# generated using pymatgen
data_Fe7C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.04659590
_cell_length_b   11.61746064
_cell_length_c   46.32119399
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.51801578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe7C3
_chemical_formula_sum   'Fe420 C180'
_cell_volume   10738.4276646
_cell_formula_units_Z   60
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  0.131473  0.589763  0.354082  1
  Fe  Fe2  1  0.496918  0.692474  0.293374  1
  Fe  Fe3  1  0.814318  0.641677  0.323543  1
  Fe  Fe4  1  0.027838  0.771446  0.307108  1
  Fe  Fe5  1  0.346216  0.717480  0.337232  1
  Fe  Fe6  1  0.708004  0.818879  0.276226  1
  Fe  Fe7  1  0.980040  0.242470  0.324253  1
  Fe  Fe8  1  0.298432  0.187804  0.354242  1
  Fe  Fe9  1  0.660438  0.287755  0.293422  1
  Fe  Fe10  1  0.840729  0.098834  0.348584  1
  Fe  Fe11  1  0.205857  0.199666  0.288201  1
  Fe  Fe12  1  0.521880  0.150580  0.318314  1
  Fe  Fe13  1  0.945101  0.711780  0.277204  1
  Fe  Fe14  1  0.257331  0.668148  0.308787  1
  Fe  Fe15  1  0.576199  0.614361  0.337819  1
  Fe  Fe16  1  0.913258  0.730886  0.332108  1
  Fe  Fe17  1  0.230134  0.675657  0.362564  1
  Fe  Fe18  1  0.595100  0.782879  0.302435  1
  Fe  Fe19  1  0.096341  0.283659  0.299068  1
  Fe  Fe20  1  0.414267  0.235465  0.328961  1
  Fe  Fe21  1  0.732005  0.183894  0.358497  1
  Fe  Fe22  1  0.078699  0.120439  0.334674  1
  Fe  Fe23  1  0.439176  0.214439  0.277551  1
  Fe  Fe24  1  0.761449  0.170903  0.306180  1
  Fe  Fe25  1  0.928868  0.912784  0.296055  1
  Fe  Fe26  1  0.247795  0.860567  0.326689  1
  Fe  Fe27  1  0.566682  0.808302  0.357390  1
  Fe  Fe28  1  0.926929  0.541990  0.313251  1
  Fe  Fe29  1  0.240937  0.485832  0.340634  1
  Fe  Fe30  1  0.594606  0.589184  0.278724  1
  Fe  Fe31  1  0.105304  0.089421  0.278872  1
  Fe  Fe32  1  0.424297  0.037323  0.308931  1
  Fe  Fe33  1  0.741776  0.988091  0.338947  1
  Fe  Fe34  1  0.066503  0.311077  0.356422  1
  Fe  Fe35  1  0.431116  0.416302  0.295488  1
  Fe  Fe36  1  0.748836  0.364449  0.325998  1
  Fe  Fe37  1  0.929235  0.109374  0.298486  1
  Fe  Fe38  1  0.247058  0.055159  0.329201  1
  Fe  Fe39  1  0.564671  0.004454  0.360018  1
  Fe  Fe40  1  0.943382  0.393090  0.277078  1
  Fe  Fe41  1  0.258867  0.345302  0.307107  1
  Fe  Fe42  1  0.576242  0.291690  0.337245  1
  Fe  Fe43  1  0.108005  0.895502  0.273933  1
  Fe  Fe44  1  0.425951  0.843707  0.306369  1
  Fe  Fe45  1  0.744217  0.794349  0.335722  1
  Fe  Fe46  1  0.099584  0.609455  0.295759  1
  Fe  Fe47  1  0.413896  0.558498  0.329080  1
  Fe  Fe48  1  0.732077  0.507510  0.358610  1
  Fe  Fe49  1  0.149047  0.750366  0.318755  1
  Fe  Fe50  1  0.467977  0.699253  0.348271  1
  Fe  Fe51  1  0.826741  0.795037  0.287010  1
  Fe  Fe52  1  0.010256  0.610502  0.343233  1
  Fe  Fe53  1  0.370464  0.710339  0.281039  1
  Fe  Fe54  1  0.690836  0.660696  0.311677  1
  Fe  Fe55  1  0.960592  0.077687  0.360264  1
  Fe  Fe56  1  0.326704  0.182700  0.299772  1
  Fe  Fe57  1  0.643950  0.130216  0.329706  1
  Fe  Fe58  1  0.858623  0.263286  0.312431  1
  Fe  Fe59  1  0.176199  0.206981  0.342696  1
  Fe  Fe60  1  0.541911  0.307628  0.282549  1
  Fe  Fe61  1  0.848235  0.903657  0.340734  1
  Fe  Fe62  1  0.213273  0.002690  0.281720  1
  Fe  Fe63  1  0.529700  0.953180  0.311411  1
  Fe  Fe64  1  0.960370  0.396935  0.354312  1
  Fe  Fe65  1  0.324839  0.499554  0.293406  1
  Fe  Fe66  1  0.642742  0.449399  0.323395  1
  Fe  Fe67  1  0.029328  0.965083  0.313640  1
  Fe  Fe68  1  0.347123  0.913330  0.344024  1
