# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.85770938
_cell_length_b   14.20439718
_cell_length_c   51.83894019
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   115.10788680
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe540 C216'
_cell_volume   13240.4124594
_cell_formula_units_Z   108
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  0.739610  0.752858  0.283673  1
  Fe  Fe2  1  0.133057  0.175976  0.309997  1
  Fe  Fe3  1  0.072943  0.752858  0.283673  1
  Fe  Fe4  1  0.532785  0.600600  0.335404  1
  Fe  Fe5  1  0.466390  0.175976  0.309997  1
  Fe  Fe6  1  0.406276  0.752858  0.283673  1
  Fe  Fe7  1  0.866118  0.600600  0.335404  1
  Fe  Fe8  1  0.799723  0.175976  0.309997  1
  Fe  Fe9  1  0.199452  0.600600  0.335404  1
  Fe  Fe10  1  0.138605  0.419837  0.331723  1
  Fe  Fe11  1  0.345679  0.571115  0.279809  1
  Fe  Fe12  1  0.471938  0.419837  0.331723  1
  Fe  Fe13  1  0.739891  0.998022  0.306184  1
  Fe  Fe14  1  0.679012  0.571115  0.279809  1
  Fe  Fe15  1  0.805272  0.419837  0.331723  1
  Fe  Fe16  1  0.073224  0.998022  0.306184  1
  Fe  Fe17  1  0.012345  0.571115  0.279809  1
  Fe  Fe18  1  0.406557  0.998022  0.306184  1
  Fe  Fe19  1  0.054571  0.255681  0.323821  1
  Fe  Fe20  1  0.267478  0.396289  0.272110  1
  Fe  Fe21  1  0.387904  0.255681  0.323821  1
  Fe  Fe22  1  0.656887  0.831331  0.297626  1
  Fe  Fe23  1  0.600811  0.396289  0.272110  1
  Fe  Fe24  1  0.721237  0.255681  0.323821  1
  Fe  Fe25  1  0.990220  0.831331  0.297626  1
  Fe  Fe26  1  0.934144  0.396289  0.272110  1
  Fe  Fe27  1  0.323553  0.831331  0.297626  1
  Fe  Fe28  1  0.924270  0.211543  0.337971  1
  Fe  Fe29  1  0.128947  0.366026  0.285381  1
  Fe  Fe30  1  0.257603  0.211543  0.337971  1
  Fe  Fe31  1  0.526735  0.787586  0.311328  1
  Fe  Fe32  1  0.462280  0.366026  0.285381  1
  Fe  Fe33  1  0.590936  0.211543  0.337971  1
  Fe  Fe34  1  0.860068  0.787586  0.311328  1
  Fe  Fe35  1  0.795613  0.366026  0.285381  1
  Fe  Fe36  1  0.193401  0.787586  0.311328  1
  Fe  Fe37  1  0.947026  0.962783  0.277484  1
  Fe  Fe38  1  0.348249  0.386254  0.303683  1
  Fe  Fe39  1  0.280360  0.962783  0.277484  1
  Fe  Fe40  1  0.744354  0.808416  0.329079  1
  Fe  Fe41  1  0.681582  0.386254  0.303683  1
  Fe  Fe42  1  0.613693  0.962783  0.277484  1
  Fe  Fe43  1  0.077687  0.808416  0.329079  1
  Fe  Fe44  1  0.014916  0.386254  0.303683  1
  Fe  Fe45  1  0.411020  0.808416  0.329079  1
  Fe  Fe46  1  0.050830  0.076603  0.343135  1
  Fe  Fe47  1  0.254693  0.229412  0.291805  1
  Fe  Fe48  1  0.384163  0.076603  0.343135  1
  Fe  Fe49  1  0.653373  0.652590  0.317193  1
  Fe  Fe50  1  0.588027  0.229412  0.291805  1
  Fe  Fe51  1  0.717497  0.076603  0.343135  1
  Fe  Fe52  1  0.986706  0.652590  0.317193  1
  Fe  Fe53  1  0.921360  0.229412  0.291805  1
  Fe  Fe54  1  0.320039  0.652590  0.317193  1
  Fe  Fe55  1  0.880557  0.052784  0.319252  1
  Fe  Fe56  1  0.279309  0.476687  0.344478  1
  Fe  Fe57  1  0.213891  0.052784  0.319252  1
  Fe  Fe58  1  0.482975  0.628920  0.293224  1
  Fe  Fe59  1  0.612642  0.476687  0.344478  1
  Fe  Fe60  1  0.547224  0.052784  0.319252  1
  Fe  Fe61  1  0.816308  0.628920  0.293224  1
  Fe  Fe62  1  0.945975  0.476687  0.344478  1
  Fe  Fe63  1  0.149641  0.628920  0.293224  1
  Fe  Fe64  1  0.820291  0.094914  0.271826  1
  Fe  Fe65  1  0.220912  0.519315  0.296730  1
  Fe  Fe66  1  0.153624  0.094914  0.271826  1
