# generated using pymatgen
data_Fe576C191
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.46951519
_cell_length_b   19.15798897
_cell_length_c   19.63999542
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe576C191
_chemical_formula_sum   'Fe576 C191'
_cell_volume   6949.39179108
_cell_formula_units_Z   1
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  0.232458  0.041370  0.249889  1
  Fe  Fe2  1  0.233005  0.041417  0.583258  1
  Fe  Fe3  1  0.233005  0.041417  0.916521  1
  Fe  Fe4  1  0.233227  0.291418  0.249889  1
  Fe  Fe5  1  0.233021  0.291480  0.583441  1
  Fe  Fe6  1  0.233021  0.291480  0.916338  1
  Fe  Fe7  1  0.232859  0.541424  0.249889  1
  Fe  Fe8  1  0.232950  0.541420  0.583157  1
  Fe  Fe9  1  0.232950  0.541420  0.916622  1
  Fe  Fe10  1  0.232789  0.791466  0.249889  1
  Fe  Fe11  1  0.232946  0.791405  0.583177  1
  Fe  Fe12  1  0.232946  0.791405  0.916602  1
  Fe  Fe13  1  0.482927  0.041325  0.249889  1
  Fe  Fe14  1  0.482964  0.041409  0.583195  1
  Fe  Fe15  1  0.482964  0.041409  0.916583  1
  Fe  Fe16  1  0.482951  0.291402  0.249889  1
  Fe  Fe17  1  0.482973  0.291418  0.583184  1
  Fe  Fe18  1  0.482973  0.291418  0.916595  1
  Fe  Fe19  1  0.482976  0.541431  0.249889  1
  Fe  Fe20  1  0.482974  0.541436  0.583179  1
  Fe  Fe21  1  0.482974  0.541436  0.916600  1
  Fe  Fe22  1  0.482974  0.791394  0.249889  1
  Fe  Fe23  1  0.482936  0.791416  0.583169  1
  Fe  Fe24  1  0.482936  0.791416  0.916610  1
  Fe  Fe25  1  0.733421  0.041279  0.249889  1
  Fe  Fe26  1  0.732935  0.041394  0.583224  1
  Fe  Fe27  1  0.732935  0.041394  0.916555  1
  Fe  Fe28  1  0.732949  0.291425  0.249889  1
  Fe  Fe29  1  0.732943  0.291428  0.583212  1
  Fe  Fe30  1  0.732943  0.291428  0.916567  1
  Fe  Fe31  1  0.733031  0.541434  0.249889  1
  Fe  Fe32  1  0.732940  0.541413  0.583185  1
  Fe  Fe33  1  0.732940  0.541413  0.916594  1
  Fe  Fe34  1  0.733111  0.791617  0.249889  1
  Fe  Fe35  1  0.732939  0.791340  0.583209  1
  Fe  Fe36  1  0.732939  0.791340  0.916570  1
  Fe  Fe37  1  0.982821  0.044471  0.249889  1
  Fe  Fe38  1  0.982930  0.041364  0.583339  1
  Fe  Fe39  1  0.982930  0.041364  0.916440  1
  Fe  Fe40  1  0.983802  0.289856  0.249889  1
  Fe  Fe41  1  0.982960  0.291431  0.583341  1
  Fe  Fe42  1  0.982960  0.291431  0.916438  1
  Fe  Fe43  1  0.983113  0.541241  0.249889  1
  Fe  Fe44  1  0.982943  0.541404  0.583214  1
  Fe  Fe45  1  0.982943  0.541404  0.916565  1
  Fe  Fe46  1  0.982931  0.791988  0.249889  1
  Fe  Fe47  1  0.982944  0.791369  0.583245  1
  Fe  Fe48  1  0.982944  0.791369  0.916534  1
  Fe  Fe49  1  0.142224  0.166559  0.082795  1
  Fe  Fe50  1  0.142224  0.166559  0.416984  1
  Fe  Fe51  1  0.142210  0.166398  0.749889  1
  Fe  Fe52  1  0.142241  0.416396  0.083222  1
  Fe  Fe53  1  0.142241  0.416396  0.416557  1
  Fe  Fe54  1  0.142210  0.416427  0.749889  1
  Fe  Fe55  1  0.142119  0.666465  0.083267  1
  Fe  Fe56  1  0.142119  0.666465  0.416512  1
  Fe  Fe57  1  0.142209  0.666375  0.749889  1
  Fe  Fe58  1  0.142066  0.916445  0.083270  1
  Fe  Fe59  1  0.142066  0.916445  0.416509  1
  Fe  Fe60  1  0.142209  0.916342  0.749889  1
  Fe  Fe61  1  0.392161  0.166391  0.083188  1
  Fe  Fe62  1  0.392161  0.166391  0.416591  1
  Fe  Fe63  1  0.392220  0.166421  0.749889  1
  Fe  Fe64  1  0.392208  0.416452  0.083284  1
  Fe  Fe65  1  0.392208  0.416452  0.416495  1
  Fe  Fe66  1  0.392225  0.416452  0.749889  1