  Fe  Fe69  1  0.709416  0.023353  0.283634  1
  Fe  Fe70  1  0.142820  0.434252  0.323474  1
  Fe  Fe71  1  0.460541  0.382642  0.353587  1
  Fe  Fe72  1  0.825925  0.487046  0.292416  1
  Fe  Fe73  1  0.141793  0.946657  0.324554  1
  Fe  Fe74  1  0.460247  0.895174  0.354835  1
  Fe  Fe75  1  0.823777  0.999816  0.294283  1
  Fe  Fe76  1  0.030920  0.451546  0.312537  1
  Fe  Fe77  1  0.347289  0.400572  0.343076  1
  Fe  Fe78  1  0.713679  0.489023  0.282128  1
  Fe  Fe79  1  0.960009  0.886233  0.352469  1
  Fe  Fe80  1  0.324711  0.983410  0.291719  1
  Fe  Fe81  1  0.642741  0.935328  0.322542  1
  Fe  Fe82  1  0.847021  0.417150  0.343218  1
  Fe  Fe83  1  0.208396  0.514075  0.282789  1
  Fe  Fe84  1  0.529129  0.468217  0.312631  1
  Fe  Fe85  1  0.085177  0.431872  0.444675  1
  Fe  Fe86  1  0.449928  0.537047  0.384208  1
  Fe  Fe87  1  0.766962  0.484426  0.414493  1
  Fe  Fe88  1  0.981459  0.616877  0.396901  1
  Fe  Fe89  1  0.299409  0.563637  0.427277  1
  Fe  Fe90  1  0.664532  0.666833  0.366996  1
  Fe  Fe91  1  0.933100  0.085496  0.415271  1
  Fe  Fe92  1  0.251629  0.032499  0.445450  1
  Fe  Fe93  1  0.616417  0.136746  0.384607  1
  Fe  Fe94  1  0.792403  0.941142  0.439574  1
  Fe  Fe95  1  0.157946  0.044924  0.378983  1
  Fe  Fe96  1  0.475281  0.992924  0.409270  1
  Fe  Fe97  1  0.893483  0.564307  0.368402  1
  Fe  Fe98  1  0.211594  0.510979  0.398259  1
  Fe  Fe99  1  0.529587  0.458694  0.428582  1
  Fe  Fe100  1  0.865548  0.572682  0.423016  1
  Fe  Fe101  1  0.183308  0.519783  0.453230  1
  Fe  Fe102  1  0.548003  0.624082  0.392730  1
  Fe  Fe103  1  0.049899  0.130216  0.389346  1
  Fe  Fe104  1  0.367545  0.078182  0.419417  1
  Fe  Fe105  1  0.685325  0.026211  0.449674  1
  Fe  Fe106  1  0.031010  0.965673  0.425062  1
  Fe  Fe107  1  0.395762  0.069277  0.364265  1
  Fe  Fe108  1  0.713370  0.017780  0.394564  1
  Fe  Fe109  1  0.882911  0.757588  0.387631  1
  Fe  Fe110  1  0.201806  0.704526  0.418101  1
  Fe  Fe111  1  0.519408  0.652380  0.448269  1
  Fe  Fe112  1  0.876424  0.383308  0.400991  1
  Fe  Fe113  1  0.194616  0.330522  0.431327  1
  Fe  Fe114  1  0.559526  0.434277  0.370741  1
  Fe  Fe115  1  0.059140  0.938892  0.370169  1
  Fe  Fe116  1  0.377582  0.885393  0.400164  1
  Fe  Fe117  1  0.695209  0.832520  0.430382  1
  Fe  Fe118  1  0.019817  0.153900  0.447264  1
  Fe  Fe119  1  0.384340  0.259065  0.386513  1
  Fe  Fe120  1  0.702109  0.206666  0.416646  1
  Fe  Fe121  1  0.881327  0.953452  0.390624  1
  Fe  Fe122  1  0.200169  0.900138  0.421144  1
  Fe  Fe123  1  0.517909  0.847887  0.451320  1
  Fe  Fe124  1  0.894229  0.240606  0.367723  1
  Fe  Fe125  1  0.212011  0.187205  0.397880  1
  Fe  Fe126  1  0.529648  0.135056  0.428105  1
  Fe  Fe127  1  0.060905  0.741960  0.367534  1
  Fe  Fe128  1  0.379016  0.689224  0.397271  1
  Fe  Fe129  1  0.696672  0.637262  0.427191  1
  Fe  Fe130  1  0.049108  0.453763  0.389832  1
  Fe  Fe131  1  0.367178  0.401412  0.420084  1
  Fe  Fe132  1  0.685065  0.349711  0.450076  1
  Fe  Fe133  1  0.103609  0.596094  0.408657  1
  Fe  Fe134  1  0.421547  0.543887  0.438881  1
  Fe  Fe135  1  0.786162  0.649575  0.377801  1
  Fe  Fe136  1  0.963023  0.451934  0.433304  1
  Fe  Fe137  1  0.327589  0.557155  0.372656  1
  Fe  Fe138  1  0.645058  0.505340  0.402722  1
  Fe  Fe139  1  0.914980  0.920810  0.451494  1
  Fe  Fe140  1  0.279549  0.024935  0.390508  1
  Fe  Fe141  1  0.597726  0.972871  0.420933  1
  Fe  Fe142  1  0.811084  0.105258  0.403164  1
  Fe  Fe143  1  0.129342  0.052657  0.434001  1
