# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.85021939
_cell_length_b   14.18559220
_cell_length_c   46.29026766
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   59.26634010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe450 C180'
_cell_volume   11204.0419373
_cell_formula_units_Z   90
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  0.609869  0.916855  0.342730  1
  Fe  Fe2  1  0.747396  0.409311  0.281494  1
  Fe  Fe3  1  0.276535  0.916855  0.342730  1
  Fe  Fe4  1  0.679572  0.161755  0.312677  1
  Fe  Fe5  1  0.414062  0.409311  0.281494  1
  Fe  Fe6  1  0.943202  0.916855  0.342730  1
  Fe  Fe7  1  0.346239  0.161755  0.312677  1
  Fe  Fe8  1  0.080729  0.409311  0.281494  1
  Fe  Fe9  1  0.012905  0.161755  0.312677  1
  Fe  Fe10  1  0.805274  0.447416  0.353266  1
  Fe  Fe11  1  0.942231  0.936639  0.291856  1
  Fe  Fe12  1  0.471940  0.447416  0.353266  1
  Fe  Fe13  1  0.873737  0.692365  0.323759  1
  Fe  Fe14  1  0.608897  0.936639  0.291856  1
  Fe  Fe15  1  0.138607  0.447416  0.353266  1
  Fe  Fe16  1  0.540404  0.692365  0.323759  1
  Fe  Fe17  1  0.275564  0.936639  0.291856  1
  Fe  Fe18  1  0.207070  0.692365  0.323759  1
  Fe  Fe19  1  0.836334  0.446763  0.306211  1
  Fe  Fe20  1  0.768781  0.202129  0.336328  1
  Fe  Fe21  1  0.503001  0.446763  0.306211  1
  Fe  Fe22  1  0.905155  0.693594  0.275858  1
  Fe  Fe23  1  0.435448  0.202129  0.336328  1
  Fe  Fe24  1  0.169668  0.446763  0.306211  1
  Fe  Fe25  1  0.571821  0.693594  0.275858  1
  Fe  Fe26  1  0.102114  0.202129  0.336328  1
  Fe  Fe27  1  0.238488  0.693594  0.275858  1
  Fe  Fe28  1  0.936034  0.508786  0.297385  1
  Fe  Fe29  1  0.858685  0.271457  0.327807  1
  Fe  Fe30  1  0.602701  0.508786  0.297385  1
  Fe  Fe31  1  0.791715  0.025191  0.358315  1
  Fe  Fe32  1  0.525352  0.271457  0.327807  1
  Fe  Fe33  1  0.269368  0.508786  0.297385  1
  Fe  Fe34  1  0.458382  0.025191  0.358315  1
  Fe  Fe35  1  0.192018  0.271457  0.327807  1
  Fe  Fe36  1  0.125049  0.025191  0.358315  1
  Fe  Fe37  1  0.694431  0.583882  0.306988  1
  Fe  Fe38  1  0.624653  0.338484  0.337714  1
  Fe  Fe39  1  0.361098  0.583882  0.306988  1
  Fe  Fe40  1  0.762539  0.830360  0.277272  1
  Fe  Fe41  1  0.291320  0.338484  0.337714  1
  Fe  Fe42  1  0.027764  0.583882  0.306988  1
  Fe  Fe43  1  0.429206  0.830360  0.277272  1
  Fe  Fe44  1  0.957986  0.338484  0.337714  1
  Fe  Fe45  1  0.095873  0.830360  0.277272  1
  Fe  Fe46  1  0.535662  0.831095  0.353494  1
  Fe  Fe47  1  0.678424  0.306228  0.288791  1
  Fe  Fe48  1  0.202329  0.831095  0.353494  1
  Fe  Fe49  1  0.604743  0.077433  0.323494  1
  Fe  Fe50  1  0.345091  0.306228  0.288791  1
  Fe  Fe51  1  0.868996  0.831095  0.353494  1
  Fe  Fe52  1  0.271410  0.077433  0.323494  1
  Fe  Fe53  1  0.011757  0.306228  0.288791  1
  Fe  Fe54  1  0.938077  0.077433  0.323494  1
  Fe  Fe55  1  0.733912  0.735210  0.341424  1
  Fe  Fe56  1  0.868882  0.236192  0.280349  1
  Fe  Fe57  1  0.400579  0.735210  0.341424  1
  Fe  Fe58  1  0.802500  0.979875  0.310649  1
  Fe  Fe59  1  0.535549  0.236192  0.280349  1
  Fe  Fe60  1  0.067245  0.735210  0.341424  1
  Fe  Fe61  1  0.469167  0.979875  0.310649  1
  Fe  Fe62  1  0.202215  0.236192  0.280349  1
  Fe  Fe63  1  0.135834  0.979875  0.310649  1
  Fe  Fe64  1  0.880848  0.531918  0.342465  1
  Fe  Fe65  1  0.016214  0.026137  0.282152  1
  Fe  Fe66  1  0.547515  0.531918  0.342465  1
