# generated using pymatgen
data_Fe7C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07354378
_cell_length_b   24.19167366
_cell_length_c   53.25053066
_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   'Fe210 C90'
_cell_volume   5247.61836692
_cell_formula_units_Z   30
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  0.742536  0.898735  0.275315  1
  Fe  Fe2  1  0.743909  0.437841  0.336112  1
  Fe  Fe3  1  0.741227  0.167738  0.305112  1
  Fe  Fe4  1  0.268210  0.033266  0.278280  1
  Fe  Fe5  1  0.248467  0.578129  0.340323  1
  Fe  Fe6  1  0.252671  0.308142  0.309754  1
  Fe  Fe7  1  0.033143  0.918601  0.314504  1
  Fe  Fe8  1  0.036646  0.651259  0.284817  1
  Fe  Fe9  1  0.036256  0.189666  0.344481  1
  Fe  Fe10  1  0.534819  0.905436  0.339929  1
  Fe  Fe11  1  0.538307  0.637293  0.310168  1
  Fe  Fe12  1  0.536699  0.368051  0.280068  1
  Fe  Fe13  1  0.531430  0.973897  0.307130  1
  Fe  Fe14  1  0.528202  0.708609  0.275081  1
  Fe  Fe15  1  0.531027  0.245680  0.337528  1
  Fe  Fe16  1  0.035871  0.678533  0.328430  1
  Fe  Fe17  1  0.033954  0.411516  0.297513  1
  Fe  Fe18  1  0.037033  0.947607  0.358247  1
  Fe  Fe19  1  0.035548  0.749719  0.295854  1
  Fe  Fe20  1  0.033126  0.286788  0.355591  1
  Fe  Fe21  1  0.037484  0.017210  0.325691  1
  Fe  Fe22  1  0.534292  0.734126  0.320809  1
  Fe  Fe23  1  0.533368  0.465177  0.291018  1
  Fe  Fe24  1  0.537454  0.003435  0.350924  1
  Fe  Fe25  1  0.757137  0.833059  0.306062  1
  Fe  Fe26  1  0.763799  0.567463  0.274888  1
  Fe  Fe27  1  0.737379  0.101818  0.337139  1
  Fe  Fe28  1  0.248055  0.820308  0.329419  1
  Fe  Fe29  1  0.251939  0.552566  0.298590  1
  Fe  Fe30  1  0.250016  0.089795  0.359035  1
  Fe  Fe31  1  0.247665  0.755546  0.360300  1
  Fe  Fe32  1  0.244518  0.486791  0.329736  1
  Fe  Fe33  1  0.245727  0.218377  0.299085  1
  Fe  Fe34  1  0.747412  0.615023  0.356394  1
  Fe  Fe35  1  0.746515  0.346495  0.326128  1
  Fe  Fe36  1  0.749640  0.075725  0.295001  1
  Fe  Fe37  1  0.747948  0.807822  0.353593  1
  Fe  Fe38  1  0.745018  0.539518  0.323425  1
  Fe  Fe39  1  0.755495  0.269551  0.291771  1
  Fe  Fe40  1  0.256188  0.846016  0.281126  1
  Fe  Fe41  1  0.245499  0.385376  0.343403  1
  Fe  Fe42  1  0.233794  0.113902  0.314877  1
  Fe  Fe43  1  0.747234  0.706273  0.366842  1
  Fe  Fe44  1  0.747528  0.244875  0.426773  1
  Fe  Fe45  1  0.746346  0.975407  0.396595  1
  Fe  Fe46  1  0.246534  0.847102  0.370503  1
  Fe  Fe47  1  0.248573  0.385543  0.430827  1
  Fe  Fe48  1  0.246466  0.116362  0.400372  1
  Fe  Fe49  1  0.034428  0.727673  0.405908  1
  Fe  Fe50  1  0.034597  0.458621  0.375440  1
  Fe  Fe51  1  0.035884  0.996658  0.435788  1
  Fe  Fe52  1  0.535511  0.713739  0.431401  1
  Fe  Fe53  1  0.534240  0.444782  0.400933  1
  Fe  Fe54  1  0.539408  0.175398  0.370221  1
  Fe  Fe55  1  0.535248  0.783327  0.398504  1