  Fe  Fe67  1  0.392156  0.666444  0.083271  1
  Fe  Fe68  1  0.392156  0.666444  0.416508  1
  Fe  Fe69  1  0.392213  0.666416  0.749889  1
  Fe  Fe70  1  0.392150  0.916415  0.083263  1
  Fe  Fe71  1  0.392150  0.916415  0.416516  1
  Fe  Fe72  1  0.392216  0.916379  0.749889  1
  Fe  Fe73  1  0.642294  0.166373  0.083262  1
  Fe  Fe74  1  0.642294  0.166373  0.416517  1
  Fe  Fe75  1  0.642147  0.166444  0.749889  1
  Fe  Fe76  1  0.642200  0.416408  0.083244  1
  Fe  Fe77  1  0.642200  0.416408  0.416535  1
  Fe  Fe78  1  0.642164  0.416444  0.749889  1
  Fe  Fe79  1  0.642225  0.666414  0.083286  1
  Fe  Fe80  1  0.642225  0.666414  0.416493  1
  Fe  Fe81  1  0.642183  0.666411  0.749889  1
  Fe  Fe82  1  0.642242  0.916419  0.083317  1
  Fe  Fe83  1  0.642242  0.916419  0.416462  1
  Fe  Fe84  1  0.642169  0.916406  0.749889  1
  Fe  Fe85  1  0.892169  0.166479  0.082788  1
  Fe  Fe86  1  0.892169  0.166479  0.416991  1
  Fe  Fe87  1  0.892142  0.166419  0.749889  1
  Fe  Fe88  1  0.892241  0.416366  0.083231  1
  Fe  Fe89  1  0.892241  0.416366  0.416548  1
  Fe  Fe90  1  0.892158  0.416430  0.749889  1
  Fe  Fe91  1  0.892198  0.666413  0.083226  1
  Fe  Fe92  1  0.892198  0.666413  0.416553  1
  Fe  Fe93  1  0.892181  0.666381  0.749889  1
  Fe  Fe94  1  0.892113  0.916393  0.082909  1
  Fe  Fe95  1  0.892113  0.916393  0.416870  1
  Fe  Fe96  1  0.892165  0.916362  0.749889  1
  Fe  Fe97  1  0.107411  0.084175  0.249889  1
  Fe  Fe98  1  0.108002  0.083704  0.583350  1
  Fe  Fe99  1  0.108002  0.083704  0.916429  1
  Fe  Fe100  1  0.108246  0.333552  0.249889  1
  Fe  Fe101  1  0.107974  0.333751  0.583303  1
  Fe  Fe102  1  0.107974  0.333751  0.916475  1
  Fe  Fe103  1  0.107928  0.583632  0.249889  1
  Fe  Fe104  1  0.107953  0.583714  0.583192  1
  Fe  Fe105  1  0.107953  0.583714  0.916586  1
  Fe  Fe106  1  0.107669  0.833857  0.249889  1
  Fe  Fe107  1  0.107977  0.833696  0.583226  1
  Fe  Fe108  1  0.107977  0.833696  0.916552  1
  Fe  Fe109  1  0.357772  0.083792  0.249889  1
  Fe  Fe110  1  0.358032  0.083685  0.583237  1
  Fe  Fe111  1  0.358032  0.083685  0.916542  1
  Fe  Fe112  1  0.358027  0.333691  0.249889  1
  Fe  Fe113  1  0.357983  0.333720  0.583253  1
  Fe  Fe114  1  0.357983  0.333720  0.916526  1
  Fe  Fe115  1  0.357922  0.583801  0.249889  1
  Fe  Fe116  1  0.357946  0.583726  0.583158  1
  Fe  Fe117  1  0.357946  0.583726  0.916621  1
  Fe  Fe118  1  0.357687  0.833863  0.249889  1
  Fe  Fe119  1  0.357959  0.833707  0.583143  1
  Fe  Fe120  1  0.357959  0.833707  0.916636  1
  Fe  Fe121  1  0.608009  0.083824  0.249889  1
  Fe  Fe122  1  0.607951  0.083668  0.583197  1
  Fe  Fe123  1  0.607951  0.083668  0.916582  1
  Fe  Fe124  1  0.607986  0.333734  0.249889  1
  Fe  Fe125  1  0.607941  0.333688  0.583184  1
  Fe  Fe126  1  0.607941  0.333688  0.916595  1
  Fe  Fe127  1  0.608029  0.583802  0.249889  1
  Fe  Fe128  1  0.607934  0.583709  0.583168  1
  Fe  Fe129  1  0.607934  0.583709  0.916610  1
  Fe  Fe130  1  0.608121  0.833915  0.249889  1
  Fe  Fe131  1  0.607934  0.833671  0.583169  1
  Fe  Fe132  1  0.607934  0.833671  0.916610  1
  Fe  Fe133  1  0.858183  0.083919  0.249889  1
  Fe  Fe134  1  0.857920  0.083703  0.583364  1
  Fe  Fe135  1  0.857920  0.083703  0.916415  1
  Fe  Fe136  1  0.857864  0.333520  0.249889  1
  Fe  Fe137  1  0.857933  0.333748  0.583251  1
  Fe  Fe138  1  0.857933  0.333748  0.916528  1
  Fe  Fe139  1  0.858023  0.583600  0.249889  1