  Fe  Fe67  1  0.949357  0.777795  0.312222  1
  Fe  Fe68  1  0.682881  0.026137  0.282152  1
  Fe  Fe69  1  0.214181  0.531918  0.342465  1
  Fe  Fe70  1  0.616024  0.777795  0.312222  1
  Fe  Fe71  1  0.349547  0.026137  0.282152  1
  Fe  Fe72  1  0.282691  0.777795  0.312222  1
  Fe  Fe73  1  0.783432  0.654082  0.298231  1
  Fe  Fe74  1  0.716897  0.406286  0.329379  1
  Fe  Fe75  1  0.450099  0.654082  0.298231  1
  Fe  Fe76  1  0.647378  0.161481  0.359464  1
  Fe  Fe77  1  0.383564  0.406286  0.329379  1
  Fe  Fe78  1  0.116765  0.654082  0.298231  1
  Fe  Fe79  1  0.314045  0.161481  0.359464  1
  Fe  Fe80  1  0.050230  0.406286  0.329379  1
  Fe  Fe81  1  0.980711  0.161481  0.359464  1
  Fe  Fe82  1  0.683007  0.627421  0.354499  1
  Fe  Fe83  1  0.820892  0.120425  0.293820  1
  Fe  Fe84  1  0.349674  0.627421  0.354499  1
  Fe  Fe85  1  0.750487  0.874004  0.324774  1
  Fe  Fe86  1  0.487558  0.120425  0.293820  1
  Fe  Fe87  1  0.016340  0.627421  0.354499  1
  Fe  Fe88  1  0.417154  0.874004  0.324774  1
  Fe  Fe89  1  0.154225  0.120425  0.293820  1
  Fe  Fe90  1  0.083821  0.874004  0.324774  1
  Fe  Fe91  1  0.402773  0.180228  0.433533  1
  Fe  Fe92  1  0.541330  0.670561  0.372735  1
  Fe  Fe93  1  0.069440  0.180228  0.433533  1
  Fe  Fe94  1  0.471987  0.425198  0.403085  1
  Fe  Fe95  1  0.207997  0.670561  0.372735  1
  Fe  Fe96  1  0.736107  0.180228  0.433533  1
  Fe  Fe97  1  0.138654  0.425198  0.403085  1
  Fe  Fe98  1  0.874663  0.670561  0.372735  1
  Fe  Fe99  1  0.805321  0.425198  0.403085  1
  Fe  Fe100  1  0.596957  0.710786  0.444236  1
  Fe  Fe101  1  0.735330  0.201321  0.383741  1
  Fe  Fe102  1  0.263624  0.710786  0.444236  1
  Fe  Fe103  1  0.666241  0.956043  0.413998  1
  Fe  Fe104  1  0.401997  0.201321  0.383741  1
  Fe  Fe105  1  0.930291  0.710786  0.444236  1
  Fe  Fe106  1  0.332908  0.956043  0.413998  1
  Fe  Fe107  1  0.068663  0.201321  0.383741  1
  Fe  Fe108  1  0.999575  0.956043  0.413998  1
  Fe  Fe109  1  0.630010  0.710615  0.397170  1
  Fe  Fe110  1  0.560709  0.465493  0.427582  1
  Fe  Fe111  1  0.296677  0.710615  0.397170  1
  Fe  Fe112  1  0.698910  0.956416  0.367087  1
  Fe  Fe113  1  0.227376  0.465493  0.427582  1
  Fe  Fe114  1  0.963344  0.710615  0.397170  1
  Fe  Fe115  1  0.365577  0.956416  0.367087  1
  Fe  Fe116  1  0.894043  0.465493  0.427582  1
  Fe  Fe117  1  0.032244  0.956416  0.367087  1
  Fe  Fe118  1  0.721973  0.779438  0.388869  1
  Fe  Fe119  1  0.652887  0.534368  0.418948  1
  Fe  Fe120  1  0.388640  0.779438  0.388869  1
  Fe  Fe121  1  0.583799  0.288834  0.449399  1
  Fe  Fe122  1  0.319553  0.534368  0.418948  1
  Fe  Fe123  1  0.055306  0.779438  0.388869  1
  Fe  Fe124  1  0.250466  0.288834  0.449399  1
  Fe  Fe125  1  0.986220  0.534368  0.418948  1
  Fe  Fe126  1  0.917132  0.288834  0.449399  1
  Fe  Fe127  1  0.485293  0.847320  0.398268  1
  Fe  Fe128  1  0.416193  0.601758  0.428463  1
  Fe  Fe129  1  0.151959  0.847320  0.398268  1
  Fe  Fe130  1  0.554525  0.092730  0.367881  1
  Fe  Fe131  1  0.082860  0.601758  0.428463  1
  Fe  Fe132  1  0.818626  0.847320  0.398268  1
  Fe  Fe133  1  0.221192  0.092730  0.367881  1
  Fe  Fe134  1  0.749526  0.601758  0.428463  1
  Fe  Fe135  1  0.887859  0.092730  0.367881  1
  Fe  Fe136  1  0.328268  0.094436  0.444046  1
  Fe  Fe137  1  0.466647  0.585131  0.383354  1
  Fe  Fe138  1  0.994935  0.094436  0.444046  1