  Fe  Fe56  1  0.534919  0.514585  0.368154  1
  Fe  Fe57  1  0.537209  0.052301  0.428363  1
  Fe  Fe58  1  0.035309  0.486361  0.419252  1
  Fe  Fe59  1  0.037036  0.217083  0.388493  1
  Fe  Fe60  1  0.035900  0.755616  0.449655  1
  Fe  Fe61  1  0.035694  0.556179  0.386440  1
  Fe  Fe62  1  0.037247  0.094204  0.446593  1
  Fe  Fe63  1  0.035390  0.825189  0.416760  1
  Fe  Fe64  1  0.535285  0.542100  0.411998  1
  Fe  Fe65  1  0.536294  0.272851  0.381357  1
  Fe  Fe66  1  0.535494  0.811261  0.442237  1
  Fe  Fe67  1  0.749056  0.641237  0.397633  1
  Fe  Fe68  1  0.746469  0.372119  0.367171  1
  Fe  Fe69  1  0.750484  0.910202  0.427568  1
  Fe  Fe70  1  0.248121  0.628733  0.420325  1
  Fe  Fe71  1  0.247376  0.359790  0.389775  1
  Fe  Fe72  1  0.249590  0.897759  0.450448  1
  Fe  Fe73  1  0.246537  0.563288  0.451128  1
  Fe  Fe74  1  0.246015  0.293787  0.420447  1
  Fe  Fe75  1  0.251053  0.024715  0.390172  1
  Fe  Fe76  1  0.748719  0.422670  0.447156  1
  Fe  Fe77  1  0.748648  0.152971  0.416369  1
  Fe  Fe78  1  0.746404  0.883846  0.386495  1
  Fe  Fe79  1  0.750950  0.615534  0.444273  1
  Fe  Fe80  1  0.751988  0.346036  0.413546  1
  Fe  Fe81  1  0.755276  0.077542  0.383297  1
  Fe  Fe82  1  0.250846  0.654315  0.373462  1
  Fe  Fe83  1  0.253958  0.192514  0.433662  1
  Fe  Fe84  1  0.253728  0.923292  0.403269  1
  Fe  Fe85  1  0.747032  0.514210  0.457477  1
  Fe  Fe86  1  0.747705  0.052575  0.517800  1
  Fe  Fe87  1  0.747343  0.783421  0.487921  1
  Fe  Fe88  1  0.248837  0.654902  0.461475  1
  Fe  Fe89  1  0.247866  0.193131  0.521517  1
  Fe  Fe90  1  0.246291  0.924202  0.491589  1
  Fe  Fe91  1  0.035504  0.535404  0.496577  1
  Fe  Fe92  1  0.036740  0.266049  0.465926  1
  Fe  Fe93  1  0.035989  0.804696  0.527048  1
  Fe  Fe94  1  0.534776  0.521590  0.522177  1
  Fe  Fe95  1  0.536017  0.252191  0.491512  1
  Fe  Fe96  1  0.535554  0.982827  0.461303  1
  Fe  Fe97  1  0.535464  0.591255  0.489386  1
  Fe  Fe98  1  0.535471  0.321884  0.458732  1
  Fe  Fe99  1  0.535975  0.860357  0.519590  1
  Fe  Fe100  1  0.035464  0.293807  0.509778  1
  Fe  Fe101  1  0.035975  0.024705  0.479575  1
  Fe  Fe102  1  0.035471  0.563179  0.540433  1
  Fe  Fe103  1  0.034776  0.363472  0.476988  1
  Fe  Fe104  1  0.035554  0.902235  0.537862  1
  Fe  Fe105  1  0.036017  0.632871  0.507653  1
  Fe  Fe106  1  0.535504  0.349658  0.502588  1
  Fe  Fe107  1  0.535989  0.080366  0.472117  1
  Fe  Fe108  1  0.536740  0.619014  0.533239  1
  Fe  Fe109  1  0.746326  0.448596  0.488332  1
  Fe  Fe110  1  0.749053  0.179385  0.457634  1
  Fe  Fe111  1  0.748789  0.718000  0.518856  1
  Fe  Fe112  1  0.246326  0.436467  0.510833  1
  Fe  Fe113  1  0.248789  0.167063  0.480309  1
  Fe  Fe114  1  0.249053  0.705677  0.541531  1
  Fe  Fe115  1  0.247032  0.370852  0.541688  1
  Fe  Fe116  1  0.247343  0.101641  0.511244  1
