# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56477885
_cell_length_b   14.15764974
_cell_length_c   49.24525921
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.42527284
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe120 C48'
_cell_volume   3167.49835474
_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  0.778889  0.107630  0.313288  1
  Fe  Fe2  1  0.133235  0.389663  0.304127  1
  Fe  Fe3  1  0.434335  0.397348  0.344179  1
  Fe  Fe4  1  0.437296  0.244563  0.318856  1
  Fe  Fe5  1  0.917645  0.293635  0.334785  1
  Fe  Fe6  1  0.979797  0.236083  0.290320  1
  Fe  Fe7  1  0.283269  0.073173  0.301426  1
  Fe  Fe8  1  0.632928  0.383710  0.289614  1
  Fe  Fe9  1  0.986992  0.931754  0.288653  1
  Fe  Fe10  1  0.409352  0.144875  0.354750  1
  Fe  Fe11  1  0.747376  0.722501  0.348998  1
  Fe  Fe12  1  0.099436  0.005192  0.340544  1
  Fe  Fe13  1  0.474621  0.784518  0.307609  1
  Fe  Fe14  1  0.403361  0.858671  0.354437  1
  Fe  Fe15  1  0.959989  0.679164  0.298364  1
  Fe  Fe16  1  0.954619  0.833631  0.324903  1
  Fe  Fe17  1  0.261240  0.688318  0.338014  1
  Fe  Fe18  1  0.611680  0.969235  0.329814  1
  Fe  Fe19  1  0.940638  0.544607  0.323907  1
  Fe  Fe20  1  0.447943  0.532161  0.318964  1
  Fe  Fe21  1  0.706857  0.337721  0.384748  1
  Fe  Fe22  1  0.062226  0.618889  0.376028  1
  Fe  Fe23  1  0.362650  0.628765  0.415577  1
  Fe  Fe24  1  0.362695  0.474238  0.390033  1
  Fe  Fe25  1  0.845559  0.524547  0.405635  1
  Fe  Fe26  1  0.920152  0.447595  0.359768  1
  Fe  Fe27  1  0.217461  0.302673  0.373863  1
  Fe  Fe28  1  0.574832  0.584451  0.365139  1
  Fe  Fe29  1  0.909782  0.160792  0.359081  1
  Fe  Fe30  1  0.337795  0.376686  0.426304  1
  Fe  Fe31  1  0.671330  0.953128  0.420471  1
  Fe  Fe32  1  0.025169  0.234569  0.411945  1
  Fe  Fe33  1  0.399542  0.013256  0.380084  1
  Fe  Fe34  1  0.326939  0.089676  0.425851  1
  Fe  Fe35  1  0.885024  0.908730  0.370193  1
  Fe  Fe36  1  0.881990  0.063668  0.395749  1
  Fe  Fe37  1  0.184755  0.918488  0.409608  1
  Fe  Fe38  1  0.537807  0.199672  0.401212  1
  Fe  Fe39  1  0.871106  0.776122  0.395058  1
  Fe  Fe40  1  0.376244  0.761185  0.390676  1
  Fe  Fe41  1  0.633499  0.568387  0.456031  1
  Fe  Fe42  1  0.987826  0.849895  0.447595  1
  Fe  Fe43  1  0.288016  0.859628  0.487074  1
  Fe  Fe44  1  0.289233  0.704991  0.461507  1
  Fe  Fe45  1  0.771832  0.755129  0.477108  1
  Fe  Fe46  1  0.844918  0.678622  0.431156  1
  Fe  Fe47  1  0.146027  0.533969  0.445115  1
  Fe  Fe48  1  0.500854  0.815142  0.436736  1
  Fe  Fe49  1  0.833209  0.392100  0.430837  1
  Fe  Fe50  1  0.263420  0.607545  0.497736  1
  Fe  Fe51  1  0.596982  0.184110  0.491816  1
