# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.60734290
_cell_length_b   7.76459444
_cell_length_c   46.74039184
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   55.36758492
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe120 C48'
_cell_volume   3167.52406689
_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  0.306637  0.157181  0.287726  1
  Fe  Fe2  1  0.784920  0.983134  0.323979  1
  Fe  Fe3  1  0.958000  0.625545  0.320301  1
  Fe  Fe4  1  0.443247  0.433884  0.356292  1
  Fe  Fe5  1  0.068853  0.274667  0.314459  1
  Fe  Fe6  1  0.558364  0.086202  0.350650  1
  Fe  Fe7  1  0.950408  0.126987  0.342427  1
  Fe  Fe8  1  0.463930  0.314470  0.305907  1
  Fe  Fe9  1  0.274253  0.294742  0.338073  1
  Fe  Fe10  1  0.786799  0.481104  0.302669  1
  Fe  Fe11  1  0.357516  0.952273  0.329509  1
  Fe  Fe12  1  0.875905  0.131494  0.292570  1
  Fe  Fe13  1  0.103828  0.808549  0.322141  1
  Fe  Fe14  1  0.590508  0.619888  0.357184  1
  Fe  Fe15  1  0.868628  0.463314  0.350937  1
  Fe  Fe16  1  0.381295  0.651924  0.312898  1
  Fe  Fe17  1  0.185705  0.519884  0.294564  1
  Fe  Fe18  1  0.669377  0.333416  0.330552  1
  Fe  Fe19  1  0.163807  0.971711  0.288053  1
  Fe  Fe20  1  0.633457  0.800064  0.323369  1
  Fe  Fe21  1  0.270525  0.794925  0.359883  1
  Fe  Fe22  1  0.755331  0.607200  0.395807  1
  Fe  Fe23  1  0.929831  0.244866  0.391804  1
  Fe  Fe24  1  0.414791  0.056336  0.427548  1
  Fe  Fe25  1  0.043014  0.896447  0.385886  1
  Fe  Fe26  1  0.528889  0.707660  0.421615  1
  Fe  Fe27  1  0.923092  0.748351  0.413763  1
  Fe  Fe28  1  0.437224  0.937366  0.378296  1
  Fe  Fe29  1  0.247750  0.914471  0.409520  1
  Fe  Fe30  1  0.761105  0.103243  0.373961  1
  Fe  Fe31  1  0.329193  0.577553  0.401199  1
  Fe  Fe32  1  0.843078  0.766053  0.365386  1
  Fe  Fe33  1  0.076897  0.431168  0.392647  1
  Fe  Fe34  1  0.562974  0.242202  0.428544  1
  Fe  Fe35  1  0.841639  0.085016  0.422338  1
  Fe  Fe36  1  0.355084  0.274634  0.386371  1
  Fe  Fe37  1  0.156053  0.145329  0.365856  1
  Fe  Fe38  1  0.641751  0.955172  0.401735  1
  Fe  Fe39  1  0.120832  0.610530  0.359147  1
  Fe  Fe40  1  0.607649  0.421086  0.395033  1
  Fe  Fe41  1  0.241586  0.417719  0.431442  1
  Fe  Fe42  1  0.727207  0.228849  0.467203  1
  Fe  Fe43  1  0.901168  0.867420  0.463213  1
  Fe  Fe44  1  0.386839  0.678773  0.498927  1
  Fe  Fe45  1  0.014884  0.518680  0.457271  1
  Fe  Fe46  1  0.500587  0.330125  0.493003  1
  Fe  Fe47  1  0.894808  0.370822  0.485125  1
  Fe  Fe48  1  0.409058  0.559447  0.449480  1
  Fe  Fe49  1  0.219299  0.536869  0.480953  1
  Fe  Fe50  1  0.733579  0.725327  0.445293  1
  Fe  Fe51  1  0.301122  0.199606  0.472500  1