  Fe  Fe67  1  0.617674  0.943220  0.323775  1
  Fe  Fe68  1  0.554245  0.519315  0.296730  1
  Fe  Fe69  1  0.486958  0.094914  0.271826  1
  Fe  Fe70  1  0.951007  0.943220  0.323775  1
  Fe  Fe71  1  0.887578  0.519315  0.296730  1
  Fe  Fe72  1  0.284341  0.943220  0.323775  1
  Fe  Fe73  1  0.819138  0.918940  0.292370  1
  Fe  Fe74  1  0.217083  0.342321  0.318101  1
  Fe  Fe75  1  0.152472  0.918940  0.292370  1
  Fe  Fe76  1  0.614530  0.764935  0.343570  1
  Fe  Fe77  1  0.550416  0.342321  0.318101  1
  Fe  Fe78  1  0.485805  0.918940  0.292370  1
  Fe  Fe79  1  0.947863  0.764935  0.343570  1
  Fe  Fe80  1  0.883749  0.342321  0.318101  1
  Fe  Fe81  1  0.281196  0.764935  0.343570  1
  Fe  Fe82  1  0.992792  0.123880  0.296259  1
  Fe  Fe83  1  0.389701  0.543626  0.322406  1
  Fe  Fe84  1  0.326126  0.123880  0.296259  1
  Fe  Fe85  1  0.602149  0.681879  0.272224  1
  Fe  Fe86  1  0.723034  0.543626  0.322406  1
  Fe  Fe87  1  0.659459  0.123880  0.296259  1
  Fe  Fe88  1  0.935482  0.681879  0.272224  1
  Fe  Fe89  1  0.056367  0.543626  0.322406  1
  Fe  Fe90  1  0.268816  0.681879  0.272224  1
  Fe  Fe91  1  0.929321  0.023241  0.361015  1
  Fe  Fe92  1  0.327508  0.447374  0.386667  1
  Fe  Fe93  1  0.262655  0.023241  0.361015  1
  Fe  Fe94  1  0.724876  0.870759  0.412290  1
  Fe  Fe95  1  0.660841  0.447374  0.386667  1
  Fe  Fe96  1  0.595988  0.023241  0.361015  1
  Fe  Fe97  1  0.058209  0.870759  0.412290  1
  Fe  Fe98  1  0.994175  0.447374  0.386667  1
  Fe  Fe99  1  0.391542  0.870759  0.412290  1
  Fe  Fe100  1  0.330659  0.691381  0.408244  1
  Fe  Fe101  1  0.535035  0.843732  0.356955  1
  Fe  Fe102  1  0.663992  0.691381  0.408244  1
  Fe  Fe103  1  0.932857  0.267750  0.382750  1
  Fe  Fe104  1  0.868369  0.843732  0.356955  1
  Fe  Fe105  1  0.997325  0.691381  0.408244  1
  Fe  Fe106  1  0.266190  0.267750  0.382750  1
  Fe  Fe107  1  0.201702  0.843732  0.356955  1
  Fe  Fe108  1  0.599523  0.267750  0.382750  1
  Fe  Fe109  1  0.248056  0.526018  0.400081  1
  Fe  Fe110  1  0.452911  0.678368  0.348797  1
  Fe  Fe111  1  0.581389  0.526018  0.400081  1
  Fe  Fe112  1  0.850062  0.102246  0.374551  1
  Fe  Fe113  1  0.786245  0.678368  0.348797  1
  Fe  Fe114  1  0.914722  0.526018  0.400081  1
  Fe  Fe115  1  0.183395  0.102246  0.374551  1
  Fe  Fe116  1  0.119578  0.678368  0.348797  1
  Fe  Fe117  1  0.516728  0.102246  0.374551  1
  Fe  Fe118  1  0.117705  0.482650  0.414511  1
  Fe  Fe119  1  0.322412  0.635400  0.363230  1
  Fe  Fe120  1  0.451039  0.482650  0.414511  1
  Fe  Fe121  1  0.719741  0.058682  0.388994  1
  Fe  Fe122  1  0.655745  0.635400  0.363230  1
  Fe  Fe123  1  0.784372  0.482650  0.414511  1
  Fe  Fe124  1  0.053074  0.058682  0.388994  1
  Fe  Fe125  1  0.989079  0.635400  0.363230  1
  Fe  Fe126  1  0.386408  0.058682  0.388994  1
  Fe  Fe127  1  0.142724  0.232797  0.354916  1
  Fe  Fe128  1  0.540374  0.655963  0.380473  1
  Fe  Fe129  1  0.476057  0.232797  0.354916  1
  Fe  Fe130  1  0.938038  0.079649  0.406075  1
  Fe  Fe131  1  0.873707  0.655963  0.380473  1
  Fe  Fe132  1  0.809391  0.232797  0.354916  1
  Fe  Fe133  1  0.271371  0.079649  0.406075  1
  Fe  Fe134  1  0.207040  0.655963  0.380473  1
  Fe  Fe135  1  0.604704  0.079649  0.406075  1
  Fe  Fe136  1  0.244452  0.347724  0.419980  1
  Fe  Fe137  1  0.449193  0.500602  0.368660  1
  Fe  Fe138  1  0.577785  0.347724  0.419980  1
  Fe  Fe139  1  0.846491  0.923835  0.394321  1
