# generated using pymatgen
data_Fe7C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.81348428
_cell_length_b   21.78715033
_cell_length_c   47.68625974
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.75575346
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe7C3
_chemical_formula_sum   'Fe560 C240'
_cell_volume   14312.1306496
_cell_formula_units_Z   80
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  0.529308  0.434623  0.359703  1
  Fe  Fe2  1  0.029308  0.934623  0.359703  1
  Fe  Fe3  1  0.084400  0.455409  0.314611  1
  Fe  Fe4  1  0.584400  0.955409  0.314611  1
  Fe  Fe5  1  0.399280  0.512822  0.301722  1
  Fe  Fe6  1  0.899280  0.012822  0.301722  1
  Fe  Fe7  1  0.854137  0.489754  0.347371  1
  Fe  Fe8  1  0.354137  0.989754  0.347371  1
  Fe  Fe9  1  0.357572  0.763963  0.294894  1
  Fe  Fe10  1  0.857572  0.263963  0.294894  1
  Fe  Fe11  1  0.801121  0.743296  0.340832  1
  Fe  Fe12  1  0.301121  0.243296  0.340832  1
  Fe  Fe13  1  0.139636  0.702683  0.318411  1
  Fe  Fe14  1  0.639636  0.202683  0.318411  1
  Fe  Fe15  1  0.582623  0.682918  0.364024  1
  Fe  Fe16  1  0.082623  0.182918  0.364024  1
  Fe  Fe17  1  0.178268  0.432529  0.363958  1
  Fe  Fe18  1  0.678268  0.932529  0.363958  1
  Fe  Fe19  1  0.733858  0.452208  0.318293  1
  Fe  Fe20  1  0.233858  0.952208  0.318293  1
  Fe  Fe21  1  0.229786  0.503168  0.323601  1
  Fe  Fe22  1  0.729786  0.003168  0.323601  1
  Fe  Fe23  1  0.781194  0.517376  0.279094  1
  Fe  Fe24  1  0.281194  0.017376  0.279094  1
  Fe  Fe25  1  0.543496  0.772798  0.276457  1
  Fe  Fe26  1  0.043496  0.272798  0.276457  1
  Fe  Fe27  1  0.983227  0.753588  0.319845  1
  Fe  Fe28  1  0.483227  0.253588  0.319845  1
  Fe  Fe29  1  0.489195  0.703523  0.315832  1
  Fe  Fe30  1  0.989195  0.203523  0.315832  1
  Fe  Fe31  1  0.933996  0.683678  0.360246  1
  Fe  Fe32  1  0.433996  0.183678  0.360246  1
  Fe  Fe33  1  0.251560  0.574365  0.284002  1
  Fe  Fe34  1  0.751560  0.074365  0.284002  1
  Fe  Fe35  1  0.724275  0.561738  0.327536  1
  Fe  Fe36  1  0.224275  0.061738  0.327536  1
  Fe  Fe37  1  0.246363  0.396754  0.315674  1
  Fe  Fe38  1  0.746363  0.896754  0.315674  1
  Fe  Fe39  1  0.687814  0.372760  0.356507  1
  Fe  Fe40  1  0.187814  0.872760  0.356507  1
  Fe  Fe41  1  0.438929  0.623181  0.355400  1
  Fe  Fe42  1  0.938929  0.123181  0.355400  1
  Fe  Fe43  1  0.994324  0.645214  0.310212  1
  Fe  Fe44  1  0.494324  0.145214  0.310212  1
  Fe  Fe45  1  0.474559  0.812958  0.326006  1
  Fe  Fe46  1  0.974559  0.312958  0.326006  1
  Fe  Fe47  1  0.026824  0.830390  0.280955  1
  Fe  Fe48  1  0.526824  0.330390  0.280955  1
  Fe  Fe49  1  0.294089  0.681660  0.274902  1
  Fe  Fe50  1  0.794089  0.181660  0.274902  1
  Fe  Fe51  1  0.731627  0.664541  0.320977  1
  Fe  Fe52  1  0.231627  0.164541  0.320977  1
  Fe  Fe53  1  0.217681  0.783423  0.332477  1
  Fe  Fe54  1  0.717681  0.283423  0.332477  1
  Fe  Fe55  1  0.769501  0.805945  0.286627  1
  Fe  Fe56  1  0.269501  0.305945  0.286627  1
  Fe  Fe57  1  0.431788  0.521201  0.361653  1
  Fe  Fe58  1  0.931788  0.021201  0.361653  1
  Fe  Fe59  1  0.987529  0.542229  0.315965  1
  Fe  Fe60  1  0.487529  0.042229  0.315965  1