  Fe  Fe144  1  0.493743  0.156450  0.372886  1
  Fe  Fe145  1  0.801332  0.746351  0.432860  1
  Fe  Fe146  1  0.166320  0.850671  0.372315  1
  Fe  Fe147  1  0.483976  0.798504  0.402563  1
  Fe  Fe148  1  0.913304  0.240629  0.444800  1
  Fe  Fe149  1  0.277914  0.344667  0.384125  1
  Fe  Fe150  1  0.595663  0.292332  0.414477  1
  Fe  Fe151  1  0.982204  0.810661  0.405022  1
  Fe  Fe152  1  0.300184  0.757673  0.435157  1
  Fe  Fe153  1  0.665062  0.862388  0.374349  1
  Fe  Fe154  1  0.096210  0.277861  0.413967  1
  Fe  Fe155  1  0.413943  0.225539  0.444218  1
  Fe  Fe156  1  0.777981  0.331426  0.383588  1
  Fe  Fe157  1  0.095248  0.791559  0.415666  1
  Fe  Fe158  1  0.413128  0.738773  0.445855  1
  Fe  Fe159  1  0.777769  0.844694  0.384953  1
  Fe  Fe160  1  0.983025  0.296395  0.403259  1
  Fe  Fe161  1  0.301087  0.244055  0.433389  1
  Fe  Fe162  1  0.665548  0.348144  0.372686  1
  Fe  Fe163  1  0.914107  0.727772  0.443565  1
  Fe  Fe164  1  0.278692  0.832036  0.382817  1
  Fe  Fe165  1  0.596824  0.779824  0.413110  1
  Fe  Fe166  1  0.800067  0.259302  0.434112  1
  Fe  Fe167  1  0.165243  0.362668  0.373523  1
  Fe  Fe168  1  0.483091  0.310789  0.403801  1
  Fe  Fe169  1  0.038355  0.274326  0.535651  1
  Fe  Fe170  1  0.402911  0.379490  0.474941  1
  Fe  Fe171  1  0.720581  0.326698  0.505473  1
  Fe  Fe172  1  0.934754  0.458980  0.487742  1
  Fe  Fe173  1  0.252469  0.406313  0.518074  1
  Fe  Fe174  1  0.617225  0.511451  0.457509  1
  Fe  Fe175  1  0.886878  0.927516  0.506184  1
  Fe  Fe176  1  0.204703  0.875125  0.536532  1
  Fe  Fe177  1  0.569430  0.980067  0.475763  1
  Fe  Fe178  1  0.746297  0.783136  0.530715  1
  Fe  Fe179  1  0.110533  0.888419  0.470140  1
  Fe  Fe180  1  0.428388  0.836133  0.500357  1
  Fe  Fe181  1  0.846970  0.406283  0.459122  1
  Fe  Fe182  1  0.164819  0.353374  0.489374  1
  Fe  Fe183  1  0.482656  0.301083  0.519581  1
  Fe  Fe184  1  0.818750  0.414898  0.513921  1
  Fe  Fe185  1  0.136438  0.362072  0.544282  1
  Fe  Fe186  1  0.501151  0.467526  0.483492  1
  Fe  Fe187  1  0.002742  0.973586  0.480225  1
  Fe  Fe188  1  0.320579  0.921295  0.510432  1
  Fe  Fe189  1  0.638428  0.868386  0.540684  1
  Fe  Fe190  1  0.984247  0.807143  0.516315  1
  Fe  Fe191  1  0.348960  0.912597  0.455524  1
  Fe  Fe192  1  0.666648  0.859772  0.485885  1
  Fe  Fe193  1  0.836985  0.600155  0.478363  1
  Fe  Fe194  1  0.154908  0.547686  0.508698  1
  Fe  Fe195  1  0.472588  0.495216  0.538955  1
  Fe  Fe196  1  0.830019  0.225733  0.492010  1
  Fe  Fe197  1  0.147819  0.173017  0.522308  1
  Fe  Fe198  1  0.512551  0.278044  0.461597  1
  Fe  Fe199  1  0.012810  0.779453  0.460852  1
  Fe  Fe200  1  0.330490  0.726983  0.491108  1
  Fe  Fe201  1  0.648413  0.674514  0.521443  1
  Fe  Fe202  1  0.972847  0.996625  0.538209  1
  Fe  Fe203  1  0.337579  0.101652  0.477498  1
  Fe  Fe204  1  0.655378  0.048936  0.507796  1
  Fe  Fe205  1  0.835465  0.795493  0.481569  1
  Fe  Fe206  1  0.153237  0.742861  0.511874  1
  Fe  Fe207  1  0.470902  0.690337  0.542164  1
  Fe  Fe208  1  0.847124  0.082760  0.458664  1
  Fe  Fe209  1  0.164941  0.029815  0.489131  1
  Fe  Fe210  1  0.482735  0.977499  0.519351  1
  Fe  Fe211  1  0.014496  0.584332  0.457642  1
  Fe  Fe212  1  0.332161  0.531808  0.487932  1
  Fe  Fe213  1  0.649933  0.479176  0.518237  1
  Fe  Fe214  1  0.002663  0.297170  0.480456  1
  Fe  Fe215  1  0.320457  0.244854  0.510675  1
  Fe  Fe216  1  0.638274  0.191909  0.541142  1
  Fe  Fe217  1  0.057010  0.438536  0.499449  1
  Fe  Fe218  1  0.374865  0.386250  0.529666  1