  Fe  Fe140  1  0.782526  0.500602  0.368660  1
  Fe  Fe141  1  0.911119  0.347724  0.419980  1
  Fe  Fe142  1  0.179825  0.923835  0.394321  1
  Fe  Fe143  1  0.115860  0.500602  0.368660  1
  Fe  Fe144  1  0.513158  0.923835  0.394321  1
  Fe  Fe145  1  0.074476  0.324023  0.395973  1
  Fe  Fe146  1  0.472163  0.747703  0.421435  1
  Fe  Fe147  1  0.407810  0.324023  0.395973  1
  Fe  Fe148  1  0.676618  0.900267  0.370189  1
  Fe  Fe149  1  0.805496  0.747703  0.421435  1
  Fe  Fe150  1  0.741143  0.324023  0.395973  1
  Fe  Fe151  1  0.009951  0.900267  0.370189  1
  Fe  Fe152  1  0.138830  0.747703  0.421435  1
  Fe  Fe153  1  0.343284  0.900267  0.370189  1
  Fe  Fe154  1  0.016038  0.367344  0.349387  1
  Fe  Fe155  1  0.413604  0.790775  0.374987  1
  Fe  Fe156  1  0.349371  0.367344  0.349387  1
  Fe  Fe157  1  0.811305  0.214541  0.400724  1
  Fe  Fe158  1  0.746937  0.790775  0.374987  1
  Fe  Fe159  1  0.682705  0.367344  0.349387  1
  Fe  Fe160  1  0.144638  0.214541  0.400724  1
  Fe  Fe161  1  0.080271  0.790775  0.374987  1
  Fe  Fe162  1  0.477971  0.214541  0.400724  1
  Fe  Fe163  1  0.012294  0.188812  0.369330  1
  Fe  Fe164  1  0.410217  0.612662  0.394904  1
  Fe  Fe165  1  0.345627  0.188812  0.369330  1
  Fe  Fe166  1  0.807803  0.036229  0.420534  1
  Fe  Fe167  1  0.743550  0.612662  0.394904  1
  Fe  Fe168  1  0.678961  0.188812  0.369330  1
  Fe  Fe169  1  0.141136  0.036229  0.420534  1
  Fe  Fe170  1  0.076883  0.612662  0.394904  1
  Fe  Fe171  1  0.474469  0.036229  0.420534  1
  Fe  Fe172  1  0.186150  0.391184  0.373607  1
  Fe  Fe173  1  0.583554  0.814456  0.399142  1
  Fe  Fe174  1  0.519483  0.391184  0.373607  1
  Fe  Fe175  1  0.787792  0.967460  0.347874  1
  Fe  Fe176  1  0.916888  0.814456  0.399142  1
  Fe  Fe177  1  0.852816  0.391184  0.373607  1
  Fe  Fe178  1  0.121125  0.967460  0.347874  1
  Fe  Fe179  1  0.250221  0.814456  0.399142  1
  Fe  Fe180  1  0.454459  0.967460  0.347874  1
  Fe  Fe181  1  0.122767  0.294749  0.437938  1
  Fe  Fe182  1  0.520373  0.718341  0.463561  1
  Fe  Fe183  1  0.456100  0.294749  0.437938  1
  Fe  Fe184  1  0.918047  0.142098  0.489185  1
  Fe  Fe185  1  0.853706  0.718341  0.463561  1
  Fe  Fe186  1  0.789434  0.294749  0.437938  1
  Fe  Fe187  1  0.251380  0.142098  0.489185  1
  Fe  Fe188  1  0.187039  0.718341  0.463561  1
  Fe  Fe189  1  0.584714  0.142098  0.489185  1
  Fe  Fe190  1  0.523807  0.962448  0.485187  1
  Fe  Fe191  1  0.728443  0.115020  0.433959  1
  Fe  Fe192  1  0.857141  0.962448  0.485187  1
  Fe  Fe193  1  0.126173  0.538735  0.459547  1
  Fe  Fe194  1  0.061776  0.115020  0.433959  1
  Fe  Fe195  1  0.190474  0.962448  0.485187  1
  Fe  Fe196  1  0.459506  0.538735  0.459547  1
  Fe  Fe197  1  0.395109  0.115020  0.433959  1
  Fe  Fe198  1  0.792839  0.538735  0.459547  1
  Fe  Fe199  1  0.440951  0.797066  0.476947  1
  Fe  Fe200  1  0.645453  0.949612  0.425672  1
  Fe  Fe201  1  0.774284  0.797066  0.476947  1
  Fe  Fe202  1  0.043325  0.373350  0.451333  1
  Fe  Fe203  1  0.978787  0.949612  0.425672  1
  Fe  Fe204  1  0.107618  0.797066  0.476947  1
  Fe  Fe205  1  0.376659  0.373350  0.451333  1
  Fe  Fe206  1  0.312120  0.949612  0.425672  1
  Fe  Fe207  1  0.709992  0.373350  0.451333  1
  Fe  Fe208  1  0.310677  0.753690  0.491405  1
  Fe  Fe209  1  0.515267  0.906203  0.440152  1
  Fe  Fe210  1  0.644010  0.753690  0.491405  1
  Fe  Fe211  1  0.913026  0.329983  0.465781  1
  Fe  Fe212  1  0.848601  0.906203  0.440152  1