  Fe  Fe140  1  0.857941  0.583709  0.583194  1
  Fe  Fe141  1  0.857941  0.583709  0.916585  1
  Fe  Fe142  1  0.858315  0.833869  0.249889  1
  Fe  Fe143  1  0.857925  0.833681  0.583236  1
  Fe  Fe144  1  0.857925  0.833681  0.916543  1
  Fe  Fe145  1  0.017383  0.208781  0.082775  1
  Fe  Fe146  1  0.017383  0.208781  0.417004  1
  Fe  Fe147  1  0.017177  0.208736  0.749889  1
  Fe  Fe148  1  0.017165  0.458616  0.083336  1
  Fe  Fe149  1  0.017165  0.458616  0.416443  1
  Fe  Fe150  1  0.017196  0.458751  0.749889  1
  Fe  Fe151  1  0.017147  0.708664  0.083212  1
  Fe  Fe152  1  0.017147  0.708664  0.416566  1
  Fe  Fe153  1  0.017197  0.708704  0.749889  1
  Fe  Fe154  1  0.017128  0.958685  0.082593  1
  Fe  Fe155  1  0.017128  0.958685  0.417186  1
  Fe  Fe156  1  0.017188  0.958691  0.749889  1
  Fe  Fe157  1  0.267206  0.208641  0.083252  1
  Fe  Fe158  1  0.267206  0.208641  0.416527  1
  Fe  Fe159  1  0.267223  0.208737  0.749889  1
  Fe  Fe160  1  0.267178  0.458741  0.083229  1
  Fe  Fe161  1  0.267178  0.458741  0.416550  1
  Fe  Fe162  1  0.267227  0.458770  0.749889  1
  Fe  Fe163  1  0.267113  0.708755  0.083246  1
  Fe  Fe164  1  0.267113  0.708755  0.416533  1
  Fe  Fe165  1  0.267216  0.708701  0.749889  1
  Fe  Fe166  1  0.267112  0.958753  0.083156  1
  Fe  Fe167  1  0.267112  0.958753  0.416623  1
  Fe  Fe168  1  0.267222  0.958679  0.749889  1
  Fe  Fe169  1  0.517186  0.208716  0.083250  1
  Fe  Fe170  1  0.517186  0.208716  0.416529  1
  Fe  Fe171  1  0.517191  0.208697  0.749889  1
  Fe  Fe172  1  0.517180  0.458732  0.083258  1
  Fe  Fe173  1  0.517180  0.458732  0.416521  1
  Fe  Fe174  1  0.517201  0.458706  0.749889  1
  Fe  Fe175  1  0.517188  0.708783  0.083320  1
  Fe  Fe176  1  0.517188  0.708783  0.416459  1
  Fe  Fe177  1  0.517181  0.708693  0.749889  1
  Fe  Fe178  1  0.517160  0.958763  0.083335  1
  Fe  Fe179  1  0.517160  0.958763  0.416444  1
  Fe  Fe180  1  0.517179  0.958670  0.749889  1
  Fe  Fe181  1  0.767154  0.208730  0.083088  1
  Fe  Fe182  1  0.767154  0.208730  0.416691  1
  Fe  Fe183  1  0.767145  0.208694  0.749889  1
  Fe  Fe184  1  0.767190  0.458718  0.083246  1
  Fe  Fe185  1  0.767190  0.458718  0.416533  1
  Fe  Fe186  1  0.767174  0.458709  0.749889  1
  Fe  Fe187  1  0.767245  0.708728  0.083318  1
  Fe  Fe188  1  0.767245  0.708728  0.416461  1
  Fe  Fe189  1  0.767166  0.708679  0.749889  1
  Fe  Fe190  1  0.766903  0.958739  0.083526  1
  Fe  Fe191  1  0.766903  0.958739  0.416253  1
  Fe  Fe192  1  0.767130  0.958655  0.749889  1
  Fe  Fe193  1  0.193400  0.168980  0.190575  1
  Fe  Fe194  1  0.193517  0.169008  0.524282  1
  Fe  Fe195  1  0.193541  0.169061  0.857418  1
  Fe  Fe196  1  0.193585  0.419030  0.190780  1
  Fe  Fe197  1  0.193573  0.419079  0.524134  1
  Fe  Fe198  1  0.193506  0.419087  0.857445  1
  Fe  Fe199  1  0.193374  0.669118  0.190856  1
  Fe  Fe200  1  0.193505  0.669087  0.524072  1
  Fe  Fe201  1  0.193487  0.669012  0.857461  1
  Fe  Fe202  1  0.193022  0.919130  0.190948  1
  Fe  Fe203  1  0.193564  0.919131  0.524088  1
  Fe  Fe204  1  0.193465  0.918950  0.857448  1
  Fe  Fe205  1  0.443479  0.169036  0.190769  1
  Fe  Fe206  1  0.443513  0.169051  0.524124  1
  Fe  Fe207  1  0.443500  0.169027  0.857461  1
  Fe  Fe208  1  0.443512  0.419104  0.190813  1
  Fe  Fe209  1  0.443486  0.419042  0.524096  1
  Fe  Fe210  1  0.443503  0.419043  0.857473  1
  Fe  Fe211  1  0.443540  0.669211  0.190843  1
  Fe  Fe212  1  0.443522  0.669092  0.524068  1
