# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.61138320
_cell_length_b   6.87837435
_cell_length_c   48.32111389
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   56.45551049
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe120 C48'
_cell_volume   2939.53030033
_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  0.187936  0.892087  0.292464  1
  Fe  Fe2  1  0.724841  0.043139  0.331539  1
  Fe  Fe3  1  0.853508  0.457606  0.282015  1
  Fe  Fe4  1  0.385738  0.623366  0.321517  1
  Fe  Fe5  1  0.993967  0.225837  0.317980  1
  Fe  Fe6  1  0.458555  0.071538  0.278676  1
  Fe  Fe7  1  0.856740  0.113341  0.287344  1
  Fe  Fe8  1  0.393832  0.260391  0.326135  1
  Fe  Fe9  1  0.178703  0.254824  0.287693  1
  Fe  Fe10  1  0.718195  0.404667  0.326862  1
  Fe  Fe11  1  0.296085  0.020046  0.325983  1
  Fe  Fe12  1  0.756047  0.860818  0.286773  1
  Fe  Fe13  1  0.022116  0.755548  0.308083  1
  Fe  Fe14  1  0.488920  0.621242  0.268787  1
  Fe  Fe15  1  0.815077  0.647769  0.327039  1
  Fe  Fe16  1  0.279282  0.495872  0.287863  1
  Fe  Fe17  1  0.118358  0.436597  0.334823  1
  Fe  Fe18  1  0.579333  0.288228  0.296480  1
  Fe  Fe19  1  0.088677  0.902794  0.344339  1
  Fe  Fe20  1  0.552407  0.751882  0.306132  1
  Fe  Fe21  1  0.263801  0.194453  0.370144  1
  Fe  Fe22  1  0.801475  0.347083  0.408681  1
  Fe  Fe23  1  0.924983  0.771749  0.359734  1
  Fe  Fe24  1  0.462072  0.926195  0.398447  1
  Fe  Fe25  1  0.070390  0.530555  0.394848  1
  Fe  Fe26  1  0.532238  0.379138  0.356334  1
  Fe  Fe27  1  0.931787  0.410234  0.364667  1
  Fe  Fe28  1  0.470852  0.562980  0.403214  1
  Fe  Fe29  1  0.254675  0.557340  0.364745  1
  Fe  Fe30  1  0.793608  0.709398  0.403904  1
  Fe  Fe31  1  0.371498  0.324592  0.402891  1
  Fe  Fe32  1  0.833358  0.170076  0.364079  1
  Fe  Fe33  1  0.099278  0.064029  0.385504  1
  Fe  Fe34  1  0.561868  0.913485  0.346676  1
  Fe  Fe35  1  0.892795  0.949049  0.404160  1
  Fe  Fe36  1  0.354254  0.795980  0.365548  1
  Fe  Fe37  1  0.193209  0.741790  0.412094  1
  Fe  Fe38  1  0.655536  0.590101  0.373751  1
  Fe  Fe39  1  0.164655  0.207888  0.421580  1
  Fe  Fe40  1  0.626522  0.056196  0.383051  1
  Fe  Fe41  1  0.339177  0.499842  0.447192  1
  Fe  Fe42  1  0.877062  0.652206  0.485808  1
  Fe  Fe43  1  0.000558  0.077320  0.436906  1
  Fe  Fe44  1  0.538162  0.230315  0.475521  1
  Fe  Fe45  1  0.146258  0.835311  0.471996  1
  Fe  Fe46  1  0.608448  0.682911  0.433444  1
  Fe  Fe47  1  0.008072  0.715782  0.441779  1
  Fe  Fe48  1  0.546111  0.868201  0.480361  1
  Fe  Fe49  1  0.331366  0.861700  0.442365  1
  Fe  Fe50  1  0.869251  0.014220  0.480947  1
  Fe  Fe51  1  0.447169  0.628509  0.480025  1