  Fe  Fe213  1  0.977344  0.753690  0.491405  1
  Fe  Fe214  1  0.246359  0.329983  0.465781  1
  Fe  Fe215  1  0.181934  0.906203  0.440152  1
  Fe  Fe216  1  0.579692  0.329983  0.465781  1
  Fe  Fe217  1  0.335860  0.503477  0.431723  1
  Fe  Fe218  1  0.733496  0.927073  0.457332  1
  Fe  Fe219  1  0.669194  0.503477  0.431723  1
  Fe  Fe220  1  0.131222  0.350874  0.482973  1
  Fe  Fe221  1  0.066830  0.927073  0.457332  1
  Fe  Fe222  1  0.002527  0.503477  0.431723  1
  Fe  Fe223  1  0.464555  0.350874  0.482973  1
  Fe  Fe224  1  0.400163  0.927073  0.457332  1
  Fe  Fe225  1  0.797889  0.350874  0.482973  1
  Fe  Fe226  1  0.437438  0.618824  0.496839  1
  Fe  Fe227  1  0.642042  0.771391  0.445596  1
  Fe  Fe228  1  0.770771  0.618824  0.496839  1
  Fe  Fe229  1  0.039765  0.195066  0.471208  1
  Fe  Fe230  1  0.975375  0.771391  0.445596  1
  Fe  Fe231  1  0.104105  0.618824  0.496839  1
  Fe  Fe232  1  0.373098  0.195066  0.471208  1
  Fe  Fe233  1  0.308708  0.771391  0.445596  1
  Fe  Fe234  1  0.706431  0.195066  0.471208  1
  Fe  Fe235  1  0.267577  0.595131  0.472704  1
  Fe  Fe236  1  0.665220  0.018852  0.498332  1
  Fe  Fe237  1  0.600911  0.595131  0.472704  1
  Fe  Fe238  1  0.869887  0.171399  0.447107  1
  Fe  Fe239  1  0.998553  0.018852  0.498332  1
  Fe  Fe240  1  0.934244  0.595131  0.472704  1
  Fe  Fe241  1  0.203221  0.171399  0.447107  1
  Fe  Fe242  1  0.331887  0.018852  0.498332  1
  Fe  Fe243  1  0.536554  0.171399  0.447107  1
  Fe  Fe244  1  0.209098  0.638322  0.426253  1
  Fe  Fe245  1  0.606738  0.061965  0.451928  1
  Fe  Fe246  1  0.542432  0.638322  0.426253  1
  Fe  Fe247  1  0.004467  0.485745  0.477527  1
  Fe  Fe248  1  0.940072  0.061965  0.451928  1
  Fe  Fe249  1  0.875765  0.638322  0.426253  1
  Fe  Fe250  1  0.337800  0.485745  0.477527  1
  Fe  Fe251  1  0.273405  0.061965  0.451928  1
  Fe  Fe252  1  0.671133  0.485745  0.477527  1
  Fe  Fe253  1  0.205666  0.460198  0.446161  1
  Fe  Fe254  1  0.603176  0.883689  0.471786  1
  Fe  Fe255  1  0.538999  0.460198  0.446161  1
  Fe  Fe256  1  0.000933  0.307529  0.497412  1
  Fe  Fe257  1  0.936509  0.883689  0.471786  1
  Fe  Fe258  1  0.872333  0.460198  0.446161  1
  Fe  Fe259  1  0.334267  0.307529  0.497412  1
  Fe  Fe260  1  0.269843  0.883689  0.471786  1
  Fe  Fe261  1  0.667600  0.307529  0.497412  1
  Fe  Fe262  1  0.378999  0.661952  0.450416  1
  Fe  Fe263  1  0.776606  0.085711  0.476028  1
  Fe  Fe264  1  0.712332  0.661952  0.450416  1
  Fe  Fe265  1  0.981253  0.238384  0.424790  1
  Fe  Fe266  1  0.109939  0.085711  0.476028  1
  Fe  Fe267  1  0.045665  0.661952  0.450416  1
  Fe  Fe268  1  0.314587  0.238384  0.424790  1
  Fe  Fe269  1  0.443272  0.085711  0.476028  1
  Fe  Fe270  1  0.647920  0.238384  0.424790  1
  Fe  Fe271  1  0.315752  0.565816  0.514813  1
  Fe  Fe272  1  0.713387  0.989530  0.540453  1
  Fe  Fe273  1  0.649086  0.565816  0.514813  1
  Fe  Fe274  1  0.111117  0.413245  0.566041  1
  Fe  Fe275  1  0.046720  0.989530  0.540453  1
  Fe  Fe276  1  0.982419  0.565816  0.514813  1
  Fe  Fe277  1  0.444450  0.413245  0.566041  1
  Fe  Fe278  1  0.380054  0.989530  0.540453  1
  Fe  Fe279  1  0.777784  0.413245  0.566041  1
  Fe  Fe280  1  0.716792  0.233516  0.562062  1
  Fe  Fe281  1  0.921513  0.386167  0.510815  1
  Fe  Fe282  1  0.050126  0.233516  0.562062  1
  Fe  Fe283  1  0.319187  0.809924  0.536439  1
  Fe  Fe284  1  0.254846  0.386167  0.510815  1
