.886573  0.397561  0.409302  1
  Fe  Fe88  1  0.337606  0.324437  0.450225  1
  Fe  Fe89  1  0.958967  0.537196  0.429120  1
  Fe  Fe90  1  0.509185  0.612487  0.386897  1
  Fe  Fe91  1  0.746281  0.405229  0.446216  1
  Fe  Fe92  1  0.296001  0.479717  0.405092  1
  Fe  Fe93  1  0.768135  0.026434  0.377703  1
  Fe  Fe94  1  0.220304  0.951936  0.419294  1
  Fe  Fe95  1  0.536463  0.068140  0.411721  1
  Fe  Fe96  1  0.987315  0.993364  0.453894  1
  Fe  Fe97  1  0.512065  0.711289  0.439225  1
  Fe  Fe98  1  0.062571  0.785248  0.397719  1
  Fe  Fe99  1  0.670333  0.198096  0.455014  1
  Fe  Fe100  1  0.220443  0.271537  0.413492  1
  Fe  Fe101  1  0.784106  0.760540  0.420614  1
  Fe  Fe102  1  0.335054  0.833566  0.378390  1
  Fe  Fe103  1  0.946215  0.219815  0.433866  1
  Fe  Fe104  1  0.496009  0.294530  0.391644  1
  Fe  Fe105  1  0.944285  0.733877  0.435352  1
  Fe  Fe106  1  0.494918  0.808420  0.393309  1
  Fe  Fe107  1  0.785649  0.246682  0.419097  1
  Fe  Fe108  1  0.336316  0.318548  0.376995  1
  Fe  Fe109  1  0.671998  0.685131  0.453956  1
  Fe  Fe110  1  0.222470  0.759003  0.412093  1
  Fe  Fe111  1  0.510176  0.224288  0.440313  1
  Fe  Fe112  1  0.059932  0.297164  0.398845  1
  Fe  Fe113  1  0.919586  0.376852  0.462257  1
  Fe  Fe114  1  0.369822  0.302459  0.503873  1
  Fe  Fe115  1  0.686034  0.417484  0.496228  1
  Fe  Fe116  1  0.136943  0.343197  0.537938  1
  Fe  Fe117  1  0.610685  0.890862  0.511452  1
  Fe  Fe118  1  0.161181  0.964689  0.469863  1
  Fe  Fe119  1  0.398491  0.758485  0.528797  1
  Fe  Fe120  1  0.947453  0.833199  0.486986  1
  Fe  Fe121  1  0.569084  0.369462  0.465636  1
  Fe  Fe122  1  0.019633  0.295126  0.507320  1
  Fe  Fe123  1  0.509328  0.383634  0.515970  1
  Fe  Fe124  1  0.058875  0.458025  0.474260  1
  Fe  Fe125  1  0.787677  0.926884  0.491971  1
  Fe  Fe126  1  0.238227  0.852548  0.533655  1
  Fe  Fe127  1  0.748435  0.763985  0.525030  1
  Fe  Fe128  1  0.297982  0.838377  0.483320  1
  Fe  Fe129  1  0.547862  0.565625  0.483323  1
  Fe  Fe130  1  0.998274  0.491124  0.525135  1
  Fe  Fe131  1  0.532776  0.192448  0.495822  1
  Fe  Fe132  1  0.983427  0.118161  0.537588  1
  Fe  Fe133  1  0.809037  0.730886  0.474155  1
  Fe  Fe134  1  0.259449  0.656385  0.515967  1
  Fe  Fe135  1  0.823883  0.103849  0.461703  1
  Fe  Fe136  1  0.274534  0.029562  0.503468  1
  Fe  Fe137  1  0.544722  0.761097  0.486243  1
  Fe  Fe138  1  0.994879  0.686881  0.527939  1
  Fe  Fe139  1  0.569395  0.045835  0.465386  1
  Fe  Fe140  1  0.019940  0.971686  0.507028  1
  Fe  Fe141  1  0.812431  0.535129  0.471352  1
  Fe  Fe142  1  0.262588  0.460913  0.513048  1
  Fe  Fe143  1  0.787371  0.250324  0.492263  1
  Fe  Fe144  1  0.237916  0.176175  0.533905  1
  Fe  Fe145  1  0.859857  0.388811  0.512305  1
  Fe  Fe146  1  0.408819  0.463525  0.470494  1
  Fe  Fe147  1  0.646130  0.257321  0.529427  1
  Fe  Fe148  1  0.196625  0.331148  0.487839  1
  Fe  Fe149  1  0.670368  0.878814  0.461353  1
  Fe  Fe150  1  0.121277  0.804526  0.503062  1
  Fe  Fe151  1  0.437489  0.919551  0.495418  1
  Fe  Fe152  1  0.887725  0.845158  0.537033  1
  Fe  Fe153  1  0.412519  0.563044  0.522530  1