  Fe  Fe52  1  0.909287  0.475801  0.441430  1
  Fe  Fe53  1  0.175106  0.369407  0.462535  1
  Fe  Fe54  1  0.637359  0.217104  0.423965  1
  Fe  Fe55  1  0.968211  0.253851  0.481307  1
  Fe  Fe56  1  0.430070  0.101642  0.442708  1
  Fe  Fe57  1  0.269011  0.047045  0.489281  1
  Fe  Fe58  1  0.731178  0.894688  0.450745  1
  Fe  Fe59  1  0.240206  0.512998  0.498722  1
  Fe  Fe60  1  0.702386  0.360526  0.460164  1
  Fe  Fe61  1  0.414936  0.804526  0.524352  1
  Fe  Fe62  1  0.952540  0.957521  0.562966  1
  Fe  Fe63  1  0.076036  0.382635  0.514065  1
  Fe  Fe64  1  0.613921  0.534999  0.552680  1
  Fe  Fe65  1  0.221919  0.140153  0.549127  1
  Fe  Fe66  1  0.684087  0.987797  0.510592  1
  Fe  Fe67  1  0.083847  0.020621  0.518926  1
  Fe  Fe68  1  0.621732  0.173142  0.557508  1
  Fe  Fe69  1  0.406986  0.166641  0.519512  1
  Fe  Fe70  1  0.945026  0.319060  0.558093  1
  Fe  Fe71  1  0.523028  0.933200  0.557165  1
  Fe  Fe72  1  0.984887  0.780990  0.518566  1
  Fe  Fe73  1  0.250712  0.674315  0.539709  1
  Fe  Fe74  1  0.712892  0.521843  0.501151  1
  Fe  Fe75  1  0.043811  0.559040  0.558442  1
  Fe  Fe76  1  0.505929  0.406332  0.519848  1
  Fe  Fe77  1  0.344650  0.351931  0.566428  1
  Fe  Fe78  1  0.806840  0.199530  0.527877  1
  Fe  Fe79  1  0.315739  0.817737  0.575908  1
  Fe  Fe80  1  0.777992  0.665434  0.537338  1
  Fe  Fe81  1  0.491025  0.108646  0.601425  1
  Fe  Fe82  1  0.028115  0.263093  0.640139  1
  Fe  Fe83  1  0.151623  0.687758  0.591192  1
  Fe  Fe84  1  0.689296  0.840388  0.629729  1
  Fe  Fe85  1  0.297561  0.444740  0.626122  1
  Fe  Fe86  1  0.759889  0.293051  0.587778  1
  Fe  Fe87  1  0.159490  0.325443  0.595968  1
  Fe  Fe88  1  0.698423  0.477502  0.635128  1
  Fe  Fe89  1  0.482246  0.471861  0.596658  1
  Fe  Fe90  1  0.021311  0.624608  0.635206  1
  Fe  Fe91  1  0.598843  0.238862  0.634325  1
  Fe  Fe92  1  0.060302  0.085792  0.595712  1
  Fe  Fe93  1  0.326575  0.978645  0.616822  1
  Fe  Fe94  1  0.788442  0.826953  0.578293  1
  Fe  Fe95  1  0.119739  0.864765  0.635794  1
  Fe  Fe96  1  0.581599  0.710249  0.596981  1
  Fe  Fe97  1  0.420859  0.655703  0.643538  1
  Fe  Fe98  1  0.882707  0.504286  0.605025  1
  Fe  Fe99  1  0.391229  0.121356  0.653197  1
  Fe  Fe100  1  0.853820  0.970812  0.614368  1
  Fe  Fe101  1  0.567359  0.411475  0.678356  1
  Fe  Fe102  1  0.099590  0.577235  0.717858  1
  Fe  Fe103  1  0.228256  0.991702  0.668333  1
  Fe  Fe104  1  0.765161  0.142754  0.707409  1
  Fe  Fe105  1  0.373765  0.746613  0.703393  1
  Fe  Fe106  1  0.834740  0.598244  0.665050  1
  Fe  Fe107  1  0.234903  0.630175  0.673010  1
  Fe  Fe108  1  0.774394  0.780017  0.712180  1
  Fe  Fe109  1  0.559265  0.774450  0.673738  1