  Fe  Fe285  1  0.383459  0.233516  0.562062  1
  Fe  Fe286  1  0.652520  0.809924  0.536439  1
  Fe  Fe287  1  0.588179  0.386167  0.510815  1
  Fe  Fe288  1  0.985853  0.809924  0.536439  1
  Fe  Fe289  1  0.633893  0.068067  0.553839  1
  Fe  Fe290  1  0.838626  0.220736  0.502588  1
  Fe  Fe291  1  0.967227  0.068067  0.553839  1
  Fe  Fe292  1  0.236384  0.644575  0.528214  1
  Fe  Fe293  1  0.171960  0.220736  0.502588  1
  Fe  Fe294  1  0.300560  0.068067  0.553839  1
  Fe  Fe295  1  0.569717  0.644575  0.528214  1
  Fe  Fe296  1  0.505293  0.220736  0.502588  1
  Fe  Fe297  1  0.903050  0.644575  0.528214  1
  Fe  Fe298  1  0.503699  0.024788  0.568277  1
  Fe  Fe299  1  0.708338  0.177390  0.517027  1
  Fe  Fe300  1  0.837033  0.024788  0.568277  1
  Fe  Fe301  1  0.106063  0.601192  0.542668  1
  Fe  Fe302  1  0.041671  0.177390  0.517027  1
  Fe  Fe303  1  0.170366  0.024788  0.568277  1
  Fe  Fe304  1  0.439397  0.601192  0.542668  1
  Fe  Fe305  1  0.375004  0.177390  0.517027  1
  Fe  Fe306  1  0.772730  0.601192  0.542668  1
  Fe  Fe307  1  0.528883  0.774575  0.508595  1
  Fe  Fe308  1  0.926534  0.198281  0.534219  1
  Fe  Fe309  1  0.862216  0.774575  0.508595  1
  Fe  Fe310  1  0.324292  0.622061  0.559848  1
  Fe  Fe311  1  0.259867  0.198281  0.534219  1
  Fe  Fe312  1  0.195549  0.774575  0.508595  1
  Fe  Fe313  1  0.657626  0.622061  0.559848  1
  Fe  Fe314  1  0.593201  0.198281  0.534219  1
  Fe  Fe315  1  0.990959  0.622061  0.559848  1
  Fe  Fe316  1  0.630461  0.889942  0.573747  1
  Fe  Fe317  1  0.835093  0.042520  0.522473  1
  Fe  Fe318  1  0.963795  0.889942  0.573747  1
  Fe  Fe319  1  0.232821  0.466300  0.548072  1
  Fe  Fe320  1  0.168426  0.042520  0.522473  1
  Fe  Fe321  1  0.297128  0.889942  0.573747  1
  Fe  Fe322  1  0.566155  0.466300  0.548072  1
  Fe  Fe323  1  0.501760  0.042520  0.522473  1
  Fe  Fe324  1  0.899488  0.466300  0.548072  1
  Fe  Fe325  1  0.460561  0.866313  0.549584  1
  Fe  Fe326  1  0.858306  0.289881  0.575210  1
  Fe  Fe327  1  0.793894  0.866313  0.549584  1
  Fe  Fe328  1  0.062954  0.442554  0.523972  1
  Fe  Fe329  1  0.191640  0.289881  0.575210  1
  Fe  Fe330  1  0.127228  0.866313  0.549584  1
  Fe  Fe331  1  0.396287  0.442554  0.523972  1
  Fe  Fe332  1  0.524973  0.289881  0.575210  1
  Fe  Fe333  1  0.729621  0.442554  0.523972  1
  Fe  Fe334  1  0.402122  0.909441  0.503161  1
  Fe  Fe335  1  0.799795  0.333199  0.528792  1
  Fe  Fe336  1  0.735455  0.909441  0.503161  1
  Fe  Fe337  1  0.197518  0.756874  0.554404  1
  Fe  Fe338  1  0.133128  0.333199  0.528792  1
  Fe  Fe339  1  0.068788  0.909441  0.503161  1
  Fe  Fe340  1  0.530851  0.756874  0.554404  1
  Fe  Fe341  1  0.466462  0.333199  0.528792  1
  Fe  Fe342  1  0.864185  0.756874  0.554404  1
  Fe  Fe343  1  0.398608  0.731199  0.523053  1
  Fe  Fe344  1  0.796234  0.154915  0.548667  1
  Fe  Fe345  1  0.731942  0.731199  0.523053  1
  Fe  Fe346  1  0.194106  0.578653  0.574328  1
  Fe  Fe347  1  0.129568  0.154915  0.548667  1
  Fe  Fe348  1  0.065275  0.731199  0.523053  1
  Fe  Fe349  1  0.527440  0.578653  0.574328  1
  Fe  Fe350  1  0.462901  0.154915  0.548667  1
  Fe  Fe351  1  0.860773  0.578653  0.574328  1
  Fe  Fe352  1  0.571982  0.933134  0.527296  1
  Fe  Fe353  1  0.969672  0.356865  0.552893  1
  Fe  Fe354  1  0.905316  0.933134  0.527296  1
  Fe  Fe355  1  0.174340  0.509413  0.501668  1
  Fe  Fe356  1  0.303006  0.356865  0.552893  1