  Fe  Fe219  1  0.739101  0.491533  0.469091  1
  Fe  Fe220  1  0.915968  0.294602  0.524043  1
  Fe  Fe221  1  0.280695  0.399545  0.463275  1
  Fe  Fe222  1  0.598520  0.347153  0.493622  1
  Fe  Fe223  1  0.868173  0.763218  0.542297  1
  Fe  Fe224  1  0.232928  0.868356  0.481732  1
  Fe  Fe225  1  0.550644  0.815689  0.512065  1
  Fe  Fe226  1  0.764816  0.947971  0.494333  1
  Fe  Fe227  1  0.082487  0.895179  0.524866  1
  Fe  Fe228  1  0.447043  1.000344  0.464155  1
  Fe  Fe229  1  0.754607  0.588503  0.523717  1
  Fe  Fe230  1  0.118898  0.693445  0.463183  1
  Fe  Fe231  1  0.436786  0.641249  0.493439  1
  Fe  Fe232  1  0.866563  0.082698  0.536011  1
  Fe  Fe233  1  0.231378  0.187626  0.475156  1
  Fe  Fe234  1  0.549068  0.134882  0.505420  1
  Fe  Fe235  1  0.935630  0.652220  0.495630  1
  Fe  Fe236  1  0.253338  0.599849  0.525844  1
  Fe  Fe237  1  0.617965  0.704979  0.465381  1
  Fe  Fe238  1  0.049061  0.120725  0.505236  1
  Fe  Fe239  1  0.366795  0.068431  0.535418  1
  Fe  Fe240  1  0.731521  0.173167  0.474659  1
  Fe  Fe241  1  0.048612  0.633420  0.506367  1
  Fe  Fe242  1  0.366500  0.581224  0.536624  1
  Fe  Fe243  1  0.730791  0.686166  0.476089  1
  Fe  Fe244  1  0.936330  0.139788  0.494386  1
  Fe  Fe245  1  0.254020  0.087043  0.524651  1
  Fe  Fe246  1  0.618835  0.191971  0.463796  1
  Fe  Fe247  1  0.867433  0.569690  0.534425  1
  Fe  Fe248  1  0.232060  0.674820  0.473962  1
  Fe  Fe249  1  0.549768  0.622449  0.504176  1
  Fe  Fe250  1  0.753877  0.101502  0.525147  1
  Fe  Fe251  1  0.118603  0.206238  0.464388  1
  Fe  Fe252  1  0.436337  0.153944  0.494570  1
  Fe  Fe253  1  0.991655  0.118220  0.626920  1
  Fe  Fe254  1  0.356056  0.222012  0.565806  1
  Fe  Fe255  1  0.674313  0.169411  0.596643  1
  Fe  Fe256  1  0.887672  0.301799  0.578874  1
  Fe  Fe257  1  0.205849  0.249734  0.609298  1
  Fe  Fe258  1  0.570418  0.353859  0.548312  1
  Fe  Fe259  1  0.840340  0.769329  0.597084  1
  Fe  Fe260  1  0.157809  0.717514  0.627150  1
  Fe  Fe261  1  0.522375  0.822735  0.566502  1
  Fe  Fe262  1  0.699236  0.625094  0.622006  1
  Fe  Fe263  1  0.063851  0.730782  0.560925  1
  Fe  Fe264  1  0.381789  0.678575  0.591149  1
  Fe  Fe265  1  0.800073  0.248458  0.550132  1
  Fe  Fe266  1  0.117853  0.196488  0.580389  1
  Fe  Fe267  1  0.435499  0.144453  0.610461  1
  Fe  Fe268  1  0.772028  0.256889  0.605242  1
  Fe  Fe269  1  0.089636  0.205392  0.635542  1
  Fe  Fe270  1  0.454388  0.308996  0.574744  1
  Fe  Fe271  1  0.955810  0.815976  0.571225  1
  Fe  Fe272  1  0.273804  0.763691  0.601547  1
  Fe  Fe273  1  0.591915  0.710362  0.631404  1
  Fe  Fe274  1  0.937394  0.650588  0.607076  1
  Fe  Fe275  1  0.302090  0.754886  0.546576  1
  Fe  Fe276  1  0.619849  0.701987  0.576790  1
  Fe  Fe277  1  0.790189  0.442149  0.569424  1
  Fe  Fe278  1  0.107816  0.389276  0.599642  1
  Fe  Fe279  1  0.426258  0.335777  0.629637  1
  Fe  Fe280  1  0.783288  0.068003  0.583160  1
  Fe  Fe281  1  0.101058  0.015604  0.613294  1
  Fe  Fe282  1  0.465581  0.120769  0.552542  1
  Fe  Fe283  1  0.965990  0.622289  0.551537  1
  Fe  Fe284  1  0.283592  0.570144  0.581705  1
  Fe  Fe285  1  0.602487  0.517081  0.612175  1
  Fe  Fe286  1  0.925872  0.840392  0.629066  1
  Fe  Fe287  1  0.290782  0.944147  0.568479  1
  Fe  Fe288  1  0.608974  0.891361  0.598815  1
  Fe  Fe289  1  0.788726  0.637407  0.572616  1
  Fe  Fe290  1  0.106382  0.585445  0.602535  1
  Fe  Fe291  1  0.424492  0.532709  0.632272  1
  Fe  Fe292  1  0.800332  0.924959  0.549730  1
  Fe  Fe293  1  0.118220  0.873257  0.579722  1