  Fe  Fe213  1  0.443469  0.669012  0.857473  1
  Fe  Fe214  1  0.443552  0.919179  0.190826  1
  Fe  Fe215  1  0.443549  0.919092  0.524070  1
  Fe  Fe216  1  0.443464  0.918961  0.857462  1
  Fe  Fe217  1  0.693537  0.169044  0.190857  1
  Fe  Fe218  1  0.693590  0.169008  0.524070  1
  Fe  Fe219  1  0.693352  0.169002  0.857434  1
  Fe  Fe220  1  0.693531  0.419088  0.190802  1
  Fe  Fe221  1  0.693509  0.419057  0.524097  1
  Fe  Fe222  1  0.693410  0.419026  0.857451  1
  Fe  Fe223  1  0.693657  0.669182  0.190831  1
  Fe  Fe224  1  0.693518  0.669054  0.524058  1
  Fe  Fe225  1  0.693452  0.668984  0.857475  1
  Fe  Fe226  1  0.694021  0.919476  0.190756  1
  Fe  Fe227  1  0.693544  0.919006  0.524050  1
  Fe  Fe228  1  0.693394  0.918962  0.857462  1
  Fe  Fe229  1  0.942407  0.168973  0.190194  1
  Fe  Fe230  1  0.943600  0.169119  0.524303  1
  Fe  Fe231  1  0.943414  0.169074  0.857393  1
  Fe  Fe232  1  0.943503  0.418715  0.190866  1
  Fe  Fe233  1  0.943561  0.419058  0.524141  1
  Fe  Fe234  1  0.943425  0.419051  0.857432  1
  Fe  Fe235  1  0.943446  0.668976  0.190812  1
  Fe  Fe236  1  0.943503  0.669051  0.524090  1
  Fe  Fe237  1  0.943480  0.669008  0.857461  1
  Fe  Fe238  1  0.943370  0.919100  0.190634  1
  Fe  Fe239  1  0.943511  0.919058  0.524221  1
  Fe  Fe240  1  0.943433  0.918978  0.857432  1
  Fe  Fe241  1  0.181712  0.043775  0.142202  1
  Fe  Fe242  1  0.181409  0.044267  0.475810  1
  Fe  Fe243  1  0.181711  0.044035  0.808928  1
  Fe  Fe244  1  0.181490  0.294049  0.142155  1
  Fe  Fe245  1  0.182186  0.294011  0.475919  1
  Fe  Fe246  1  0.181685  0.294113  0.808924  1
  Fe  Fe247  1  0.181664  0.544013  0.142370  1
  Fe  Fe248  1  0.181496  0.544092  0.475590  1
  Fe  Fe249  1  0.181664  0.544048  0.809010  1
  Fe  Fe250  1  0.181596  0.794059  0.142340  1
  Fe  Fe251  1  0.181497  0.794140  0.475641  1
  Fe  Fe252  1  0.181678  0.794003  0.808995  1
  Fe  Fe253  1  0.431575  0.044098  0.142332  1
  Fe  Fe254  1  0.431584  0.044069  0.475657  1
  Fe  Fe255  1  0.431694  0.044003  0.808987  1
  Fe  Fe256  1  0.431604  0.294071  0.142337  1
  Fe  Fe257  1  0.431675  0.294016  0.475619  1
  Fe  Fe258  1  0.431695  0.294031  0.809006  1
  Fe  Fe259  1  0.431635  0.544101  0.142332  1
  Fe  Fe260  1  0.431617  0.544135  0.475638  1
  Fe  Fe261  1  0.431702  0.544033  0.809018  1
  Fe  Fe262  1  0.431585  0.794135  0.142333  1
  Fe  Fe263  1  0.431551  0.794132  0.475629  1
  Fe  Fe264  1  0.431677  0.793997  0.809013  1
  Fe  Fe265  1  0.681653  0.044159  0.142307  1
  Fe  Fe266  1  0.681580  0.044129  0.475657  1
  Fe  Fe267  1  0.681657  0.043970  0.808985  1
  Fe  Fe268  1  0.681690  0.294019  0.142331  1
  Fe  Fe269  1  0.681635  0.294070  0.475649  1
  Fe  Fe270  1  0.681648  0.294021  0.808994  1
  Fe  Fe271  1  0.681668  0.544075  0.142329  1
  Fe  Fe272  1  0.681623  0.544100  0.475635  1
  Fe  Fe273  1  0.681649  0.544020  0.809012  1
  Fe  Fe274  1  0.681709  0.794098  0.142352  1
  Fe  Fe275  1  0.681622  0.794069  0.475660  1
  Fe  Fe276  1  0.681656  0.793966  0.809006  1
  Fe  Fe277  1  0.933084  0.042045  0.140957  1
  Fe  Fe278  1  0.931164  0.044565  0.476028  1
  Fe  Fe279  1  0.931651  0.044008  0.808914  1
  Fe  Fe280  1  0.931671  0.293688  0.142186  1
  Fe  Fe281  1  0.931721  0.294065  0.475791  1
  Fe  Fe282  1  0.931629  0.294076  0.808937  1
  Fe  Fe283  1  0.931742  0.543923  0.142331  1
  Fe  Fe284  1  0.931641  0.544021  0.475665  1