  Fe  Fe117  1  0.247705  0.832488  0.481365  1
  Fe  Fe118  1  0.748837  0.230161  0.537690  1
  Fe  Fe119  1  0.746291  0.960860  0.507576  1
  Fe  Fe120  1  0.747866  0.691931  0.477648  1
  Fe  Fe121  1  0.751373  0.423050  0.534796  1
  Fe  Fe122  1  0.752130  0.153894  0.504445  1
  Fe  Fe123  1  0.751582  0.884859  0.474595  1
  Fe  Fe124  1  0.251373  0.462012  0.464369  1
  Fe  Fe125  1  0.251582  1.000204  0.524570  1
  Fe  Fe126  1  0.252130  0.731168  0.494720  1
  Fe  Fe127  1  0.746537  0.321774  0.548037  1
  Fe  Fe128  1  0.751053  0.860347  0.608993  1
  Fe  Fe129  1  0.746015  0.591275  0.578718  1
  Fe  Fe130  1  0.248719  0.462392  0.552009  1
  Fe  Fe131  1  0.246404  0.001216  0.612670  1
  Fe  Fe132  1  0.248648  0.732091  0.582796  1
  Fe  Fe133  1  0.035285  0.342962  0.587167  1
  Fe  Fe134  1  0.035494  0.073801  0.556928  1
  Fe  Fe135  1  0.036294  0.612211  0.617808  1
  Fe  Fe136  1  0.535694  0.328883  0.612725  1
  Fe  Fe137  1  0.535390  0.059873  0.582405  1
  Fe  Fe138  1  0.537247  0.790858  0.552572  1
  Fe  Fe139  1  0.535309  0.398701  0.579913  1
  Fe  Fe140  1  0.535900  0.129446  0.549510  1
  Fe  Fe141  1  0.537036  0.667979  0.610672  1
  Fe  Fe142  1  0.035248  0.101736  0.600661  1
  Fe  Fe143  1  0.037209  0.832761  0.570802  1
  Fe  Fe144  1  0.034919  0.370478  0.631011  1
  Fe  Fe145  1  0.035511  0.171324  0.567764  1
  Fe  Fe146  1  0.039408  0.709664  0.628944  1
  Fe  Fe147  1  0.034240  0.440280  0.598232  1
  Fe  Fe148  1  0.534428  0.157389  0.593257  1
  Fe  Fe149  1  0.535884  0.888404  0.563377  1
  Fe  Fe150  1  0.534597  0.426441  0.623725  1
  Fe  Fe151  1  0.748121  0.256329  0.578840  1
  Fe  Fe152  1  0.749590  0.987303  0.548717  1
  Fe  Fe153  1  0.747376  0.525272  0.609390  1
  Fe  Fe154  1  0.249056  0.243825  0.601532  1
  Fe  Fe155  1  0.250484  0.974860  0.571597  1
  Fe  Fe156  1  0.246469  0.512943  0.631994  1
  Fe  Fe157  1  0.247234  0.178789  0.632323  1
  Fe  Fe158  1  0.246346  0.909655  0.602570  1
  Fe  Fe159  1  0.247528  0.640187  0.572392  1
  Fe  Fe160  1  0.746534  0.037961  0.628662  1
  Fe  Fe161  1  0.746466  0.768701  0.598793  1
  Fe  Fe162  1  0.748573  0.499519  0.568338  1
  Fe  Fe163  1  0.750846  0.230747  0.625703  1
  Fe  Fe164  1  0.753728  0.961770  0.595896  1
  Fe  Fe165  1  0.753958  0.692549  0.565503  1
  Fe  Fe166  1  0.250950  0.269528  0.554892  1
  Fe  Fe167  1  0.255276  0.807520  0.615868  1
  Fe  Fe168  1  0.251988  0.539026  0.585619  1
  Fe  Fe169  1  0.747665  0.129516  0.638865  1
  Fe  Fe170  1  0.745727  0.666686  0.700080  1
  Fe  Fe171  1  0.744518  0.398271  0.669429  1
  Fe  Fe172  1  0.247412  0.270039  0.642771  1
  Fe  Fe173  1  0.249640  0.809338  0.704164  1
  Fe  Fe174  1  0.246515  0.538567  0.673037  1
  Fe  Fe175  1  0.034292  0.150936  0.678356  1
  Fe  Fe176  1  0.037454  0.881627  0.648241  1