  Fe  Fe294  1  0.436289  0.820906  0.609975  1
  Fe  Fe295  1  0.967489  0.426782  0.548486  1
  Fe  Fe296  1  0.285229  0.374531  0.578663  1
  Fe  Fe297  1  0.604071  0.321217  0.609183  1
  Fe  Fe298  1  0.955750  0.139613  0.571701  1
  Fe  Fe299  1  0.273387  0.087464  0.601927  1
  Fe  Fe300  1  0.591169  0.034063  0.632084  1
  Fe  Fe301  1  0.010117  0.281745  0.590536  1
  Fe  Fe302  1  0.327452  0.229745  0.620823  1
  Fe  Fe303  1  0.692995  0.333527  0.560233  1
  Fe  Fe304  1  0.868981  0.137923  0.615199  1
  Fe  Fe305  1  0.233769  0.242170  0.554356  1
  Fe  Fe306  1  0.552298  0.189173  0.584535  1
  Fe  Fe307  1  0.820865  0.607836  0.632810  1
  Fe  Fe308  1  0.185989  0.711032  0.572530  1
  Fe  Fe309  1  0.503938  0.657792  0.602905  1
  Fe  Fe310  1  0.718436  0.790244  0.585313  1
  Fe  Fe311  1  0.035470  0.737622  0.615598  1
  Fe  Fe312  1  0.400221  0.842797  0.555131  1
  Fe  Fe313  1  0.707629  0.429975  0.614854  1
  Fe  Fe314  1  0.072270  0.535896  0.553952  1
  Fe  Fe315  1  0.390150  0.483110  0.584140  1
  Fe  Fe316  1  0.819850  0.926526  0.627120  1
  Fe  Fe317  1  0.184310  0.030615  0.566417  1
  Fe  Fe318  1  0.502373  0.978274  0.596547  1
  Fe  Fe319  1  0.888574  0.494845  0.586696  1
  Fe  Fe320  1  0.206706  0.442633  0.616989  1
  Fe  Fe321  1  0.571291  0.546897  0.556241  1
  Fe  Fe322  1  0.002307  0.963880  0.596005  1
  Fe  Fe323  1  0.320155  0.912001  0.626283  1
  Fe  Fe324  1  0.685331  0.015367  0.565694  1
  Fe  Fe325  1  0.001422  0.476165  0.597244  1
  Fe  Fe326  1  0.319077  0.423998  0.627491  1
  Fe  Fe327  1  0.684065  0.528318  0.566947  1
  Fe  Fe328  1  0.889735  0.982337  0.585329  1
  Fe  Fe329  1  0.207483  0.930002  0.615681  1
  Fe  Fe330  1  0.572094  0.034041  0.555006  1
  Fe  Fe331  1  0.820336  0.412281  0.625457  1
  Fe  Fe332  1  0.185214  0.516996  0.564649  1
  Fe  Fe333  1  0.503194  0.464008  0.594784  1
  Fe  Fe334  1  0.707417  0.943243  0.616219  1
  Fe  Fe335  1  0.071455  0.049130  0.555588  1
  Fe  Fe336  1  0.389188  0.996808  0.585840  1
  Fe  Fe337  1  0.943487  0.967041  0.717257  1
  Fe  Fe338  1  0.309199  0.067688  0.657110  1
  Fe  Fe339  1  0.626774  0.011383  0.687375  1
  Fe  Fe340  1  0.841448  0.144454  0.670101  1
  Fe  Fe341  1  0.158693  0.091969  0.700035  1
  Fe  Fe342  1  0.524806  0.196983  0.639543  1
  Fe  Fe343  1  0.794561  0.613973  0.688129  1
  Fe  Fe344  1  0.114934  0.564330  0.718767  1
  Fe  Fe345  1  0.475141  0.664167  0.656573  1
  Fe  Fe346  1  0.658656  0.479632  0.712796  1
  Fe  Fe347  1  0.017421  0.575416  0.651535  1
  Fe  Fe348  1  0.336351  0.524303  0.681052  1
  Fe  Fe349  1  0.753393  0.090775  0.641309  1
  Fe  Fe350  1  0.071131  0.039204  0.670845  1
  Fe  Fe351  1  0.389057  0.991010  0.700738  1
  Fe  Fe352  1  0.723948  0.103766  0.693626  1
  Fe  Fe353  1  0.046222  0.060230  0.722255  1
  Fe  Fe354  1  0.406699  0.154230  0.665132  1
  Fe  Fe355  1  0.909199  0.660308  0.661988  1
  Fe  Fe356  1  0.228067  0.606522  0.691019  1
  Fe  Fe357  1  0.540296  0.562889  0.722602  1
  Fe  Fe358  1  0.890298  0.491790  0.697371  1
  Fe  Fe359  1  0.255264  0.599012  0.637242  1
  Fe  Fe360  1  0.572140  0.543783  0.667698  1
  Fe  Fe361  1  0.743622  0.286578  0.660859  1
  Fe  Fe362  1  0.061101  0.237347  0.690876  1
  Fe  Fe363  1  0.380094  0.185248  0.720934  1
  Fe  Fe364  1  0.736562  0.910220  0.673808  1
  Fe  Fe365  1  0.054282  0.858367  0.704319  1
  Fe  Fe366  1  0.418895  0.963592  0.643384  1
  Fe  Fe367  1  0.918715  0.466367  0.642416  1
  Fe  Fe368  1  0.237603  0.414102  0.673117  1