  Fe  Fe52  1  0.951163  0.465560  0.483355  1
  Fe  Fe53  1  0.325578  0.244358  0.451433  1
  Fe  Fe54  1  0.252601  0.320696  0.497226  1
  Fe  Fe55  1  0.809817  0.139769  0.441496  1
  Fe  Fe56  1  0.808144  0.294533  0.467073  1
  Fe  Fe57  1  0.109794  0.149444  0.480945  1
  Fe  Fe58  1  0.463583  0.431211  0.472404  1
  Fe  Fe59  1  0.796113  0.007210  0.466515  1
  Fe  Fe60  1  0.301443  0.992185  0.462056  1
  Fe  Fe61  1  0.559581  0.799159  0.527514  1
  Fe  Fe62  1  0.913369  0.080926  0.518973  1
  Fe  Fe63  1  0.213347  0.090601  0.558423  1
  Fe  Fe64  1  0.215019  0.935837  0.532846  1
  Fe  Fe65  1  0.697585  0.986012  0.548485  1
  Fe  Fe66  1  0.770563  0.909675  0.502693  1
  Fe  Fe67  1  0.072001  0.764810  0.516564  1
  Fe  Fe68  1  0.426182  0.046260  0.508102  1
  Fe  Fe69  1  0.759744  0.622825  0.502182  1
  Fe  Fe70  1  0.189955  0.838270  0.569082  1
  Fe  Fe71  1  0.522309  0.415228  0.563182  1
  Fe  Fe72  1  0.877136  0.696401  0.554803  1
  Fe  Fe73  1  0.251332  0.475241  0.522811  1
  Fe  Fe74  1  0.178246  0.551748  0.568763  1
  Fe  Fe75  1  0.735147  0.370742  0.512844  1
  Fe  Fe76  1  0.733931  0.525379  0.538412  1
  Fe  Fe77  1  0.035338  0.380475  0.552324  1
  Fe  Fe78  1  0.389664  0.661984  0.543887  1
  Fe  Fe79  1  0.721721  0.238185  0.537862  1
  Fe  Fe80  1  0.227051  0.223160  0.533404  1
  Fe  Fe81  1  0.485357  0.030698  0.598707  1
  Fe  Fe82  1  0.838409  0.311882  0.590311  1
  Fe  Fe83  1  0.138140  0.321640  0.629726  1
  Fe  Fe84  1  0.141174  0.166702  0.604169  1
  Fe  Fe85  1  0.623622  0.217115  0.619834  1
  Fe  Fe86  1  0.696224  0.140694  0.574067  1
  Fe  Fe87  1  0.997995  0.995801  0.587973  1
  Fe  Fe88  1  0.351834  0.277242  0.579447  1
  Fe  Fe89  1  0.685369  0.853684  0.573615  1
  Fe  Fe90  1  0.113381  0.069578  0.640837  1
  Fe  Fe91  1  0.448332  0.645919  0.634780  1
  Fe  Fe92  1  0.805703  0.927697  0.626055  1
  Fe  Fe93  1  0.177605  0.705823  0.594283  1
  Fe  Fe94  1  0.103011  0.782776  0.640150  1
  Fe  Fe95  1  0.660514  0.601605  0.584342  1
  Fe  Fe96  1  0.660468  0.756132  0.609886  1
  Fe  Fe97  1  0.960938  0.611481  0.623890  1
  Fe  Fe98  1  0.316307  0.892649  0.615170  1
  Fe  Fe99  1  0.646919  0.469185  0.609242  1
  Fe  Fe100  1  0.152058  0.454248  0.604860  1
  Fe  Fe101  1  0.411483  0.261135  0.670104  1
  Fe  Fe102  1  0.761924  0.542052  0.661904  1
  Fe  Fe103  1  0.063175  0.551206  0.701554  1
  Fe  Fe104  1  0.068544  0.396739  0.675015  1
  Fe  Fe105  1  0.548543  0.445852  0.692310  1
  Fe  Fe106  1  0.619803  0.371699  0.645481  1
  Fe  Fe107  1  0.923728  0.225178  0.659374  1
  Fe  Fe108  1  0.275787  0.507869  0.650920  1
  Fe  Fe109  1  0.613812  0.085495  0.645168  1