  Fe  Fe357  1  0.238649  0.933134  0.527296  1
  Fe  Fe358  1  0.507673  0.509413  0.501668  1
  Fe  Fe359  1  0.636339  0.356865  0.552893  1
  Fe  Fe360  1  0.841006  0.509413  0.501668  1
  Fe  Fe361  1  0.508901  0.836884  0.591756  1
  Fe  Fe362  1  0.906703  0.260515  0.617250  1
  Fe  Fe363  1  0.842234  0.836884  0.591756  1
  Fe  Fe364  1  0.304524  0.684533  0.643045  1
  Fe  Fe365  1  0.240036  0.260515  0.617250  1
  Fe  Fe366  1  0.175568  0.836884  0.591756  1
  Fe  Fe367  1  0.637857  0.684533  0.643045  1
  Fe  Fe368  1  0.573369  0.260515  0.617250  1
  Fe  Fe369  1  0.971191  0.684533  0.643045  1
  Fe  Fe370  1  0.910238  0.505024  0.638985  1
  Fe  Fe371  1  0.114684  0.657505  0.587710  1
  Fe  Fe372  1  0.243572  0.505024  0.638985  1
  Fe  Fe373  1  0.512052  0.080890  0.613333  1
  Fe  Fe374  1  0.448017  0.657505  0.587710  1
  Fe  Fe375  1  0.576905  0.505024  0.638985  1
  Fe  Fe376  1  0.845385  0.080890  0.613333  1
  Fe  Fe377  1  0.781351  0.657505  0.587710  1
  Fe  Fe378  1  0.178718  0.080890  0.613333  1
  Fe  Fe379  1  0.827266  0.339453  0.630670  1
  Fe  Fe380  1  0.031757  0.492035  0.579466  1
  Fe  Fe381  1  0.160599  0.339453  0.630670  1
  Fe  Fe382  1  0.429343  0.915602  0.605096  1
  Fe  Fe383  1  0.365090  0.492035  0.579466  1
  Fe  Fe384  1  0.493932  0.339453  0.630670  1
  Fe  Fe385  1  0.762676  0.915602  0.605096  1
  Fe  Fe386  1  0.698423  0.492035  0.579466  1
  Fe  Fe387  1  0.096010  0.915602  0.605096  1
  Fe  Fe388  1  0.696836  0.295467  0.645084  1
  Fe  Fe389  1  0.901522  0.448615  0.593925  1
  Fe  Fe390  1  0.030169  0.295467  0.645084  1
  Fe  Fe391  1  0.299186  0.872301  0.619527  1
  Fe  Fe392  1  0.234855  0.448615  0.593925  1
  Fe  Fe393  1  0.363502  0.295467  0.645084  1
  Fe  Fe394  1  0.632519  0.872301  0.619527  1
  Fe  Fe395  1  0.568189  0.448615  0.593925  1
  Fe  Fe396  1  0.965853  0.872301  0.619527  1
  Fe  Fe397  1  0.721854  0.045615  0.585489  1
  Fe  Fe398  1  0.119819  0.469582  0.611006  1
  Fe  Fe399  1  0.055188  0.045615  0.585489  1
  Fe  Fe400  1  0.517148  0.892865  0.636770  1
  Fe  Fe401  1  0.453152  0.469582  0.611006  1
  Fe  Fe402  1  0.388521  0.045615  0.585489  1
  Fe  Fe403  1  0.850481  0.892865  0.636770  1
  Fe  Fe404  1  0.786485  0.469582  0.611006  1
  Fe  Fe405  1  0.183814  0.892865  0.636770  1
  Fe  Fe406  1  0.823522  0.160921  0.650613  1
  Fe  Fe407  1  0.028255  0.313724  0.599276  1
  Fe  Fe408  1  0.156855  0.160921  0.650613  1
  Fe  Fe409  1  0.425956  0.737490  0.625013  1
  Fe  Fe410  1  0.361588  0.313724  0.599276  1
  Fe  Fe411  1  0.490188  0.160921  0.650613  1
  Fe  Fe412  1  0.759289  0.737490  0.625013  1
  Fe  Fe413  1  0.694922  0.313724  0.599276  1
  Fe  Fe414  1  0.092622  0.737490  0.625013  1
  Fe  Fe415  1  0.653410  0.137080  0.626393  1
  Fe  Fe416  1  0.051767  0.560805  0.652126  1
  Fe  Fe417  1  0.986743  0.137080  0.626393  1
  Fe  Fe418  1  0.256005  0.713809  0.600858  1
  Fe  Fe419  1  0.385101  0.560805  0.652126  1
  Fe  Fe420  1  0.320077  0.137080  0.626393  1
  Fe  Fe421  1  0.589339  0.713809  0.600858  1
  Fe  Fe422  1  0.718434  0.560805  0.652126  1
  Fe  Fe423  1  0.922672  0.713809  0.600858  1
  Fe  Fe424  1  0.595108  0.180541  0.580020  1
  Fe  Fe425  1  0.993068  0.604430  0.605679  1
  Fe  Fe426  1  0.928441  0.180541  0.580020  1
  Fe  Fe427  1  0.390367  0.027662  0.631340  1
  Fe  Fe428  1  0.326402  0.604430  0.605679  1