  Fe  Fe52  1  0.815433  0.388144  0.436716  1
  Fe  Fe53  1  0.048807  0.053370  0.464104  1
  Fe  Fe54  1  0.534567  0.864769  0.499830  1
  Fe  Fe55  1  0.813060  0.707849  0.493657  1
  Fe  Fe56  1  0.327242  0.896611  0.457902  1
  Fe  Fe57  1  0.127712  0.766212  0.437406  1
  Fe  Fe58  1  0.613503  0.577619  0.473120  1
  Fe  Fe59  1  0.093767  0.231625  0.430565  1
  Fe  Fe60  1  0.579495  0.042977  0.466300  1
  Fe  Fe61  1  0.213113  0.040151  0.502883  1
  Fe  Fe62  1  0.698785  0.851504  0.538597  1
  Fe  Fe63  1  0.872745  0.490075  0.534607  1
  Fe  Fe64  1  0.358366  0.301205  0.570368  1
  Fe  Fe65  1  0.986449  0.141305  0.528690  1
  Fe  Fe66  1  0.472241  0.952712  0.564404  1
  Fe  Fe67  1  0.866374  0.993597  0.556517  1
  Fe  Fe68  1  0.380654  0.182055  0.520857  1
  Fe  Fe69  1  0.190895  0.159477  0.552330  1
  Fe  Fe70  1  0.705145  0.348102  0.516685  1
  Fe  Fe71  1  0.272711  0.822313  0.543908  1
  Fe  Fe72  1  0.786893  0.011075  0.508153  1
  Fe  Fe73  1  0.020458  0.675948  0.535510  1
  Fe  Fe74  1  0.506186  0.487299  0.571245  1
  Fe  Fe75  1  0.784519  0.330780  0.565094  1
  Fe  Fe76  1  0.298831  0.519318  0.529310  1
  Fe  Fe77  1  0.099365  0.388799  0.508807  1
  Fe  Fe78  1  0.585069  0.200244  0.544539  1
  Fe  Fe79  1  0.065386  0.854155  0.501980  1
  Fe  Fe80  1  0.551146  0.665554  0.537706  1
  Fe  Fe81  1  0.185162  0.662588  0.574262  1
  Fe  Fe82  1  0.670122  0.474058  0.610006  1
  Fe  Fe83  1  0.844622  0.111724  0.606003  1
  Fe  Fe84  1  0.329428  0.923999  0.641927  1
  Fe  Fe85  1  0.958202  0.763753  0.600075  1
  Fe  Fe86  1  0.443900  0.573596  0.635954  1
  Fe  Fe87  1  0.838847  0.615681  0.627849  1
  Fe  Fe88  1  0.352203  0.804453  0.592290  1
  Fe  Fe89  1  0.162729  0.781558  0.623514  1
  Fe  Fe90  1  0.676861  0.970573  0.588047  1
  Fe  Fe91  1  0.244869  0.444291  0.615439  1
  Fe  Fe92  1  0.758314  0.633908  0.579472  1
  Fe  Fe93  1  0.992304  0.297838  0.606777  1
  Fe  Fe94  1  0.479121  0.108394  0.642663  1
  Fe  Fe95  1  0.756875  0.952871  0.636424  1
  Fe  Fe96  1  0.270760  0.141371  0.600611  1
  Fe  Fe97  1  0.071063  0.011264  0.580195  1
  Fe  Fe98  1  0.556939  0.822477  0.615924  1
  Fe  Fe99  1  0.036979  0.476722  0.573266  1
  Fe  Fe100  1  0.523056  0.287756  0.609163  1
  Fe  Fe101  1  0.156706  0.285040  0.645518  1
  Fe  Fe102  1  0.641952  0.093379  0.681509  1
  Fe  Fe103  1  0.815033  0.735790  0.677831  1
  Fe  Fe104  1  0.293315  0.561743  0.714084  1
  Fe  Fe105  1  0.930575  0.385508  0.671258  1
  Fe  Fe106  1  0.414248  0.199040  0.707246  1
  Fe  Fe107  1  0.813154  0.237820  0.699141  1
  Fe  Fe108  1  0.325700  0.424182  0.663737  1
  Fe  Fe109  1  0.136023  0.404454  0.695903  1