  Fe  Fe139  1  0.397313  0.340197  0.414011  1
  Fe  Fe140  1  0.133313  0.585131  0.383354  1
  Fe  Fe141  1  0.661601  0.094436  0.444046  1
  Fe  Fe142  1  0.063980  0.340197  0.414011  1
  Fe  Fe143  1  0.799980  0.585131  0.383354  1
  Fe  Fe144  1  0.730647  0.340197  0.414011  1
  Fe  Fe145  1  0.525708  0.999188  0.432210  1
  Fe  Fe146  1  0.663611  0.491176  0.371359  1
  Fe  Fe147  1  0.192375  0.999188  0.432210  1
  Fe  Fe148  1  0.594537  0.245086  0.401725  1
  Fe  Fe149  1  0.330278  0.491176  0.371359  1
  Fe  Fe150  1  0.859042  0.999188  0.432210  1
  Fe  Fe151  1  0.261204  0.245086  0.401725  1
  Fe  Fe152  1  0.996944  0.491176  0.371359  1
  Fe  Fe153  1  0.927870  0.245086  0.401725  1
  Fe  Fe154  1  0.671572  0.796431  0.433883  1
  Fe  Fe155  1  0.810590  0.286946  0.373296  1
  Fe  Fe156  1  0.338238  0.796431  0.433883  1
  Fe  Fe157  1  0.740816  0.041716  0.403457  1
  Fe  Fe158  1  0.477257  0.286946  0.373296  1
  Fe  Fe159  1  0.004905  0.796431  0.433883  1
  Fe  Fe160  1  0.407483  0.041716  0.403457  1
  Fe  Fe161  1  0.143923  0.286946  0.373296  1
  Fe  Fe162  1  0.074149  0.041716  0.403457  1
  Fe  Fe163  1  0.577563  0.916178  0.389566  1
  Fe  Fe164  1  0.508386  0.670964  0.419922  1
  Fe  Fe165  1  0.244229  0.916178  0.389566  1
  Fe  Fe166  1  0.439136  0.425674  0.450205  1
  Fe  Fe167  1  0.175053  0.670964  0.419922  1
  Fe  Fe168  1  0.910896  0.916178  0.389566  1
  Fe  Fe169  1  0.105802  0.425674  0.450205  1
  Fe  Fe170  1  0.841719  0.670964  0.419922  1
  Fe  Fe171  1  0.772469  0.425674  0.450205  1
  Fe  Fe172  1  0.474149  0.891812  0.445609  1
  Fe  Fe173  1  0.611932  0.382887  0.385069  1
  Fe  Fe174  1  0.140815  0.891812  0.445609  1
  Fe  Fe175  1  0.543212  0.137217  0.415300  1
  Fe  Fe176  1  0.278599  0.382887  0.385069  1
  Fe  Fe177  1  0.807482  0.891812  0.445609  1
  Fe  Fe178  1  0.209879  0.137217  0.415300  1
  Fe  Fe179  1  0.945265  0.382887  0.385069  1
  Fe  Fe180  1  0.876546  0.137217  0.415300  1
  Fe  Fe181  1  0.195267  0.444426  0.524519  1
  Fe  Fe182  1  0.333616  0.934945  0.463893  1
  Fe  Fe183  1  0.861934  0.444426  0.524519  1
  Fe  Fe184  1  0.264487  0.689563  0.494173  1
  Fe  Fe185  1  0.000283  0.934945  0.463893  1
  Fe  Fe186  1  0.528600  0.444426  0.524519  1
  Fe  Fe187  1  0.931154  0.689563  0.494173  1
  Fe  Fe188  1  0.666950  0.934945  0.463893  1
  Fe  Fe189  1  0.597821  0.689563  0.494173  1
  Fe  Fe190  1  0.389430  0.974930  0.535190  1
  Fe  Fe191  1  0.527779  0.465448  0.474565  1
  Fe  Fe192  1  0.056097  0.974930  0.535190  1
  Fe  Fe193  1  0.458559  0.220312  0.504911  1
  Fe  Fe194  1  0.194446  0.465448  0.474565  1
  Fe  Fe195  1  0.722763  0.974930  0.535190  1
  Fe  Fe196  1  0.125226  0.220312  0.504911  1
  Fe  Fe197  1  0.861113  0.465448  0.474565  1
  Fe  Fe198  1  0.791892  0.220312  0.504911  1
  Fe  Fe199  1  0.422371  0.974723  0.488230  1
  Fe  Fe200  1  0.353141  0.729422  0.518565  1
  Fe  Fe201  1  0.089038  0.974723  0.488230  1
  Fe  Fe202  1  0.491514  0.220032  0.457931  1
  Fe  Fe203  1  0.019808  0.729422  0.518565  1
  Fe  Fe204  1  0.755705  0.974723  0.488230  1
  Fe  Fe205  1  0.158181  0.220032  0.457931  1
  Fe  Fe206  1  0.686474  0.729422  0.518565  1
  Fe  Fe207  1  0.824847  0.220032  0.457931  1
  Fe  Fe208  1  0.514470  0.043757  0.479647  1
  Fe  Fe209  1  0.445342  0.798494  0.509975  1
  Fe  Fe210  1  0.181137  0.043757  0.479647  1