  Fe  Fe429  1  0.261774  0.180541  0.580020  1
  Fe  Fe430  1  0.723700  0.027662  0.631340  1
  Fe  Fe431  1  0.659735  0.604430  0.605679  1
  Fe  Fe432  1  0.057033  0.027662  0.631340  1
  Fe  Fe433  1  0.591504  0.002246  0.599919  1
  Fe  Fe434  1  0.989498  0.426018  0.625449  1
  Fe  Fe435  1  0.924837  0.002246  0.599919  1
  Fe  Fe436  1  0.386648  0.849896  0.651203  1
  Fe  Fe437  1  0.322831  0.426018  0.625449  1
  Fe  Fe438  1  0.258170  0.002246  0.599919  1
  Fe  Fe439  1  0.719982  0.849896  0.651203  1
  Fe  Fe440  1  0.656165  0.426018  0.625449  1
  Fe  Fe441  1  0.053315  0.849896  0.651203  1
  Fe  Fe442  1  0.765083  0.204242  0.604027  1
  Fe  Fe443  1  0.162942  0.627998  0.629811  1
  Fe  Fe444  1  0.098416  0.204242  0.604027  1
  Fe  Fe445  1  0.367397  0.780562  0.578565  1
  Fe  Fe446  1  0.496275  0.627998  0.629811  1
  Fe  Fe447  1  0.431750  0.204242  0.604027  1
  Fe  Fe448  1  0.700730  0.780562  0.578565  1
  Fe  Fe449  1  0.829608  0.627998  0.629811  1
  Fe  Fe450  1  0.034063  0.780562  0.578565  1
  Fe  Fe451  1  0.700955  0.108428  0.668277  1
  Fe  Fe452  1  0.099669  0.530243  0.693816  1
  Fe  Fe453  1  0.034288  0.108428  0.668277  1
  Fe  Fe454  1  0.493881  0.957150  0.720191  1
  Fe  Fe455  1  0.433002  0.530243  0.693816  1
  Fe  Fe456  1  0.367621  0.108428  0.668277  1
  Fe  Fe457  1  0.827214  0.957150  0.720191  1
  Fe  Fe458  1  0.766335  0.530243  0.693816  1
  Fe  Fe459  1  0.160548  0.957150  0.720191  1
  Fe  Fe460  1  0.099950  0.775406  0.716327  1
  Fe  Fe461  1  0.306775  0.927665  0.664596  1
  Fe  Fe462  1  0.433283  0.775406  0.716327  1
  Fe  Fe463  1  0.706503  0.352289  0.690003  1
  Fe  Fe464  1  0.640108  0.927665  0.664596  1
  Fe  Fe465  1  0.766617  0.775406  0.716327  1
  Fe  Fe466  1  0.039836  0.352289  0.690003  1
  Fe  Fe467  1  0.973441  0.927665  0.664596  1
  Fe  Fe468  1  0.373169  0.352289  0.690003  1
  Fe  Fe469  1  0.020421  0.609324  0.707630  1
  Fe  Fe470  1  0.225030  0.763330  0.656430  1
  Fe  Fe471  1  0.353755  0.609324  0.707630  1
  Fe  Fe472  1  0.622477  0.185944  0.681899  1
  Fe  Fe473  1  0.558363  0.763330  0.656430  1
  Fe  Fe474  1  0.687088  0.609324  0.707630  1
  Fe  Fe475  1  0.955810  0.185944  0.681899  1
  Fe  Fe476  1  0.891696  0.763330  0.656430  1
  Fe  Fe477  1  0.289144  0.185944  0.681899  1
  Fe  Fe478  1  0.892533  0.565481  0.722516  1
  Fe  Fe479  1  0.095206  0.719848  0.670921  1
  Fe  Fe480  1  0.225867  0.565481  0.722516  1
  Fe  Fe481  1  0.491311  0.142011  0.696317  1
  Fe  Fe482  1  0.428539  0.719848  0.670921  1
  Fe  Fe483  1  0.559200  0.565481  0.722516  1
  Fe  Fe484  1  0.824644  0.142011  0.696317  1
  Fe  Fe485  1  0.761873  0.719848  0.670921  1
  Fe  Fe486  1  0.157977  0.142011  0.696317  1
  Fe  Fe487  1  0.915290  0.316721  0.662029  1
  Fe  Fe488  1  0.312825  0.740678  0.688672  1
  Fe  Fe489  1  0.248623  0.316721  0.662029  1
  Fe  Fe490  1  0.710613  0.162238  0.714619  1
  Fe  Fe491  1  0.646158  0.740678  0.688672  1
  Fe  Fe492  1  0.581957  0.316721  0.662029  1
  Fe  Fe493  1  0.043946  0.162238  0.714619  1
  Fe  Fe494  1  0.979492  0.740678  0.688672  1
  Fe  Fe495  1  0.377280  0.162238  0.714619  1
  Fe  Fe496  1  0.019268  0.433351  0.728174  1
  Fe  Fe497  1  0.221885  0.585045  0.676225  1
  Fe  Fe498  1  0.352602  0.433351  0.728174  1
  Fe  Fe499  1  0.618648  0.008950  0.703270  1
  Fe  Fe500  1  0.555219  0.585045  0.676225  1