  Fe  Fe285  1  0.931631  0.544051  0.808991  1
  Fe  Fe286  1  0.931834  0.794003  0.142285  1
  Fe  Fe287  1  0.931587  0.794069  0.475723  1
  Fe  Fe288  1  0.931646  0.794003  0.808976  1
  Fe  Fe289  1  0.068984  0.207365  0.309866  1
  Fe  Fe290  1  0.068534  0.206078  0.642376  1
  Fe  Fe291  1  0.068477  0.205990  0.975361  1
  Fe  Fe292  1  0.068498  0.455550  0.308806  1
  Fe  Fe293  1  0.068481  0.456141  0.642326  1
  Fe  Fe294  1  0.068524  0.456057  0.975704  1
  Fe  Fe295  1  0.068228  0.706211  0.308941  1
  Fe  Fe296  1  0.068488  0.706067  0.642317  1
  Fe  Fe297  1  0.068520  0.706045  0.975692  1
  Fe  Fe298  1  0.067172  0.957414  0.308881  1
  Fe  Fe299  1  0.068466  0.956071  0.642346  1
  Fe  Fe300  1  0.068632  0.955916  0.975551  1
  Fe  Fe301  1  0.318503  0.205962  0.308952  1
  Fe  Fe302  1  0.318537  0.206105  0.642346  1
  Fe  Fe303  1  0.318451  0.206125  0.975633  1
  Fe  Fe304  1  0.318499  0.456129  0.309003  1
  Fe  Fe305  1  0.318517  0.456161  0.642334  1
  Fe  Fe306  1  0.318502  0.456111  0.975676  1
  Fe  Fe307  1  0.318431  0.706110  0.308963  1
  Fe  Fe308  1  0.318481  0.706101  0.642305  1
  Fe  Fe309  1  0.318504  0.706050  0.975710  1
  Fe  Fe310  1  0.318337  0.956150  0.308971  1
  Fe  Fe311  1  0.318474  0.956093  0.642310  1
  Fe  Fe312  1  0.318575  0.955991  0.975679  1
  Fe  Fe313  1  0.568495  0.206031  0.308966  1
  Fe  Fe314  1  0.568455  0.206141  0.642302  1
  Fe  Fe315  1  0.568539  0.206019  0.975693  1
  Fe  Fe316  1  0.568546  0.456069  0.308961  1
  Fe  Fe317  1  0.568468  0.456120  0.642309  1
  Fe  Fe318  1  0.568490  0.456076  0.975697  1
  Fe  Fe319  1  0.568677  0.706066  0.308916  1
  Fe  Fe320  1  0.568438  0.706111  0.642318  1
  Fe  Fe321  1  0.568492  0.706075  0.975736  1
  Fe  Fe322  1  0.568816  0.955977  0.308917  1
  Fe  Fe323  1  0.568442  0.956116  0.642300  1
  Fe  Fe324  1  0.568532  0.956026  0.975719  1
  Fe  Fe325  1  0.818294  0.206377  0.309025  1
  Fe  Fe326  1  0.818420  0.206135  0.642341  1
  Fe  Fe327  1  0.818508  0.205972  0.975533  1
  Fe  Fe328  1  0.818571  0.456025  0.308980  1
  Fe  Fe329  1  0.818434  0.456138  0.642319  1
  Fe  Fe330  1  0.818519  0.456042  0.975679  1
  Fe  Fe331  1  0.818686  0.706132  0.308892  1
  Fe  Fe332  1  0.818451  0.706064  0.642325  1
  Fe  Fe333  1  0.818529  0.706062  0.975713  1
  Fe  Fe334  1  0.819794  0.956245  0.308672  1
  Fe  Fe335  1  0.818388  0.956043  0.642364  1
  Fe  Fe336  1  0.818441  0.955925  0.975471  1
  Fe  Fe337  1  0.056236  0.080700  0.023796  1
  Fe  Fe338  1  0.057628  0.081866  0.358319  1
  Fe  Fe339  1  0.056676  0.081021  0.690899  1
  Fe  Fe340  1  0.056750  0.331327  0.023980  1
  Fe  Fe341  1  0.056752  0.330890  0.357640  1
  Fe  Fe342  1  0.056668  0.331089  0.690841  1
  Fe  Fe343  1  0.056606  0.580997  0.024140  1
  Fe  Fe344  1  0.056665  0.581079  0.357442  1
  Fe  Fe345  1  0.056651  0.581080  0.690774  1
  Fe  Fe346  1  0.056530  0.830993  0.024061  1
  Fe  Fe347  1  0.056712  0.831442  0.357445  1
  Fe  Fe348  1  0.056662  0.831030  0.690820  1
  Fe  Fe349  1  0.306561  0.081002  0.024053  1
  Fe  Fe350  1  0.306563  0.081118  0.357485  1
  Fe  Fe351  1  0.306714  0.081058  0.690830  1
  Fe  Fe352  1  0.306856  0.331272  0.024140  1
  Fe  Fe353  1  0.306600  0.330981  0.357415  1
  Fe  Fe354  1  0.306712  0.331115  0.690812  1
  Fe  Fe355  1  0.306524  0.581047  0.024161  1
  Fe  Fe356  1  0.306627  0.581126  0.357449  1