  Fe  Fe211  1  0.376186  0.553171  0.540246  1
  Fe  Fe212  1  0.112009  0.798494  0.509975  1
  Fe  Fe213  1  0.847804  0.043757  0.479647  1
  Fe  Fe214  1  0.042852  0.553171  0.540246  1
  Fe  Fe215  1  0.778676  0.798494  0.509975  1
  Fe  Fe216  1  0.709519  0.553171  0.540246  1
  Fe  Fe217  1  0.277704  0.111381  0.489109  1
  Fe  Fe218  1  0.208576  0.866117  0.519437  1
  Fe  Fe219  1  0.944371  0.111381  0.489109  1
  Fe  Fe220  1  0.346860  0.356703  0.458838  1
  Fe  Fe221  1  0.875242  0.866117  0.519437  1
  Fe  Fe222  1  0.611037  0.111381  0.489109  1
  Fe  Fe223  1  0.013527  0.356703  0.458838  1
  Fe  Fe224  1  0.541909  0.866117  0.519437  1
  Fe  Fe225  1  0.680194  0.356703  0.458838  1
  Fe  Fe226  1  0.120736  0.358642  0.534980  1
  Fe  Fe227  1  0.259132  0.849157  0.474357  1
  Fe  Fe228  1  0.787403  0.358642  0.534980  1
  Fe  Fe229  1  0.189962  0.603842  0.504625  1
  Fe  Fe230  1  0.925799  0.849157  0.474357  1
  Fe  Fe231  1  0.454069  0.358642  0.534980  1
  Fe  Fe232  1  0.856628  0.603842  0.504625  1
  Fe  Fe233  1  0.592466  0.849157  0.474357  1
  Fe  Fe234  1  0.523295  0.603842  0.504625  1
  Fe  Fe235  1  0.318204  0.263293  0.523198  1
  Fe  Fe236  1  0.456606  0.753737  0.462590  1
  Fe  Fe237  1  0.984871  0.263293  0.523198  1
  Fe  Fe238  1  0.387283  0.508667  0.492820  1
  Fe  Fe239  1  0.123273  0.753737  0.462590  1
  Fe  Fe240  1  0.651538  0.263293  0.523198  1
  Fe  Fe241  1  0.053950  0.508667  0.492820  1
  Fe  Fe242  1  0.789940  0.753737  0.462590  1
  Fe  Fe243  1  0.720617  0.508667  0.492820  1
  Fe  Fe244  1  0.463914  0.060717  0.524727  1
  Fe  Fe245  1  0.602310  0.551233  0.464104  1
  Fe  Fe246  1  0.130580  0.060717  0.524727  1
  Fe  Fe247  1  0.533084  0.306032  0.494459  1
  Fe  Fe248  1  0.268977  0.551233  0.464104  1
  Fe  Fe249  1  0.797247  0.060717  0.524727  1
  Fe  Fe250  1  0.199751  0.306032  0.494459  1
  Fe  Fe251  1  0.935643  0.551233  0.464104  1
  Fe  Fe252  1  0.866418  0.306032  0.494459  1
  Fe  Fe253  1  0.369905  0.180452  0.480519  1
  Fe  Fe254  1  0.300675  0.935151  0.510854  1
  Fe  Fe255  1  0.036572  0.180452  0.480519  1
  Fe  Fe256  1  0.231532  0.689842  0.541153  1
  Fe  Fe257  1  0.967342  0.935151  0.510854  1
  Fe  Fe258  1  0.703238  0.180452  0.480519  1
  Fe  Fe259  1  0.898199  0.689842  0.541153  1
  Fe  Fe260  1  0.634008  0.935151  0.510854  1
  Fe  Fe261  1  0.564865  0.689842  0.541153  1
  Fe  Fe262  1  0.266440  0.156137  0.536494  1
  Fe  Fe263  1  0.404842  0.646582  0.475886  1
  Fe  Fe264  1  0.933106  0.156137  0.536494  1
  Fe  Fe265  1  0.335763  0.401207  0.506264  1
  Fe  Fe266  1  0.071508  0.646582  0.475886  1
  Fe  Fe267  1  0.599773  0.156137  0.536494  1
  Fe  Fe268  1  0.002429  0.401207  0.506264  1
  Fe  Fe269  1  0.738175  0.646582  0.475886  1
  Fe  Fe270  1  0.669096  0.401207  0.506264  1
  Fe  Fe271  1  0.987716  0.708554  0.615343  1
  Fe  Fe272  1  0.126089  0.199089  0.554848  1
  Fe  Fe273  1  0.654383  0.708554  0.615343  1
  Fe  Fe274  1  0.056805  0.953832  0.585086  1
  Fe  Fe275  1  0.792755  0.199089  0.554848  1
  Fe  Fe276  1  0.321049  0.708554  0.615343  1
  Fe  Fe277  1  0.723471  0.953832  0.585086  1
  Fe  Fe278  1  0.459422  0.199089  0.554848  1
  Fe  Fe279  1  0.390138  0.953832  0.585086  1
  Fe  Fe280  1  0.181716  0.239313  0.626349  1
  Fe  Fe281  1  0.320273  0.729647  0.565551  1
  Fe  Fe282  1  0.848383  0.239313  0.626349  1