  Fe  Fe177  1  0.033368  0.419885  0.708147  1
  Fe  Fe178  1  0.535548  0.135343  0.703311  1
  Fe  Fe179  1  0.537484  0.867852  0.673474  1
  Fe  Fe180  1  0.533126  0.598274  0.643574  1
  Fe  Fe181  1  0.535871  0.206529  0.670735  1
  Fe  Fe182  1  0.537033  0.937455  0.640918  1
  Fe  Fe183  1  0.533954  0.473547  0.701652  1
  Fe  Fe184  1  0.031430  0.911165  0.692035  1
  Fe  Fe185  1  0.031027  0.639383  0.661637  1
  Fe  Fe186  1  0.028202  0.176453  0.724084  1
  Fe  Fe187  1  0.034819  0.979627  0.659236  1
  Fe  Fe188  1  0.036699  0.517011  0.719097  1
  Fe  Fe189  1  0.038307  0.247770  0.688997  1
  Fe  Fe190  1  0.533143  0.966461  0.684661  1
  Fe  Fe191  1  0.536256  0.695396  0.654684  1
  Fe  Fe192  1  0.536646  0.233803  0.714348  1
  Fe  Fe193  1  0.748055  0.064754  0.669746  1
  Fe  Fe194  1  0.750016  0.795267  0.640130  1
  Fe  Fe195  1  0.751939  0.332496  0.700575  1
  Fe  Fe196  1  0.257137  0.052003  0.693103  1
  Fe  Fe197  1  0.237379  0.783244  0.662026  1
  Fe  Fe198  1  0.263799  0.317599  0.724277  1
  Fe  Fe199  1  0.242536  0.986327  0.723850  1
  Fe  Fe200  1  0.241227  0.717324  0.694053  1
  Fe  Fe201  1  0.243909  0.447221  0.663053  1
  Fe  Fe202  1  0.768210  0.851796  0.720885  1
  Fe  Fe203  1  0.752671  0.576920  0.689411  1
  Fe  Fe204  1  0.748467  0.306933  0.658842  1
  Fe  Fe205  1  0.756188  0.039046  0.718039  1
  Fe  Fe206  1  0.733794  0.771160  0.684288  1
  Fe  Fe207  1  0.745499  0.499687  0.655762  1
  Fe  Fe208  1  0.247948  0.077241  0.645572  1
  Fe  Fe209  1  0.255495  0.615511  0.707394  1
  Fe  Fe210  1  0.245018  0.345544  0.675740  1
  C  C211  1  0.964700  0.756886  0.331404  1
  C  C212  1  0.963402  0.489839  0.300760  1
  C  C213  1  0.969349  0.026059  0.361206  1
  C  C214  1  0.470266  0.778897  0.291352  1
  C  C215  1  0.465359  0.317678  0.352014  1
  C  C216  1  0.471433  0.046611  0.321004  1
  C  C217  1  0.468840  0.671298  0.342389  1
  C  C218  1  0.461422  0.401960  0.312210  1
  C  C219  1  0.440197  0.129863  0.283257  1
  C  C220  1  0.965959  0.982529  0.293662  1
  C  C221  1  0.967934  0.522012  0.354230  1
  C  C222  1  0.962587  0.252956  0.323331  1
  C  C223  1  0.967260  0.875149  0.344329  1
  C  C224  1  0.969723  0.606319  0.314154  1
  C  C225  1  0.970591  0.338299  0.284264  1
  C  C226  1  0.464882  0.895414  0.304474  1
  C  C227  1  0.470501  0.629727  0.274588  1
  C  C228  1  0.470111  0.167088  0.334678  1
  C  C229  1  0.968096  0.564851  0.421979  1
  C  C230  1  0.969756  0.295578  0.391178  1
  C  C231  1  0.967892  0.834102  0.452289  1
  C  C232  1  0.468338  0.586680  0.382520  1
  C  C233  1  0.469930  0.124599  0.442515  1
  C  C234  1  0.468025  0.855592  0.412683  1
  C  C235  1  0.468040  0.478730  0.433213  1
  C  C236  1  0.469579  0.209303  0.402469  1
  C  C237  1  0.470356  0.940004  0.372105  1