  Fe  Fe357  1  0.306687  0.581115  0.690761  1
  Fe  Fe358  1  0.306463  0.831033  0.024173  1
  Fe  Fe359  1  0.306593  0.831170  0.357409  1
  Fe  Fe360  1  0.306693  0.831079  0.690768  1
  Fe  Fe361  1  0.556617  0.081033  0.024123  1
  Fe  Fe362  1  0.556619  0.081050  0.357444  1
  Fe  Fe363  1  0.556680  0.081095  0.690784  1
  Fe  Fe364  1  0.556639  0.331045  0.024155  1
  Fe  Fe365  1  0.556655  0.331045  0.357452  1
  Fe  Fe366  1  0.556666  0.331121  0.690769  1
  Fe  Fe367  1  0.556593  0.581079  0.024167  1
  Fe  Fe368  1  0.556661  0.581087  0.357439  1
  Fe  Fe369  1  0.556670  0.581119  0.690765  1
  Fe  Fe370  1  0.556595  0.831049  0.024164  1
  Fe  Fe371  1  0.556646  0.831066  0.357437  1
  Fe  Fe372  1  0.556683  0.831092  0.690770  1
  Fe  Fe373  1  0.806360  0.080960  0.023877  1
  Fe  Fe374  1  0.807226  0.081353  0.357633  1
  Fe  Fe375  1  0.806641  0.081067  0.690855  1
  Fe  Fe376  1  0.806614  0.331162  0.024047  1
  Fe  Fe377  1  0.806720  0.331074  0.357484  1
  Fe  Fe378  1  0.806641  0.331115  0.690806  1
  Fe  Fe379  1  0.806632  0.581038  0.024148  1
  Fe  Fe380  1  0.806744  0.581069  0.357446  1
  Fe  Fe381  1  0.806634  0.581091  0.690772  1
  Fe  Fe382  1  0.806543  0.830995  0.024121  1
  Fe  Fe383  1  0.806862  0.831202  0.357447  1
  Fe  Fe384  1  0.806628  0.831045  0.690807  1
  Fe  Fe385  1  0.057628  0.081866  0.141460  1
  Fe  Fe386  1  0.056236  0.080700  0.475983  1
  Fe  Fe387  1  0.056676  0.081021  0.808880  1
  Fe  Fe388  1  0.056752  0.330890  0.142139  1
  Fe  Fe389  1  0.056750  0.331327  0.475799  1
  Fe  Fe390  1  0.056668  0.331089  0.808938  1
  Fe  Fe391  1  0.056665  0.581079  0.142337  1
  Fe  Fe392  1  0.056606  0.580997  0.475639  1
  Fe  Fe393  1  0.056651  0.581080  0.809005  1
  Fe  Fe394  1  0.056712  0.831442  0.142333  1
  Fe  Fe395  1  0.056530  0.830993  0.475717  1
  Fe  Fe396  1  0.056662  0.831030  0.808959  1
  Fe  Fe397  1  0.306563  0.081118  0.142294  1
  Fe  Fe398  1  0.306561  0.081002  0.475726  1
  Fe  Fe399  1  0.306714  0.081058  0.808948  1
  Fe  Fe400  1  0.306600  0.330981  0.142364  1
  Fe  Fe401  1  0.306856  0.331272  0.475639  1
  Fe  Fe402  1  0.306712  0.331115  0.808967  1
  Fe  Fe403  1  0.306627  0.581126  0.142330  1
  Fe  Fe404  1  0.306524  0.581047  0.475618  1
  Fe  Fe405  1  0.306687  0.581115  0.809018  1
  Fe  Fe406  1  0.306593  0.831170  0.142370  1
  Fe  Fe407  1  0.306463  0.831033  0.475606  1
  Fe  Fe408  1  0.306693  0.831079  0.809011  1
  Fe  Fe409  1  0.556619  0.081050  0.142334  1
  Fe  Fe410  1  0.556617  0.081033  0.475656  1
  Fe  Fe411  1  0.556680  0.081095  0.808995  1
  Fe  Fe412  1  0.556655  0.331045  0.142327  1
  Fe  Fe413  1  0.556639  0.331045  0.475624  1
  Fe  Fe414  1  0.556666  0.331121  0.809010  1
  Fe  Fe415  1  0.556661  0.581087  0.142340  1
  Fe  Fe416  1  0.556593  0.581079  0.475611  1
  Fe  Fe417  1  0.556670  0.581119  0.809014  1
  Fe  Fe418  1  0.556646  0.831066  0.142342  1
  Fe  Fe419  1  0.556595  0.831049  0.475615  1
  Fe  Fe420  1  0.556683  0.831092  0.809009  1
  Fe  Fe421  1  0.807226  0.081353  0.142146  1
  Fe  Fe422  1  0.806360  0.080960  0.475902  1
  Fe  Fe423  1  0.806641  0.081067  0.808924  1
  Fe  Fe424  1  0.806720  0.331074  0.142295  1
  Fe  Fe425  1  0.806614  0.331162  0.475732  1
  Fe  Fe426  1  0.806641  0.331115  0.808972  1
  Fe  Fe427  1  0.806744  0.581069  0.142333  1
  Fe  Fe428  1  0.806632  0.581038  0.475631  1