  Fe  Fe369  1  0.556530  0.361885  0.703751  1
  Fe  Fe370  1  0.890792  0.685485  0.721082  1
  Fe  Fe371  1  0.244461  0.788837  0.659172  1
  Fe  Fe372  1  0.558469  0.732679  0.686555  1
  Fe  Fe373  1  0.741180  0.480321  0.664084  1
  Fe  Fe374  1  0.059447  0.430962  0.693437  1
  Fe  Fe375  1  0.377393  0.379167  0.725873  1
  Fe  Fe376  1  0.753321  0.767159  0.641196  1
  Fe  Fe377  1  0.071501  0.716171  0.670726  1
  Fe  Fe378  1  0.385814  0.665214  0.704047  1
  Fe  Fe379  1  0.920727  0.270215  0.639788  1
  Fe  Fe380  1  0.238339  0.219510  0.670606  1
  Fe  Fe381  1  0.556163  0.165295  0.701320  1
  Fe  Fe382  1  0.909155  0.982979  0.662561  1
  Fe  Fe383  1  0.226531  0.929367  0.692699  1
  Fe  Fe384  1  0.542016  0.881579  0.722728  1
  Fe  Fe385  1  0.963518  0.124090  0.681493  1
  Fe  Fe386  1  0.279540  0.075003  0.711605  1
  Fe  Fe387  1  0.644669  0.175835  0.651222  1
  Fe  Fe388  1  0.824960  0.986914  0.706385  1
  Fe  Fe389  1  0.186966  0.086865  0.645564  1
  Fe  Fe390  1  0.505358  0.032200  0.675554  1
  Fe  Fe391  1  0.777393  0.455790  0.723581  1
  Fe  Fe392  1  0.139182  0.557189  0.662574  1
  Fe  Fe393  1  0.457560  0.503223  0.692698  1
  Fe  Fe394  1  0.671080  0.632992  0.676263  1
  Fe  Fe395  1  0.988480  0.582195  0.706432  1
  Fe  Fe396  1  0.353924  0.684906  0.645724  1
  Fe  Fe397  1  0.661621  0.274853  0.705524  1
  Fe  Fe398  1  0.025151  0.379495  0.644971  1
  Fe  Fe399  1  0.343604  0.328012  0.675252  1
  Fe  Fe400  1  0.771719  0.785647  0.717679  1
  Fe  Fe401  1  0.138109  0.874097  0.656730  1
  Fe  Fe402  1  0.454478  0.823123  0.687270  1
  Fe  Fe403  1  0.842656  0.339341  0.677265  1
  Fe  Fe404  1  0.160687  0.291259  0.708087  1
  Fe  Fe405  1  0.525388  0.388437  0.647337  1
  Fe  Fe406  1  0.956269  0.806452  0.687176  1
  Fe  Fe407  1  0.277001  0.760594  0.717018  1
  Fe  Fe408  1  0.638377  0.857519  0.656588  1
  Fe  Fe409  1  0.955698  0.321489  0.688395  1
  Fe  Fe410  1  0.272125  0.271979  0.718087  1
  Fe  Fe411  1  0.637163  0.371012  0.659072  1
  Fe  Fe412  1  0.842656  0.825270  0.676411  1
  Fe  Fe413  1  0.160558  0.775115  0.706400  1
  Fe  Fe414  1  0.525028  0.877734  0.645494  1
  Fe  Fe415  1  0.775982  0.251316  0.716173  1
  Fe  Fe416  1  0.138275  0.361339  0.655782  1
  Fe  Fe417  1  0.456070  0.309586  0.686167  1
  Fe  Fe418  1  0.659473  0.787623  0.707390  1
  Fe  Fe419  1  0.024857  0.892027  0.646219  1
  Fe  Fe420  1  0.342577  0.840417  0.676332  1
  C  C421  1  0.070027  0.473645  0.349777  1
  C  C422  1  0.433801  0.579267  0.288951  1
  C  C423  1  0.752592  0.526485  0.318467  1
  C  C424  1  0.076551  0.845253  0.336402  1
  C  C425  1  0.440896  0.945100  0.274748  1
  C  C426  1  0.757329  0.898017  0.304356  1
  C  C427  1  0.920278  0.378850  0.317084  1
  C  C428  1  0.237716  0.323018  0.347063  1
  C  C429  1  0.601980  0.426075  0.286555  1
  C  C430  1  0.913234  0.007333  0.329892  1
  C  C431  1  0.231045  0.953565  0.360690  1
  C  C432  1  0.594660  0.056643  0.300512  1
  C  C433  1  0.867431  0.638580  0.288952  1
  C  C434  1  0.180354  0.588817  0.318365  1
  C  C435  1  0.498967  0.537567  0.348551  1
  C  C436  1  0.013290  0.882708  0.276506  1
  C  C437  1  0.331340  0.828445  0.306603  1
  C  C438  1  0.649565  0.779107  0.336649  1
  C  C439  1  0.039419  0.384421  0.274650  1
  C  C440  1  0.355058  0.334750  0.305053  1
  C  C441  1  0.672367  0.282462  0.334608  1
  C  C442  1  0.160312  0.098728  0.312633  1
  C  C443  1  0.478386  0.047493  0.342940  1
  C  C444  1  0.841431  0.153145  0.283038  1