  Fe  Fe501  1  0.685935  0.433351  0.728174  1
  Fe  Fe502  1  0.951981  0.008950  0.703270  1
  Fe  Fe503  1  0.888552  0.585045  0.676225  1
  Fe  Fe504  1  0.285315  0.008950  0.703270  1
  Fe  Fe505  1  0.846767  0.404384  0.703741  1
  Fe  Fe506  1  0.237411  0.846385  0.727776  1
  Fe  Fe507  1  0.180101  0.404384  0.703741  1
  Fe  Fe508  1  0.449859  0.984639  0.677594  1
  Fe  Fe509  1  0.570744  0.846385  0.727776  1
  Fe  Fe510  1  0.513434  0.404384  0.703741  1
  Fe  Fe511  1  0.783192  0.984639  0.677594  1
  Fe  Fe512  1  0.904077  0.846385  0.727776  1
  Fe  Fe513  1  0.116525  0.984639  0.677594  1
  Fe  Fe514  1  0.788730  0.451662  0.656865  1
  Fe  Fe515  1  0.186187  0.875675  0.682807  1
  Fe  Fe516  1  0.122063  0.451662  0.656865  1
  Fe  Fe517  1  0.584866  0.298852  0.708195  1
  Fe  Fe518  1  0.519520  0.875675  0.682807  1
  Fe  Fe519  1  0.455396  0.451662  0.656865  1
  Fe  Fe520  1  0.918199  0.298852  0.708195  1
  Fe  Fe521  1  0.852854  0.875675  0.682807  1
  Fe  Fe522  1  0.251533  0.298852  0.708195  1
  Fe  Fe523  1  0.784989  0.272584  0.676179  1
  Fe  Fe524  1  0.182673  0.696934  0.702374  1
  Fe  Fe525  1  0.118322  0.272584  0.676179  1
  Fe  Fe526  1  0.572082  0.131975  0.727890  1
  Fe  Fe527  1  0.516006  0.696934  0.702374  1
  Fe  Fe528  1  0.451656  0.272584  0.676179  1
  Fe  Fe529  1  0.905415  0.131975  0.727890  1
  Fe  Fe530  1  0.849339  0.696934  0.702374  1
  Fe  Fe531  1  0.238749  0.131975  0.727890  1
  Fe  Fe532  1  0.959002  0.475480  0.680748  1
  Fe  Fe533  1  0.356585  0.899345  0.706776  1
  Fe  Fe534  1  0.292335  0.475480  0.680748  1
  Fe  Fe535  1  0.560251  0.051577  0.655522  1
  Fe  Fe536  1  0.689918  0.899345  0.706776  1
  Fe  Fe537  1  0.625669  0.475480  0.680748  1
  Fe  Fe538  1  0.893584  0.051577  0.655522  1
  Fe  Fe539  1  0.023252  0.899345  0.706776  1
  Fe  Fe540  1  0.226918  0.051577  0.655522  1
  C  C541  1  0.976925  0.125596  0.334747  1
  C  C542  1  0.180649  0.278474  0.283783  1
  C  C543  1  0.310258  0.125596  0.334747  1
  C  C544  1  0.579404  0.701408  0.308719  1
  C  C545  1  0.513983  0.278474  0.283783  1
  C  C546  1  0.643592  0.125596  0.334747  1
  C  C547  1  0.912738  0.701408  0.308719  1
  C  C548  1  0.847316  0.278474  0.283783  1
  C  C549  1  0.246071  0.701408  0.308719  1
  C  C550  1  0.846686  0.907728  0.327387  1
  C  C551  1  0.049872  0.060797  0.276732  1
  C  C552  1  0.180020  0.907728  0.327387  1
  C  C553  1  0.450763  0.485128  0.302332  1
  C  C554  1  0.383206  0.060797  0.276732  1
  C  C555  1  0.513353  0.907728  0.327387  1
  C  C556  1  0.784096  0.485128  0.302332  1
  C  C557  1  0.716539  0.060797  0.276732  1
  C  C558  1  0.117430  0.485128  0.302332  1
  C  C559  1  0.026443  0.269613  0.289054  1
  C  C560  1  0.424493  0.688427  0.313828  1
  C  C561  1  0.359776  0.269613  0.289054  1
  C  C562  1  0.821882  0.112400  0.339556  1
  C  C563  1  0.757826  0.688427  0.313828  1
  C  C564  1  0.693110  0.269613  0.289054  1
  C  C565  1  0.155215  0.112400  0.339556  1
  C  C566  1  0.091159  0.688427  0.313828  1
  C  C567  1  0.488549  0.112400  0.339556  1
  C  C568  1  0.895585  0.050062  0.281423  1
  C  C569  1  0.294405  0.470866  0.306141  1
  C  C570  1  0.228918  0.050062  0.281423  1
  C  C571  1  0.691755  0.894502  0.332142  1
  C  C572  1  0.627739  0.470866  0.306141  1
  C  C573  1  0.562252  0.050062  0.281423  1
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