  Fe  Fe110  1  0.036171  0.298616  0.711265  1
  Fe  Fe111  1  0.390235  0.846660  0.710304  1
  Fe  Fe112  1  0.739895  0.157197  0.698492  1
  Fe  Fe113  1  0.105518  0.936736  0.665134  1
  Fe  Fe114  1  0.043367  0.994287  0.709599  1
  Fe  Fe115  1  0.588829  0.833022  0.655739  1
  Fe  Fe116  1  0.585868  0.985808  0.681062  1
  Fe  Fe117  1  0.889928  0.840707  0.695791  1
  Fe  Fe118  1  0.244275  0.122740  0.686631  1
  Fe  Fe119  1  0.575221  0.698209  0.680954  1
  Fe  Fe120  1  0.082526  0.685763  0.676011  1
  C  C121  1  0.776120  0.424625  0.323928  1
  C  C122  1  0.109750  0.171498  0.324990  1
  C  C123  1  0.578096  0.264154  0.355020  1
  C  C124  1  0.245488  0.520920  0.352902  1
  C  C125  1  0.824283  0.811503  0.288544  1
  C  C126  1  0.143615  0.554627  0.289974  1
  C  C127  1  0.620535  0.650746  0.318811  1
  C  C128  1  0.281213  0.906009  0.317762  1
  C  C129  1  0.702827  0.656744  0.395179  1
  C  C130  1  0.036479  0.401325  0.396870  1
  C  C131  1  0.505496  0.496157  0.425981  1
  C  C132  1  0.171123  0.751746  0.424537  1
  C  C133  1  0.739808  0.041743  0.359786  1
  C  C134  1  0.077126  0.785774  0.361252  1
  C  C135  1  0.544096  0.880627  0.390453  1
  C  C136  1  0.208347  0.136451  0.388868  1
  C  C137  1  0.628346  0.887746  0.466727  1
  C  C138  1  0.962846  0.632027  0.468204  1
  C  C139  1  0.431655  0.726924  0.497465  1
  C  C140  1  0.096628  0.982724  0.495933  1
  C  C141  1  0.665993  0.272547  0.431110  1
  C  C142  1  0.000936  0.016633  0.432637  1
  C  C143  1  0.469277  0.111637  0.461810  1
  C  C144  1  0.134282  0.367496  0.460260  1
  C  C145  1  0.553887  0.118733  0.538108  1
  C  C146  1  0.888882  0.862874  0.539658  1
  C  C147  1  0.357170  0.957823  0.568808  1
  C  C148  1  0.022228  0.213737  0.567281  1
  C  C149  1  0.591508  0.503447  0.502453  1
  C  C150  1  0.926536  0.247646  0.503986  1
  C  C151  1  0.394817  0.342624  0.533192  1
  C  C152  1  0.060318  0.598343  0.531714  1
  C  C153  1  0.479068  0.349744  0.609465  1
  C  C154  1  0.814817  0.093919  0.611050  1
  C  C155  1  0.283356  0.188628  0.640132  1
  C  C156  1  0.946038  0.444596  0.638666  1
  C  C157  1  0.517668  0.734213  0.573937  1
  C  C158  1  0.852040  0.478624  0.575381  1
  C  C159  1  0.320337  0.573626  0.604740  1
  C  C160  1  0.986684  0.829045  0.603048  1
  C  C161  1  0.402629  0.579624  0.681107  1
  C  C162  1  0.741951  0.324362  0.682156  1
  C  C163  1  0.198881  0.418867  0.711375  1
  C  C164  1  0.879549  0.675743  0.709944  1
  C  C165  1  0.445068  0.966216  0.644898  1
  C  C166  1  0.777676  0.709450  0.647016  1
  C  C167  1  0.247044  0.805745  0.675990  1
  C  C168  1  0.913413  0.058873  0.674929  1