  Fe  Fe429  1  0.806634  0.581091  0.809007  1
  Fe  Fe430  1  0.806862  0.831202  0.142332  1
  Fe  Fe431  1  0.806543  0.830995  0.475658  1
  Fe  Fe432  1  0.806628  0.831045  0.808972  1
  Fe  Fe433  1  0.068984  0.207365  0.189913  1
  Fe  Fe434  1  0.068477  0.205990  0.524418  1
  Fe  Fe435  1  0.068534  0.206078  0.857403  1
  Fe  Fe436  1  0.068498  0.455550  0.190973  1
  Fe  Fe437  1  0.068524  0.456057  0.524075  1
  Fe  Fe438  1  0.068481  0.456141  0.857453  1
  Fe  Fe439  1  0.068228  0.706211  0.190838  1
  Fe  Fe440  1  0.068520  0.706045  0.524087  1
  Fe  Fe441  1  0.068488  0.706067  0.857462  1
  Fe  Fe442  1  0.067172  0.957414  0.190898  1
  Fe  Fe443  1  0.068632  0.955916  0.524228  1
  Fe  Fe444  1  0.068466  0.956071  0.857432  1
  Fe  Fe445  1  0.318503  0.205962  0.190827  1
  Fe  Fe446  1  0.318451  0.206125  0.524146  1
  Fe  Fe447  1  0.318537  0.206105  0.857433  1
  Fe  Fe448  1  0.318499  0.456129  0.190776  1
  Fe  Fe449  1  0.318502  0.456111  0.524103  1
  Fe  Fe450  1  0.318517  0.456161  0.857445  1
  Fe  Fe451  1  0.318431  0.706110  0.190816  1
  Fe  Fe452  1  0.318504  0.706050  0.524069  1
  Fe  Fe453  1  0.318481  0.706101  0.857474  1
  Fe  Fe454  1  0.318337  0.956150  0.190808  1
  Fe  Fe455  1  0.318575  0.955991  0.524100  1
  Fe  Fe456  1  0.318474  0.956093  0.857469  1
  Fe  Fe457  1  0.568495  0.206031  0.190813  1
  Fe  Fe458  1  0.568539  0.206019  0.524086  1
  Fe  Fe459  1  0.568455  0.206141  0.857477  1
  Fe  Fe460  1  0.568546  0.456069  0.190818  1
  Fe  Fe461  1  0.568490  0.456076  0.524082  1
  Fe  Fe462  1  0.568468  0.456120  0.857470  1
  Fe  Fe463  1  0.568677  0.706066  0.190863  1
  Fe  Fe464  1  0.568492  0.706075  0.524043  1
  Fe  Fe465  1  0.568438  0.706111  0.857461  1
  Fe  Fe466  1  0.568816  0.955977  0.190862  1
  Fe  Fe467  1  0.568532  0.956026  0.524060  1
  Fe  Fe468  1  0.568442  0.956116  0.857479  1
  Fe  Fe469  1  0.818294  0.206377  0.190753  1
  Fe  Fe470  1  0.818508  0.205972  0.524246  1
  Fe  Fe471  1  0.818420  0.206135  0.857438  1
  Fe  Fe472  1  0.818571  0.456025  0.190799  1
  Fe  Fe473  1  0.818519  0.456042  0.524100  1
  Fe  Fe474  1  0.818434  0.456138  0.857460  1
  Fe  Fe475  1  0.818686  0.706132  0.190887  1
  Fe  Fe476  1  0.818529  0.706062  0.524066  1
  Fe  Fe477  1  0.818451  0.706064  0.857454  1
  Fe  Fe478  1  0.819794  0.956245  0.191107  1
  Fe  Fe479  1  0.818441  0.955925  0.524308  1
  Fe  Fe480  1  0.818388  0.956043  0.857415  1
  Fe  Fe481  1  0.181409  0.044267  0.023969  1
  Fe  Fe482  1  0.181712  0.043775  0.357577  1
  Fe  Fe483  1  0.181711  0.044035  0.690851  1
  Fe  Fe484  1  0.182186  0.294011  0.023860  1
  Fe  Fe485  1  0.181490  0.294049  0.357624  1
  Fe  Fe486  1  0.181685  0.294113  0.690855  1
  Fe  Fe487  1  0.181496  0.544092  0.024189  1
  Fe  Fe488  1  0.181664  0.544013  0.357409  1
  Fe  Fe489  1  0.181664  0.544048  0.690769  1
  Fe  Fe490  1  0.181497  0.794140  0.024138  1
  Fe  Fe491  1  0.181596  0.794059  0.357439  1
  Fe  Fe492  1  0.181678  0.794003  0.690784  1
  Fe  Fe493  1  0.431584  0.044069  0.024122  1
  Fe  Fe494  1  0.431575  0.044098  0.357447  1
  Fe  Fe495  1  0.431694  0.044003  0.690792  1
  Fe  Fe496  1  0.431675  0.294016  0.024160  1
  Fe  Fe497  1  0.431604  0.294071  0.357442  1
  Fe  Fe498  1  0.431695  0.294031  0.690773  1
  Fe  Fe499  1  0.431617  0.544135  0.024141  1
  Fe  Fe500  1  0.431635  0.544101  0.357447  1
  Fe  Fe501  1  0.431702  0.544033  0.690761  1