  C  C238  1  0.968190  0.790874  0.384575  1
  C  C239  1  0.968085  0.329419  0.444738  1
  C  C240  1  0.970095  0.059823  0.414417  1
  C  C241  1  0.968203  0.683360  0.435477  1
  C  C242  1  0.966603  0.414236  0.404964  1
  C  C243  1  0.972672  0.145045  0.373998  1
  C  C244  1  0.466927  0.704849  0.395885  1
  C  C245  1  0.467554  0.436120  0.365379  1
  C  C246  1  0.468428  0.973820  0.425776  1
  C  C247  1  0.968628  0.372302  0.512536  1
  C  C248  1  0.968591  0.103216  0.482109  1
  C  C249  1  0.969744  0.641704  0.543203  1
  C  C250  1  0.467331  0.393998  0.473056  1
  C  C251  1  0.468285  0.932593  0.533783  1
  C  C252  1  0.468593  0.663393  0.503715  1
  C  C253  1  0.468134  0.286222  0.523755  1
  C  C254  1  0.469080  0.017218  0.493479  1
  C  C255  1  0.468847  0.748079  0.463585  1
  C  C256  1  0.968134  0.598841  0.475410  1
  C  C257  1  0.968847  0.136983  0.535580  1
  C  C258  1  0.969080  0.867845  0.505686  1
  C  C259  1  0.967331  0.491065  0.526109  1
  C  C260  1  0.968593  0.221669  0.495450  1
  C  C261  1  0.968285  0.952470  0.465382  1
  C  C262  1  0.468628  0.512760  0.486629  1
  C  C263  1  0.469744  0.243359  0.455962  1
  C  C264  1  0.468591  0.781846  0.517056  1
  C  C265  1  0.966927  0.180214  0.603280  1
  C  C266  1  0.968428  0.911242  0.573389  1
  C  C267  1  0.967554  0.448943  0.633786  1
  C  C268  1  0.468203  0.201702  0.563688  1
  C  C269  1  0.472672  0.740017  0.625167  1
  C  C270  1  0.466603  0.470826  0.594201  1
  C  C271  1  0.468190  0.094188  0.614590  1
  C  C272  1  0.470095  0.825239  0.584748  1
  C  C273  1  0.468085  0.555643  0.554427  1
  C  C274  1  0.968040  0.406332  0.565952  1
  C  C275  1  0.970356  0.945058  0.627060  1
  C  C276  1  0.969579  0.675759  0.596696  1
  C  C277  1  0.968338  0.298382  0.616645  1
  C  C278  1  0.968025  0.029471  0.586482  1
  C  C279  1  0.969930  0.760463  0.556650  1
  C  C280  1  0.468096  0.320211  0.577186  1
  C  C281  1  0.467892  0.050960  0.546876  1
  C  C282  1  0.469756  0.589484  0.607987  1
  C  C283  1  0.964882  0.989648  0.694691  1
  C  C284  1  0.970111  0.717974  0.664487  1
  C  C285  1  0.970501  0.255335  0.724577  1
  C  C286  1  0.467260  0.009913  0.654836  1
  C  C287  1  0.470591  0.546763  0.714901  1
  C  C288  1  0.469723  0.278743  0.685011  1
  C  C289  1  0.465959  0.902533  0.705503  1
  C  C290  1  0.462587  0.632106  0.675834  1
  C  C291  1  0.467934  0.363050  0.644935  1
  C  C292  1  0.968840  0.213764  0.656776  1
  C  C293  1  0.940197  0.755199  0.715908  1
  C  C294  1  0.961422  0.483102  0.686955  1
  C  C295  1  0.970266  0.106166  0.707813  1
  C  C296  1  0.971433  0.838451  0.678161  1
  C  C297  1  0.965359  0.567384  0.647151  1
  C  C298  1  0.464700  0.128176  0.667761  1
  C  C299  1  0.469349  0.859003  0.637959  1
  C  C300  1  0.463402  0.395223  0.698405  1