  Fe  Fe283  1  0.251059  0.484677  0.595999  1
  Fe  Fe284  1  0.986940  0.729647  0.565551  1
  Fe  Fe285  1  0.515049  0.239313  0.626349  1
  Fe  Fe286  1  0.917726  0.484677  0.595999  1
  Fe  Fe287  1  0.653606  0.729647  0.565551  1
  Fe  Fe288  1  0.584392  0.484677  0.595999  1
  Fe  Fe289  1  0.214660  0.238911  0.579162  1
  Fe  Fe290  1  0.145483  0.993697  0.609518  1
  Fe  Fe291  1  0.881327  0.238911  0.579162  1
  Fe  Fe292  1  0.283910  0.484200  0.548879  1
  Fe  Fe293  1  0.812150  0.993697  0.609518  1
  Fe  Fe294  1  0.547993  0.238911  0.579162  1
  Fe  Fe295  1  0.950577  0.484200  0.548879  1
  Fe  Fe296  1  0.478817  0.993697  0.609518  1
  Fe  Fe297  1  0.617244  0.484200  0.548879  1
  Fe  Fe298  1  0.306853  0.308116  0.570621  1
  Fe  Fe299  1  0.237753  0.062554  0.600816  1
  Fe  Fe300  1  0.973520  0.308116  0.570621  1
  Fe  Fe301  1  0.168521  0.817144  0.631203  1
  Fe  Fe302  1  0.904420  0.062554  0.600816  1
  Fe  Fe303  1  0.640186  0.308116  0.570621  1
  Fe  Fe304  1  0.835187  0.817144  0.631203  1
  Fe  Fe305  1  0.571087  0.062554  0.600816  1
  Fe  Fe306  1  0.501854  0.817144  0.631203  1
  Fe  Fe307  1  0.070160  0.375507  0.580136  1
  Fe  Fe308  1  0.001073  0.130436  0.610215  1
  Fe  Fe309  1  0.736826  0.375507  0.580136  1
  Fe  Fe310  1  0.139247  0.621040  0.549684  1
  Fe  Fe311  1  0.667740  0.130436  0.610215  1
  Fe  Fe312  1  0.403493  0.375507  0.580136  1
  Fe  Fe313  1  0.805914  0.621040  0.549684  1
  Fe  Fe314  1  0.334406  0.130436  0.610215  1
  Fe  Fe315  1  0.472580  0.621040  0.549684  1
  Fe  Fe316  1  0.912456  0.622929  0.625788  1
  Fe  Fe317  1  0.051475  0.113443  0.565201  1
  Fe  Fe318  1  0.579123  0.622929  0.625788  1
  Fe  Fe319  1  0.982230  0.868158  0.595627  1
  Fe  Fe320  1  0.718141  0.113443  0.565201  1
  Fe  Fe321  1  0.245789  0.622929  0.625788  1
  Fe  Fe322  1  0.648897  0.868158  0.595627  1
  Fe  Fe323  1  0.384808  0.113443  0.565201  1
  Fe  Fe324  1  0.315564  0.868158  0.595627  1
  Fe  Fe325  1  0.111114  0.526988  0.614015  1
  Fe  Fe326  1  0.248897  0.018062  0.553475  1
  Fe  Fe327  1  0.777781  0.526988  0.614015  1
  Fe  Fe328  1  0.179834  0.772657  0.583784  1
  Fe  Fe329  1  0.915564  0.018062  0.553475  1
  Fe  Fe330  1  0.444447  0.526988  0.614015  1
  Fe  Fe331  1  0.846500  0.772657  0.583784  1
  Fe  Fe332  1  0.582231  0.018062  0.553475  1
  Fe  Fe333  1  0.513167  0.772657  0.583784  1
  Fe  Fe334  1  0.256400  0.324743  0.615730  1
  Fe  Fe335  1  0.394778  0.815438  0.555038  1
  Fe  Fe336  1  0.923066  0.324743  0.615730  1
  Fe  Fe337  1  0.325733  0.569677  0.585073  1
  Fe  Fe338  1  0.061445  0.815438  0.555038  1
  Fe  Fe339  1  0.589733  0.324743  0.615730  1
  Fe  Fe340  1  0.992399  0.569677  0.585073  1
  Fe  Fe341  1  0.728111  0.815438  0.555038  1
  Fe  Fe342  1  0.659066  0.569677  0.585073  1
  Fe  Fe343  1  0.162337  0.444382  0.571502  1
  Fe  Fe344  1  0.093036  0.199259  0.601914  1
  Fe  Fe345  1  0.829003  0.444382  0.571502  1
  Fe  Fe346  1  0.024136  0.953458  0.631997  1
  Fe  Fe347  1  0.759703  0.199259  0.601914  1
  Fe  Fe348  1  0.495670  0.444382  0.571502  1
  Fe  Fe349  1  0.690802  0.953458  0.631997  1
  Fe  Fe350  1  0.426369  0.199259  0.601914  1
  Fe  Fe351  1  0.357469  0.953458  0.631997  1
  Fe  Fe352  1  0.059435  0.418698  0.627725  1
  Fe  Fe353  1  0.197338  0.910686  0.566874  1
  Fe  Fe354  1  0.726102  0.418698  0.627725  1