  Fe  Fe110  1  0.649545  0.591937  0.659383  1
  Fe  Fe111  1  0.218658  0.067000  0.688912  1
  Fe  Fe112  1  0.731325  0.255610  0.650873  1
  Fe  Fe113  1  0.966496  0.918860  0.678441  1
  Fe  Fe114  1  0.436146  0.747213  0.713757  1
  Fe  Fe115  1  0.724048  0.587430  0.709240  1
  Fe  Fe116  1  0.242437  0.766651  0.672301  1
  Fe  Fe117  1  0.041589  0.632722  0.651160  1
  Fe  Fe118  1  0.531099  0.444257  0.687351  1
  Fe  Fe119  1  0.009445  0.099036  0.644626  1
  Fe  Fe120  1  0.496125  0.910375  0.679669  1
  C  C121  1  0.158738  0.000423  0.330439  1
  C  C122  1  0.673089  0.193669  0.295124  1
  C  C123  1  0.281801  0.529953  0.328783  1
  C  C124  1  0.792352  0.718521  0.293874  1
  C  C125  1  0.945311  0.889797  0.351678  1
  C  C126  1  0.458042  0.080565  0.316787  1
  C  C127  1  0.065912  0.419829  0.349893  1
  C  C128  1  0.578512  0.608497  0.314774  1
  C  C129  1  0.131432  0.622359  0.401830  1
  C  C130  1  0.645213  0.811223  0.366124  1
  C  C131  1  0.252245  0.152181  0.400278  1
  C  C132  1  0.765799  0.340996  0.364884  1
  C  C133  1  0.918463  0.510697  0.422960  1
  C  C134  1  0.432186  0.699853  0.387334  1
  C  C135  1  0.039414  0.040170  0.421425  1
  C  C136  1  0.552839  0.229983  0.386009  1
  C  C137  1  0.103259  0.244702  0.473252  1
  C  C138  1  0.617453  0.433635  0.437597  1
  C  C139  1  0.224117  0.774316  0.471711  1
  C  C140  1  0.738210  0.962923  0.436056  1
  C  C141  1  0.890142  0.133256  0.494368  1
  C  C142  1  0.404159  0.322035  0.458701  1
  C  C143  1  0.010894  0.662845  0.492844  1
  C  C144  1  0.525072  0.851627  0.457144  1
  C  C145  1  0.074881  0.867297  0.544666  1
  C  C146  1  0.589059  0.056079  0.508966  1
  C  C147  1  0.195794  0.396889  0.543109  1
  C  C148  1  0.709811  0.585668  0.507442  1
  C  C149  1  0.861742  0.756001  0.565755  1
  C  C150  1  0.375835  0.944608  0.530099  1
  C  C151  1  0.982500  0.285289  0.564213  1
  C  C152  1  0.496693  0.474222  0.528558  1
  C  C153  1  0.047114  0.488941  0.615801  1
  C  C154  1  0.560538  0.678754  0.580385  1
  C  C155  1  0.167767  0.019071  0.614476  1
  C  C156  1  0.681490  0.208227  0.578850  1
  C  C157  1  0.834154  0.377928  0.636926  1
  C  C158  1  0.347708  0.566743  0.601532  1
  C  C159  1  0.954740  0.907701  0.635686  1
  C  C160  1  0.468521  0.096565  0.599980  1
  C  C161  1  0.021441  0.110427  0.687036  1
  C  C162  1  0.534040  0.299095  0.651917  1
  C  C163  1  0.141910  0.638359  0.685023  1
  C  C164  1  0.654642  0.829127  0.650132  1
  C  C165  1  0.807601  0.000403  0.707936  1
  C  C166  1  0.318151  0.188971  0.673027  1
  C  C167  1  0.926863  0.525255  0.706686  1
  C  C168  1  0.441215  0.718501  0.671371  1