  Fe  Fe154  1  0.962135  0.637311  0.480826  1
  Fe  Fe155  1  0.570440  0.049956  0.538702  1
  Fe  Fe156  1  0.121092  0.123356  0.496825  1
  Fe  Fe157  1  0.684889  0.611190  0.503562  1
  Fe  Fe158  1  0.234720  0.686102  0.462177  1
  Fe  Fe159  1  0.846014  0.072198  0.517336  1
  Fe  Fe160  1  0.396355  0.146065  0.475434  1
  Fe  Fe161  1  0.845176  0.584699  0.518465  1
  Fe  Fe162  1  0.394791  0.658966  0.476760  1
  Fe  Fe163  1  0.686218  0.098654  0.502465  1
  Fe  Fe164  1  0.236870  0.172054  0.460588  1
  Fe  Fe165  1  0.572590  0.535908  0.537114  1
  Fe  Fe166  1  0.122421  0.610820  0.495728  1
  Fe  Fe167  1  0.410955  0.075945  0.523856  1
  Fe  Fe168  1  0.961296  0.149812  0.481954  1
  Fe  Fe169  1  0.819996  0.228646  0.545397  1
  Fe  Fe170  1  0.270848  0.153870  0.587569  1
  Fe  Fe171  1  0.587007  0.270074  0.579996  1
  Fe  Fe172  1  0.039175  0.195576  0.621587  1
  Fe  Fe173  1  0.511309  0.742293  0.594198  1
  Fe  Fe174  1  0.061030  0.816781  0.553074  1
  Fe  Fe175  1  0.298126  0.609523  0.612394  1
  Fe  Fe176  1  0.848343  0.684814  0.570170  1
  Fe  Fe177  1  0.469081  0.221359  0.549048  1
  Fe  Fe178  1  0.919922  0.147903  0.590431  1
  Fe  Fe179  1  0.409373  0.235121  0.599720  1
  Fe  Fe180  1  0.959222  0.308764  0.557831  1
  Fe  Fe181  1  0.688081  0.778518  0.575240  1
  Fe  Fe182  1  0.138956  0.703488  0.616815  1
  Fe  Fe183  1  0.648661  0.616955  0.607981  1
  Fe  Fe184  1  0.198436  0.689821  0.566754  1
  Fe  Fe185  1  0.447980  0.416668  0.566834  1
  Fe  Fe186  1  0.899200  0.341829  0.608227  1
  Fe  Fe187  1  0.433661  0.044408  0.579507  1
  Fe  Fe188  1  0.884520  0.970403  0.620646  1
  Fe  Fe189  1  0.709575  0.583139  0.557113  1
  Fe  Fe190  1  0.160708  0.508622  0.598986  1
  Fe  Fe191  1  0.724045  0.955999  0.545025  1
  Fe  Fe192  1  0.175305  0.881105  0.587025  1
  Fe  Fe193  1  0.444884  0.612114  0.569746  1
  Fe  Fe194  1  0.895588  0.538090  0.610663  1
  Fe  Fe195  1  0.469704  0.897573  0.549065  1
  Fe  Fe196  1  0.920738  0.824449  0.589988  1
  Fe  Fe197  1  0.712585  0.386721  0.554493  1
  Fe  Fe198  1  0.164119  0.312089  0.596351  1
  Fe  Fe199  1  0.687616  0.102402  0.575741  1
  Fe  Fe200  1  0.138404  0.027275  0.617452  1
  Fe  Fe201  1  0.758983  0.241830  0.595818  1
  Fe  Fe202  1  0.310473  0.314826  0.554122  1
  Fe  Fe203  1  0.546524  0.109395  0.613000  1
  Fe  Fe204  1  0.098027  0.182636  0.571153  1
  Fe  Fe205  1  0.570474  0.730785  0.544563  1
  Fe  Fe206  1  0.021425  0.655946  0.586275  1
  Fe  Fe207  1  0.338297  0.771097  0.578917  1
  Fe  Fe208  1  0.789223  0.696978  0.619934  1
  Fe  Fe209  1  0.312393  0.413590  0.605982  1
  Fe  Fe210  1  0.863026  0.488133  0.563938  1
  Fe  Fe211  1  0.470995  0.903462  0.622295  1
  Fe  Fe212  1  0.021661  0.975329  0.580193  1
  Fe  Fe213  1  0.584840  0.463007  0.587198  1
  Fe  Fe214  1  0.135313  0.536879  0.545334  1
  Fe  Fe215  1  0.747378  0.924846  0.600446  1
  Fe  Fe216  1  0.297134  0.997722  0.558977  1
  Fe  Fe217  1  0.744739  0.436762  0.601571  1
  Fe  Fe218  1  0.295245  0.510721  0.560065  1
  Fe  Fe219  1  0.586867  0.950473  0.585798  1