  Fe  Fe355  1  0.128509  0.664788  0.597359  1
  Fe  Fe356  1  0.864004  0.910686  0.566874  1
  Fe  Fe357  1  0.392768  0.418698  0.627725  1
  Fe  Fe358  1  0.795176  0.664788  0.597359  1
  Fe  Fe359  1  0.530671  0.910686  0.566874  1
  Fe  Fe360  1  0.461842  0.664788  0.597359  1
  Fe  Fe361  1  0.780815  0.973236  0.707228  1
  Fe  Fe362  1  0.917772  0.462458  0.645817  1
  Fe  Fe363  1  0.447482  0.973236  0.707228  1
  Fe  Fe364  1  0.849309  0.217510  0.675325  1
  Fe  Fe365  1  0.584439  0.462458  0.645817  1
  Fe  Fe366  1  0.114149  0.973236  0.707228  1
  Fe  Fe367  1  0.515976  0.217510  0.675325  1
  Fe  Fe368  1  0.251106  0.462458  0.645817  1
  Fe  Fe369  1  0.182642  0.217510  0.675325  1
  Fe  Fe370  1  0.975650  0.500563  0.717590  1
  Fe  Fe371  1  0.113177  0.993019  0.656353  1
  Fe  Fe372  1  0.642317  0.500563  0.717590  1
  Fe  Fe373  1  0.043474  0.748119  0.686407  1
  Fe  Fe374  1  0.779844  0.993019  0.656353  1
  Fe  Fe375  1  0.308984  0.500563  0.717590  1
  Fe  Fe376  1  0.710141  0.748119  0.686407  1
  Fe  Fe377  1  0.446511  0.993019  0.656353  1
  Fe  Fe378  1  0.376807  0.748119  0.686407  1
  Fe  Fe379  1  0.006149  0.503588  0.669705  1
  Fe  Fe380  1  0.939614  0.255792  0.700853  1
  Fe  Fe381  1  0.672816  0.503588  0.669705  1
  Fe  Fe382  1  0.075668  0.748393  0.639620  1
  Fe  Fe383  1  0.606281  0.255792  0.700853  1
  Fe  Fe384  1  0.339482  0.503588  0.669705  1
  Fe  Fe385  1  0.742335  0.748393  0.639620  1
  Fe  Fe386  1  0.272947  0.255792  0.700853  1
  Fe  Fe387  1  0.409001  0.748393  0.639620  1
  Fe  Fe388  1  0.098393  0.571390  0.661370  1
  Fe  Fe389  1  0.028615  0.325992  0.692096  1
  Fe  Fe390  1  0.765060  0.571390  0.661370  1
  Fe  Fe391  1  0.960507  0.079514  0.721811  1
  Fe  Fe392  1  0.695282  0.325992  0.692096  1
  Fe  Fe393  1  0.431726  0.571390  0.661370  1
  Fe  Fe394  1  0.627173  0.079514  0.721811  1
  Fe  Fe395  1  0.361948  0.325992  0.692096  1
  Fe  Fe396  1  0.293840  0.079514  0.721811  1
  Fe  Fe397  1  0.864361  0.638417  0.671276  1
  Fe  Fe398  1  0.787012  0.401088  0.701699  1
  Fe  Fe399  1  0.531028  0.638417  0.671276  1
  Fe  Fe400  1  0.931331  0.884683  0.640769  1
  Fe  Fe401  1  0.453678  0.401088  0.701699  1
  Fe  Fe402  1  0.197694  0.638417  0.671276  1
  Fe  Fe403  1  0.597997  0.884683  0.640769  1
  Fe  Fe404  1  0.120345  0.401088  0.701699  1
  Fe  Fe405  1  0.264664  0.884683  0.640769  1
  Fe  Fe406  1  0.706832  0.883737  0.716932  1
  Fe  Fe407  1  0.842198  0.377956  0.656619  1
  Fe  Fe408  1  0.373499  0.883737  0.716932  1
  Fe  Fe409  1  0.773689  0.132080  0.686862  1
  Fe  Fe410  1  0.508865  0.377956  0.656619  1
  Fe  Fe411  1  0.040165  0.883737  0.716932  1
  Fe  Fe412  1  0.440356  0.132080  0.686862  1
  Fe  Fe413  1  0.175532  0.377956  0.656619  1
  Fe  Fe414  1  0.107022  0.132080  0.686862  1
  Fe  Fe415  1  0.902154  0.789450  0.705264  1
  Fe  Fe416  1  0.040039  0.282453  0.644585  1
  Fe  Fe417  1  0.568821  0.789450  0.705264  1
  Fe  Fe418  1  0.972559  0.035871  0.674309  1
  Fe  Fe419  1  0.706706  0.282453  0.644585  1
  Fe  Fe420  1  0.235488  0.789450  0.705264  1
  Fe  Fe421  1  0.639225  0.035871  0.674309  1
  Fe  Fe422  1  0.373373  0.282453  0.644585  1
  Fe  Fe423  1  0.305892  0.035871  0.674309  1
  Fe  Fe424  1  0.044622  0.603647  0.710293  1
  Fe  Fe425  1  0.187384  0.078780  0.645590  1