  C  C445  1  0.173246  0.360712  0.288073  1
  C  C446  1  0.491137  0.312470  0.317815  1
  C  C447  1  0.809472  0.260556  0.348030  1
  C  C448  1  0.023999  0.122520  0.300521  1
  C  C449  1  0.341869  0.069379  0.329882  1
  C  C450  1  0.659548  0.018391  0.360150  1
  C  C451  1  0.004399  0.616269  0.301839  1
  C  C452  1  0.317752  0.565891  0.331408  1
  C  C453  1  0.636003  0.515100  0.361462  1
  C  C454  1  0.830158  0.751842  0.353123  1
  C  C455  1  0.191346  0.852180  0.293378  1
  C  C456  1  0.512094  0.800813  0.323481  1
  C  C457  1  0.023434  0.316257  0.440353  1
  C  C458  1  0.387972  0.421712  0.380035  1
  C  C459  1  0.705035  0.369275  0.409913  1
  C  C460  1  0.030308  0.688079  0.426623  1
  C  C461  1  0.395206  0.792555  0.366215  1
  C  C462  1  0.713298  0.740866  0.396250  1
  C  C463  1  0.872794  0.220825  0.407726  1
  C  C464  1  0.191355  0.167960  0.437981  1
  C  C465  1  0.555636  0.271770  0.377338  1
  C  C466  1  0.866127  0.849818  0.421741  1
  C  C467  1  0.183895  0.796691  0.452160  1
  C  C468  1  0.548783  0.901683  0.391245  1
  C  C469  1  0.816118  0.487476  0.378914  1
  C  C470  1  0.134422  0.434276  0.409101  1
  C  C471  1  0.452391  0.382081  0.439431  1
  C  C472  1  0.965863  0.730420  0.366856  1
  C  C473  1  0.284116  0.675878  0.396918  1
  C  C474  1  0.601799  0.623643  0.427148  1
  C  C475  1  0.990419  0.228780  0.365404  1
  C  C476  1  0.308174  0.176960  0.395472  1
  C  C477  1  0.625824  0.125248  0.425840  1
  C  C478  1  0.114061  0.943854  0.404039  1
  C  C479  1  0.431695  0.891250  0.434265  1
  C  C480  1  0.795731  0.997089  0.373028  1
  C  C481  1  0.127035  0.206711  0.378339  1
  C  C482  1  0.444709  0.154816  0.408532  1
  C  C483  1  0.762432  0.103241  0.438902  1
  C  C484  1  0.976222  0.966817  0.390924  1
  C  C485  1  0.294995  0.913917  0.421144  1
  C  C486  1  0.612787  0.861370  0.451476  1
  C  C487  1  0.952913  0.464714  0.392131  1
  C  C488  1  0.270975  0.411630  0.422064  1
  C  C489  1  0.588903  0.359313  0.452410  1
  C  C490  1  0.782830  0.593664  0.444283  1
  C  C491  1  0.147703  0.698307  0.384007  1
  C  C492  1  0.465472  0.645961  0.414127  1
  C  C493  1  0.976241  0.159208  0.531592  1
  C  C494  1  0.341088  0.264038  0.470561  1
  C  C495  1  0.658678  0.211451  0.501020  1
  C  C496  1  0.983638  0.530199  0.517445  1
  C  C497  1  0.348183  0.635464  0.456920  1
  C  C498  1  0.665863  0.582972  0.487247  1
  C  C499  1  0.826720  0.063218  0.498786  1
  C  C500  1  0.144309  0.010632  0.529245  1
  C  C501  1  0.509157  0.115462  0.468214  1
  C  C502  1  0.819534  0.691697  0.512560  1
  C  C503  1  0.137214  0.639205  0.542887  1
  C  C504  1  0.501760  0.744470  0.482361  1
  C  C505  1  0.769704  0.329672  0.469884  1
  C  C506  1  0.087555  0.276632  0.500066  1
  C  C507  1  0.405382  0.224344  0.530260  1
  C  C508  1  0.919565  0.571238  0.457380  1
  C  C509  1  0.237296  0.518070  0.487605  1
  C  C510  1  0.555036  0.465803  0.517895  1
  C  C511  1  0.943316  0.072985  0.456444  1
  C  C512  1  0.261098  0.020661  0.486668  1
  C  C513  1  0.578909  0.967951  0.516980  1
  C  C514  1  0.066853  0.786267  0.494957  1
  C  C515  1  0.384638  0.734075  0.525173  1
  C  C516  1  0.749223  0.838720  0.464509  1
  C  C517  1  0.080015  0.050326  0.469546  1
  C  C518  1  0.397843  0.998037  0.499740  1
  C  C519  1  0.715694  0.944997  0.529922  1
  C  C520  1  0.930362  0.808866  0.481911  1
  C  C521  1  0.248102  0.756599  0.512201  1
  C  C522  1  0.565833  0.703431  0.542426  1