  Fe  Fe220  1  0.136977  0.023914  0.544276  1
  Fe  Fe221  1  0.472256  0.388444  0.620900  1
  Fe  Fe222  1  0.023204  0.461470  0.578676  1
  Fe  Fe223  1  0.311301  0.927480  0.607647  1
  Fe  Fe224  1  0.861095  0.002195  0.565425  1
  Fe  Fe225  1  0.720779  0.081928  0.628961  1
  Fe  Fe226  1  0.169943  0.005054  0.671018  1
  Fe  Fe227  1  0.487531  0.120997  0.663391  1
  Fe  Fe228  1  0.942404  0.050838  0.704653  1
  Fe  Fe229  1  0.417285  0.599660  0.678855  1
  Fe  Fe230  1  0.960769  0.667148  0.635490  1
  Fe  Fe231  1  0.208565  0.471753  0.696373  1
  Fe  Fe232  1  0.748721  0.538156  0.652807  1
  Fe  Fe233  1  0.370184  0.072316  0.633163  1
  Fe  Fe234  1  0.819944  0.001364  0.673204  1
  Fe  Fe235  1  0.312141  0.089866  0.681406  1
  Fe  Fe236  1  0.858997  0.162692  0.640555  1
  Fe  Fe237  1  0.591550  0.628434  0.656604  1
  Fe  Fe238  1  0.031452  0.564255  0.700476  1
  Fe  Fe239  1  0.551077  0.467082  0.691190  1
  Fe  Fe240  1  0.097245  0.539867  0.649887  1
  Fe  Fe241  1  0.348960  0.270168  0.650528  1
  Fe  Fe242  1  0.801192  0.197677  0.691776  1
  Fe  Fe243  1  0.334257  0.894679  0.662711  1
  Fe  Fe244  1  0.786689  0.826996  0.704565  1
  Fe  Fe245  1  0.609869  0.433479  0.641552  1
  Fe  Fe246  1  0.062260  0.361819  0.683220  1
  Fe  Fe247  1  0.624818  0.808715  0.628243  1
  Fe  Fe248  1  0.072059  0.730984  0.666845  1
  Fe  Fe249  1  0.344956  0.465981  0.652960  1
  Fe  Fe250  1  0.794602  0.390766  0.696325  1
  Fe  Fe251  1  0.369946  0.748647  0.632791  1
  Fe  Fe252  1  0.815883  0.674664  0.675796  1
  Fe  Fe253  1  0.613204  0.239194  0.638505  1
  Fe  Fe254  1  0.063304  0.165484  0.680960  1
  Fe  Fe255  1  0.588757  0.953837  0.658857  1
  Fe  Fe256  1  0.039958  0.877845  0.700889  1
  Fe  Fe257  1  0.659609  0.093420  0.678968  1
  Fe  Fe258  1  0.208300  0.166575  0.637503  1
  Fe  Fe259  1  0.480543  0.950853  0.695901  1
  Fe  Fe260  1  0.999699  0.035064  0.654334  1
  Fe  Fe261  1  0.470735  0.583763  0.627556  1
  Fe  Fe262  1  0.922977  0.509662  0.668479  1
  Fe  Fe263  1  0.237653  0.622416  0.662087  1
  Fe  Fe264  1  0.680649  0.560882  0.702291  1
  Fe  Fe265  1  0.216275  0.268062  0.688465  1
  Fe  Fe266  1  0.762955  0.341552  0.647784  1
  Fe  Fe267  1  0.362623  0.775936  0.705388  1
  Fe  Fe268  1  0.920722  0.828889  0.663314  1
  Fe  Fe269  1  0.487484  0.317174  0.669795  1
  Fe  Fe270  1  0.036203  0.387725  0.629001  1
  Fe  Fe271  1  0.648245  0.780288  0.683219  1
  Fe  Fe272  1  0.197137  0.849037  0.642375  1
  Fe  Fe273  1  0.646346  0.290951  0.684572  1
  Fe  Fe274  1  0.195019  0.362221  0.644418  1
  Fe  Fe275  1  0.486569  0.796912  0.668906  1
  Fe  Fe276  1  0.037702  0.876530  0.627322  1
  Fe  Fe277  1  0.376664  0.243717  0.705192  1
  Fe  Fe278  1  0.922536  0.315907  0.662208  1
  Fe  Fe279  1  0.209257  0.778007  0.690736  1
  Fe  Fe280  1  0.762656  0.854006  0.648562  1
  C  C281  1  0.930303  0.413567  0.372564  1
  C  C282  1  0.482051  0.488594  0.329814  1
  C  C283  1  0.946477  0.783587  0.360101  1
  C  C284  1  0.491950  0.856311  0.317307  1
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