  Fe  Fe502  1  0.431551  0.794132  0.024150  1
  Fe  Fe503  1  0.431585  0.794135  0.357446  1
  Fe  Fe504  1  0.431677  0.793997  0.690766  1
  Fe  Fe505  1  0.681580  0.044129  0.024122  1
  Fe  Fe506  1  0.681653  0.044159  0.357472  1
  Fe  Fe507  1  0.681657  0.043970  0.690794  1
  Fe  Fe508  1  0.681635  0.294070  0.024130  1
  Fe  Fe509  1  0.681690  0.294019  0.357448  1
  Fe  Fe510  1  0.681648  0.294021  0.690785  1
  Fe  Fe511  1  0.681623  0.544100  0.024144  1
  Fe  Fe512  1  0.681668  0.544075  0.357450  1
  Fe  Fe513  1  0.681649  0.544020  0.690767  1
  Fe  Fe514  1  0.681622  0.794069  0.024119  1
  Fe  Fe515  1  0.681709  0.794098  0.357427  1
  Fe  Fe516  1  0.681656  0.793966  0.690773  1
  Fe  Fe517  1  0.931164  0.044565  0.023751  1
  Fe  Fe518  1  0.933084  0.042045  0.358822  1
  Fe  Fe519  1  0.931651  0.044008  0.690865  1
  Fe  Fe520  1  0.931721  0.294065  0.023988  1
  Fe  Fe521  1  0.931671  0.293688  0.357593  1
  Fe  Fe522  1  0.931629  0.294076  0.690842  1
  Fe  Fe523  1  0.931641  0.544021  0.024114  1
  Fe  Fe524  1  0.931742  0.543923  0.357448  1
  Fe  Fe525  1  0.931631  0.544051  0.690787  1
  Fe  Fe526  1  0.931587  0.794069  0.024056  1
  Fe  Fe527  1  0.931834  0.794003  0.357494  1
  Fe  Fe528  1  0.931646  0.794003  0.690803  1
  Fe  Fe529  1  0.193400  0.168980  0.309204  1
  Fe  Fe530  1  0.193541  0.169061  0.642361  1
  Fe  Fe531  1  0.193517  0.169008  0.975497  1
  Fe  Fe532  1  0.193585  0.419030  0.308999  1
  Fe  Fe533  1  0.193506  0.419087  0.642334  1
  Fe  Fe534  1  0.193573  0.419079  0.975645  1
  Fe  Fe535  1  0.193374  0.669118  0.308923  1
  Fe  Fe536  1  0.193487  0.669012  0.642317  1
  Fe  Fe537  1  0.193505  0.669087  0.975707  1
  Fe  Fe538  1  0.193022  0.919130  0.308831  1
  Fe  Fe539  1  0.193465  0.918950  0.642331  1
  Fe  Fe540  1  0.193564  0.919131  0.975691  1
  Fe  Fe541  1  0.443479  0.169036  0.309009  1
  Fe  Fe542  1  0.443500  0.169027  0.642318  1
  Fe  Fe543  1  0.443513  0.169051  0.975655  1
  Fe  Fe544  1  0.443512  0.419104  0.308966  1
  Fe  Fe545  1  0.443503  0.419043  0.642306  1
  Fe  Fe546  1  0.443486  0.419042  0.975683  1
  Fe  Fe547  1  0.443540  0.669211  0.308936  1
  Fe  Fe548  1  0.443469  0.669012  0.642306  1
  Fe  Fe549  1  0.443522  0.669092  0.975711  1
  Fe  Fe550  1  0.443552  0.919179  0.308953  1
  Fe  Fe551  1  0.443464  0.918961  0.642317  1
  Fe  Fe552  1  0.443549  0.919092  0.975709  1
  Fe  Fe553  1  0.693537  0.169044  0.308922  1
  Fe  Fe554  1  0.693352  0.169002  0.642345  1
  Fe  Fe555  1  0.693590  0.169008  0.975709  1
  Fe  Fe556  1  0.693531  0.419088  0.308977  1
  Fe  Fe557  1  0.693410  0.419026  0.642328  1
  Fe  Fe558  1  0.693509  0.419057  0.975682  1
  Fe  Fe559  1  0.693657  0.669182  0.308948  1
  Fe  Fe560  1  0.693452  0.668984  0.642303  1
  Fe  Fe561  1  0.693518  0.669054  0.975721  1
  Fe  Fe562  1  0.694021  0.919476  0.309023  1
  Fe  Fe563  1  0.693394  0.918962  0.642317  1
  Fe  Fe564  1  0.693544  0.919006  0.975729  1
  Fe  Fe565  1  0.942407  0.168973  0.309584  1
  Fe  Fe566  1  0.943414  0.169074  0.642386  1
  Fe  Fe567  1  0.943600  0.169119  0.975476  1
  Fe  Fe568  1  0.943503  0.418715  0.308913  1
  Fe  Fe569  1  0.943425  0.419051  0.642347  1
  Fe  Fe570  1  0.943561  0.419058  0.975638  1
  Fe  Fe571  1  0.943446  0.668976  0.308967  1
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  C  C767  1  0.981298  0.864573  0.749889  1