  C  C523  1  0.906489  0.306718  0.482826  1
  C  C524  1  0.224299  0.254009  0.513138  1
  C  C525  1  0.542082  0.201684  0.543363  1
  C  C526  1  0.736175  0.435949  0.535298  1
  C  C527  1  0.100760  0.540594  0.474633  1
  C  C528  1  0.418545  0.488402  0.504849  1
  C  C529  1  0.929762  0.002899  0.622469  1
  C  C530  1  0.294043  0.106709  0.561825  1
  C  C531  1  0.612603  0.053844  0.592080  1
  C  C532  1  0.936614  0.372986  0.608561  1
  C  C533  1  0.301503  0.477978  0.547647  1
  C  C534  1  0.619271  0.424851  0.578065  1
  C  C535  1  0.780363  0.905394  0.589893  1
  C  C536  1  0.097425  0.852957  0.619771  1
  C  C537  1  0.461964  0.958412  0.559453  1
  C  C538  1  0.772099  0.533803  0.603556  1
  C  C539  1  0.090192  0.482114  0.633591  1
  C  C540  1  0.455090  0.586590  0.573183  1
  C  C541  1  0.722965  0.171429  0.560904  1
  C  C542  1  0.040689  0.119853  0.591274  1
  C  C543  1  0.358363  0.067958  0.621467  1
  C  C544  1  0.872611  0.413299  0.548331  1
  C  C545  1  0.190403  0.360752  0.578662  1
  C  C546  1  0.509176  0.307852  0.608882  1
  C  C547  1  0.896495  0.915356  0.547396  1
  C  C548  1  0.214423  0.863039  0.577742  1
  C  C549  1  0.532485  0.809955  0.607676  1
  C  C550  1  0.019926  0.628709  0.585679  1
  C  C551  1  0.337694  0.576362  0.615799  1
  C  C552  1  0.702568  0.681005  0.555523  1
  C  C553  1  0.033007  0.892588  0.560375  1
  C  C554  1  0.350976  0.840393  0.590706  1
  C  C555  1  0.669280  0.787193  0.620892  1
  C  C556  1  0.883599  0.651026  0.572658  1
  C  C557  1  0.201282  0.598791  0.602889  1
  C  C558  1  0.519535  0.544250  0.632950  1
  C  C559  1  0.859574  0.149421  0.573966  1
  C  C560  1  0.177224  0.097709  0.604334  1
  C  C561  1  0.494979  0.045889  0.634402  1
  C  C562  1  0.689667  0.277580  0.626778  1
  C  C563  1  0.053703  0.383419  0.565542  1
  C  C564  1  0.371336  0.330815  0.595767  1
  C  C565  1  0.883418  0.848594  0.713251  1
  C  C566  1  0.247681  0.951651  0.652743  1
  C  C567  1  0.565120  0.895819  0.682723  1
  C  C568  1  0.890738  0.218027  0.699294  1
  C  C569  1  0.254353  0.321104  0.639116  1
  C  C570  1  0.572163  0.267336  0.669914  1
  C  C571  1  0.732806  0.748184  0.681339  1
  C  C572  1  0.051596  0.695403  0.710855  1
  C  C573  1  0.415371  0.801025  0.650030  1
  C  C574  1  0.728069  0.376652  0.695451  1
  C  C575  1  0.044501  0.329569  0.725058  1
  C  C576  1  0.408846  0.429416  0.663404  1
  C  C577  1  0.675926  0.014113  0.651776  1
  C  C578  1  0.994261  0.962200  0.681991  1
  C  C579  1  0.312152  0.913957  0.711733  1
  C  C580  1  0.825850  0.256278  0.639656  1
  C  C581  1  0.143529  0.205290  0.669924  1
  C  C582  1  0.461399  0.152150  0.699285  1
  C  C583  1  0.849395  0.759569  0.638344  1
  C  C584  1  0.167646  0.708778  0.668398  1
  C  C585  1  0.480999  0.658400  0.697967  1
  C  C586  1  0.973304  0.473856  0.676325  1
  C  C587  1  0.294052  0.422489  0.706428  1
  C  C588  1  0.655240  0.522828  0.646684  1
  C  C589  1  0.986431  0.737102  0.651255  1
  C  C590  1  0.305043  0.685852  0.681442  1
  C  C591  1  0.617966  0.636089  0.710854  1
  C  C592  1  0.835833  0.495562  0.663157  1
  C  C593  1  0.154058  0.446224  0.693203  1
  C  C594  1  0.472108  0.391961  0.723300  1
  C  C595  1  0.813031  0.992207  0.665198  1
  C  C596  1  0.130340  0.939919  0.694753  1
  C  C597  1  0.445979  0.890248  0.725156  1
  C  C598  1  0.643967  0.121525  0.716769  1
  C  C599  1  0.007012  0.227176  0.656866  1
  C  C600  1  0.325086  0.175941  0.687174  1