  Fe  Fe426  1  0.711289  0.603647  0.710293  1
  Fe  Fe427  1  0.118303  0.832441  0.675590  1
  Fe  Fe428  1  0.854050  0.078780  0.645590  1
  Fe  Fe429  1  0.377955  0.603647  0.710293  1
  Fe  Fe430  1  0.784969  0.832441  0.675590  1
  Fe  Fe431  1  0.520717  0.078780  0.645590  1
  Fe  Fe432  1  0.451636  0.832441  0.675590  1
  Fe  Fe433  1  0.954265  0.707745  0.662756  1
  Fe  Fe434  1  0.886712  0.463112  0.692873  1
  Fe  Fe435  1  0.620932  0.707745  0.662756  1
  Fe  Fe436  1  0.817891  0.216280  0.723226  1
  Fe  Fe437  1  0.553378  0.463112  0.692873  1
  Fe  Fe438  1  0.287598  0.707745  0.662756  1
  Fe  Fe439  1  0.484558  0.216280  0.723226  1
  Fe  Fe440  1  0.220045  0.463112  0.692873  1
  Fe  Fe441  1  0.151225  0.216280  0.723226  1
  Fe  Fe442  1  0.854164  0.673683  0.718734  1
  Fe  Fe443  1  0.989134  0.174665  0.657660  1
  Fe  Fe444  1  0.520831  0.673683  0.718734  1
  Fe  Fe445  1  0.920546  0.930000  0.688435  1
  Fe  Fe446  1  0.655801  0.174665  0.657660  1
  Fe  Fe447  1  0.187497  0.673683  0.718734  1
  Fe  Fe448  1  0.587212  0.930000  0.688435  1
  Fe  Fe449  1  0.322467  0.174665  0.657660  1
  Fe  Fe450  1  0.253879  0.930000  0.688435  1
  C  C451  1  0.850720  0.522199  0.274529  1
  C  C452  1  0.777361  0.278905  0.303598  1
  C  C453  1  0.517387  0.522199  0.274529  1
  C  C454  1  0.710798  0.030253  0.334388  1
  C  C455  1  0.444028  0.278905  0.303598  1
  C  C456  1  0.184053  0.522199  0.274529  1
  C  C457  1  0.377464  0.030253  0.334388  1
  C  C458  1  0.110695  0.278905  0.303598  1
  C  C459  1  0.044131  0.030253  0.334388  1
  C  C460  1  0.700466  0.803108  0.304103  1
  C  C461  1  0.632465  0.555312  0.333537  1
  C  C462  1  0.367133  0.803108  0.304103  1
  C  C463  1  0.767075  0.051803  0.273897  1
  C  C464  1  0.299132  0.555312  0.333537  1
  C  C465  1  0.033799  0.803108  0.304103  1
  C  C466  1  0.433742  0.051803  0.273897  1
  C  C467  1  0.965799  0.555312  0.333537  1
  C  C468  1  0.100408  0.051803  0.273897  1
  C  C469  1  0.922632  0.299178  0.302068  1
  C  C470  1  0.852925  0.053318  0.331290  1
  C  C471  1  0.589299  0.299178  0.302068  1
  C  C472  1  0.783833  0.808060  0.362304  1
  C  C473  1  0.519592  0.053318  0.331290  1
  C  C474  1  0.255966  0.299178  0.302068  1
  C  C475  1  0.450500  0.808060  0.362304  1
  C  C476  1  0.186258  0.053318  0.331290  1
  C  C477  1  0.117166  0.808060  0.362304  1
  C  C478  1  0.775299  0.577801  0.331168  1
  C  C479  1  0.704941  0.332848  0.362153  1
  C  C480  1  0.441966  0.577801  0.331168  1
  C  C481  1  0.843380  0.822909  0.301726  1
  C  C482  1  0.371608  0.332848  0.362153  1
  C  C483  1  0.108633  0.577801  0.331168  1
  C  C484  1  0.510047  0.822909  0.301726  1
  C  C485  1  0.038274  0.332848  0.362153  1
  C  C486  1  0.176713  0.822909  0.301726  1
  C  C487  1  0.641284  0.785516  0.364590  1
  C  C488  1  0.571821  0.540254  0.394933  1
  C  C489  1  0.307950  0.785516  0.364590  1
  C  C490  1  0.502732  0.294940  0.425345  1
  C  C491  1  0.238487  0.540254  0.394933  1
  C  C492  1  0.974617  0.785516  0.364590  1
  C  C493  1  0.169399  0.294940  0.425345  1
  C  C494  1  0.905154  0.540254  0.394933  1
  C  C495  1  0.836066  0.294940  0.425345  1
  C  C496  1  0.492748  0.064467  0.394586  1
  C  C497  1  0.423485  0.819184  0.424991  1
  C  C498  1  0.159414  0.064467  0.394586  1
  C  C499  1  0.562233  0.309838  0.364010  1