  Fe  Fe110  1  0.096358  0.921500  0.712529  1
  Fe  Fe111  1  0.673816  0.538969  0.712010  1
  Fe  Fe112  1  0.138021  0.387072  0.672834  1
  Fe  Fe113  1  0.400690  0.282959  0.693741  1
  Fe  Fe114  1  0.864421  0.132048  0.655533  1
  Fe  Fe115  1  0.197050  0.174023  0.713100  1
  Fe  Fe116  1  0.657013  0.014795  0.673890  1
  Fe  Fe117  1  0.494543  0.963304  0.721196  1
  Fe  Fe118  1  0.959131  0.809004  0.681893  1
  Fe  Fe119  1  0.464177  0.413599  0.731086  1
  Fe  Fe120  1  0.930982  0.279293  0.691789  1
  C  C121  1  0.044422  0.858358  0.272515  1
  C  C122  1  0.582374  0.012747  0.310692  1
  C  C123  1  0.217644  0.591865  0.325525  1
  C  C124  1  0.679776  0.442661  0.287715  1
  C  C125  1  0.894266  0.069890  0.326498  1
  C  C126  1  0.357575  0.919895  0.288457  1
  C  C127  1  0.989901  0.498655  0.303437  1
  C  C128  1  0.529217  0.653991  0.341984  1
  C  C129  1  0.121293  0.162155  0.349573  1
  C  C130  1  0.659626  0.314139  0.387976  1
  C  C131  1  0.294180  0.895066  0.403166  1
  C  C132  1  0.755688  0.744485  0.364734  1
  C  C133  1  0.969981  0.376493  0.403833  1
  C  C134  1  0.431868  0.224995  0.365301  1
  C  C135  1  0.066790  0.805458  0.380340  1
  C  C136  1  0.604565  0.958534  0.419019  1
  C  C137  1  0.196977  0.467167  0.426564  1
  C  C138  1  0.735001  0.619254  0.465176  1
  C  C139  1  0.369682  0.200742  0.480317  1
  C  C140  1  0.831908  0.048244  0.441754  1
  C  C141  1  0.045554  0.681684  0.480968  1
  C  C142  1  0.507703  0.529351  0.442422  1
  C  C143  1  0.142459  0.110550  0.457553  1
  C  C144  1  0.680350  0.263054  0.496140  1
  C  C145  1  0.272747  0.771788  0.503733  1
  C  C146  1  0.810639  0.924291  0.542320  1
  C  C147  1  0.445395  0.505490  0.557451  1
  C  C148  1  0.907543  0.353157  0.518904  1
  C  C149  1  0.121190  0.986597  0.558119  1
  C  C150  1  0.583416  0.834100  0.519555  1
  C  C151  1  0.218097  0.415587  0.534696  1
  C  C152  1  0.756121  0.567674  0.573308  1
  C  C153  1  0.348532  0.076307  0.580854  1
  C  C154  1  0.886308  0.229383  0.619533  1
  C  C155  1  0.521230  0.809846  0.634572  1
  C  C156  1  0.983117  0.658348  0.596040  1
  C  C157  1  0.197410  0.290356  0.635139  1
  C  C158  1  0.658917  0.139775  0.596707  1
  C  C159  1  0.293472  0.720702  0.611897  1
  C  C160  1  0.831804  0.872687  0.650300  1
  C  C161  1  0.423881  0.380850  0.657889  1
  C  C162  1  0.963197  0.536186  0.696436  1
  C  C163  1  0.595522  0.114947  0.711416  1
  C  C164  1  0.058832  0.964951  0.673375  1
  C  C165  1  0.273322  0.592180  0.712158  1
  C  C166  1  0.735454  0.442976  0.674347  1
  C  C167  1  0.370724  0.022094  0.689181  1
  C  C168  1  0.908675  0.176483  0.727358  1