  C  C500  1  0.090152  0.819184  0.424991  1
  C  C501  1  0.826081  0.064467  0.394586  1
  C  C502  1  0.228899  0.309838  0.364010  1
  C  C503  1  0.756819  0.819184  0.424991  1
  C  C504  1  0.895566  0.309838  0.364010  1
  C  C505  1  0.714764  0.562240  0.392189  1
  C  C506  1  0.645416  0.317084  0.422613  1
  C  C507  1  0.381431  0.562240  0.392189  1
  C  C508  1  0.576309  0.071726  0.452896  1
  C  C509  1  0.312082  0.317084  0.422613  1
  C  C510  1  0.048098  0.562240  0.392189  1
  C  C511  1  0.242976  0.071726  0.452896  1
  C  C512  1  0.978749  0.317084  0.422613  1
  C  C513  1  0.909642  0.071726  0.452896  1
  C  C514  1  0.566411  0.841507  0.422226  1
  C  C515  1  0.497133  0.596103  0.452509  1
  C  C516  1  0.233077  0.841507  0.422226  1
  C  C517  1  0.635550  0.086733  0.391951  1
  C  C518  1  0.163799  0.596103  0.452509  1
  C  C519  1  0.899744  0.841507  0.422226  1
  C  C520  1  0.302216  0.086733  0.391951  1
  C  C521  1  0.830466  0.596103  0.452509  1
  C  C522  1  0.968883  0.086733  0.391951  1
  C  C523  1  0.433462  0.049594  0.455607  1
  C  C524  1  0.364300  0.804305  0.485961  1
  C  C525  1  0.100129  0.049594  0.455607  1
  C  C526  1  0.295113  0.558966  0.516255  1
  C  C527  1  0.030966  0.804305  0.485961  1
  C  C528  1  0.766795  0.049594  0.455607  1
  C  C529  1  0.961779  0.558966  0.516255  1
  C  C530  1  0.697633  0.804305  0.485961  1
  C  C531  1  0.628446  0.558966  0.516255  1
  C  C532  1  0.285056  0.328697  0.485595  1
  C  C533  1  0.215854  0.083454  0.515866  1
  C  C534  1  0.951723  0.328697  0.485595  1
  C  C535  1  0.354244  0.573934  0.455197  1
  C  C536  1  0.882521  0.083454  0.515866  1
  C  C537  1  0.618390  0.328697  0.485595  1
  C  C538  1  0.020911  0.573934  0.455197  1
  C  C539  1  0.549187  0.083454  0.515866  1
  C  C540  1  0.687577  0.573934  0.455197  1
  C  C541  1  0.507192  0.826420  0.483218  1
  C  C542  1  0.437990  0.581178  0.513489  1
  C  C543  1  0.173859  0.826420  0.483218  1
  C  C544  1  0.368802  0.335941  0.543887  1
  C  C545  1  0.104657  0.581178  0.513489  1
  C  C546  1  0.840525  0.826420  0.483218  1
  C  C547  1  0.035469  0.335941  0.543887  1
  C  C548  1  0.771323  0.581178  0.513489  1
  C  C549  1  0.702135  0.335941  0.543887  1
  C  C550  1  0.358746  0.105570  0.513122  1
  C  C551  1  0.289584  0.860280  0.543477  1
  C  C552  1  0.025413  0.105570  0.513122  1
  C  C553  1  0.427934  0.350908  0.482829  1
  C  C554  1  0.956251  0.860280  0.543477  1
  C  C555  1  0.692080  0.105570  0.513122  1
  C  C556  1  0.094600  0.350908  0.482829  1
  C  C557  1  0.622917  0.860280  0.543477  1
  C  C558  1  0.761267  0.350908  0.482829  1
  C  C559  1  0.225913  0.313772  0.546574  1
  C  C560  1  0.156635  0.068367  0.576858  1
  C  C561  1  0.892580  0.313772  0.546574  1
  C  C562  1  0.087496  0.823142  0.607133  1
  C  C563  1  0.823302  0.068367  0.576858  1
  C  C564  1  0.559247  0.313772  0.546574  1
  C  C565  1  0.754163  0.823142  0.607133  1
  C  C566  1  0.489969  0.068367  0.576858  1
  C  C567  1  0.420830  0.823142  0.607133  1
  C  C568  1  0.077630  0.592791  0.576471  1
  C  C569  1  0.008282  0.347634  0.606895  1
  C  C570  1  0.744297  0.592791  0.576471  1
  C  C571  1  0.146737  0.838148  0.546188  1
  C  C572  1  0.674948  0.347634  0.606895  1
  C  C573  1  0.410964  0.592791  0.576471  1
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