  Fe  Fe61  1  0.504912  0.422111  0.302985  1
  Fe  Fe62  1  0.004912  0.922111  0.302985  1
  Fe  Fe63  1  0.946029  0.401719  0.349787  1
  Fe  Fe64  1  0.446029  0.901719  0.349787  1
  Fe  Fe65  1  0.577878  0.502989  0.319853  1
  Fe  Fe66  1  0.077878  0.002989  0.319853  1
  Fe  Fe67  1  0.110314  0.513485  0.272520  1
  Fe  Fe68  1  0.610314  0.013485  0.272520  1
  Fe  Fe69  1  0.359265  0.443300  0.343440  1
  Fe  Fe70  1  0.859265  0.943300  0.343440  1
  Fe  Fe71  1  0.916338  0.463478  0.296309  1
  Fe  Fe72  1  0.416338  0.963478  0.296309  1
  Fe  Fe73  1  0.308366  0.694615  0.335234  1
  Fe  Fe74  1  0.808366  0.194615  0.335234  1
  Fe  Fe75  1  0.856547  0.714979  0.290409  1
  Fe  Fe76  1  0.356547  0.214979  0.290409  1
  Fe  Fe77  1  0.187843  0.770924  0.277970  1
  Fe  Fe78  1  0.687843  0.270924  0.277970  1
  Fe  Fe79  1  0.633031  0.751883  0.322902  1
  Fe  Fe80  1  0.133031  0.251883  0.322902  1
  Fe  Fe81  1  0.140790  0.598655  0.320736  1
  Fe  Fe82  1  0.640790  0.098655  0.320736  1
  Fe  Fe83  1  0.692559  0.619930  0.276950  1
  Fe  Fe84  1  0.192559  0.119930  0.276950  1
  Fe  Fe85  1  0.270914  0.337685  0.361100  1
  Fe  Fe86  1  0.770914  0.837685  0.361100  1
  Fe  Fe87  1  0.826483  0.358443  0.314757  1
  Fe  Fe88  1  0.326483  0.858443  0.314757  1
  Fe  Fe89  1  0.416877  0.616656  0.299461  1
  Fe  Fe90  1  0.916877  0.116656  0.299461  1
  Fe  Fe91  1  0.862385  0.595063  0.345536  1
  Fe  Fe92  1  0.362385  0.095063  0.345536  1
  Fe  Fe93  1  0.607436  0.863281  0.292392  1
  Fe  Fe94  1  0.107436  0.363281  0.292392  1
  Fe  Fe95  1  0.048031  0.840656  0.338327  1
  Fe  Fe96  1  0.548031  0.340656  0.338327  1
  Fe  Fe97  1  0.575376  0.607110  0.316347  1
  Fe  Fe98  1  0.075376  0.107110  0.316347  1
  Fe  Fe99  1  0.020073  0.587979  0.361688  1
  Fe  Fe100  1  0.520073  0.087979  0.361688  1
  Fe  Fe101  1  0.444013  0.866851  0.276409  1
  Fe  Fe102  1  0.944013  0.366851  0.276409  1
  Fe  Fe103  1  0.891776  0.847350  0.322560  1
  Fe  Fe104  1  0.391776  0.347350  0.322560  1
  Fe  Fe105  1  0.298433  0.591457  0.337471  1
  Fe  Fe106  1  0.798433  0.091457  0.337471  1
  Fe  Fe107  1  0.853444  0.610967  0.292347  1
  Fe  Fe108  1  0.353444  0.110967  0.292347  1
  Fe  Fe109  1  0.112823  0.345839  0.344498  1
  Fe  Fe110  1  0.612823  0.845839  0.344498  1
  Fe  Fe111  1  0.668264  0.364490  0.299313  1
  Fe  Fe112  1  0.168264  0.864490  0.299313  1
  Fe  Fe113  1  0.417479  0.392946  0.450692  1
  Fe  Fe114  1  0.917479  0.892946  0.450692  1
  Fe  Fe115  1  0.973204  0.413711  0.405263  1
  Fe  Fe116  1  0.473204  0.913711  0.405263  1
  Fe  Fe117  1  0.296634  0.469670  0.392773  1
  Fe  Fe118  1  0.796634  0.969670  0.392773  1
  Fe  Fe119  1  0.741499  0.449292  0.437834  1
  Fe  Fe120  1  0.241499  0.949292  0.437834  1
  Fe  Fe121  1  0.247754  0.722824  0.385992  1
  Fe  Fe122  1  0.747754  0.222824  0.385992  1
  Fe  Fe123  1  0.690851  0.701998  0.431625  1
  Fe  Fe124  1  0.190851  0.201998  0.431625  1
  Fe  Fe125  1  0.025849  0.661745  0.409548  1
  Fe  Fe126  1  0.525849  0.161745  0.409548  1
  Fe  Fe127  1  0.470146  0.640957  0.454874  1
  Fe  Fe128  1  0.970146  0.140957  0.454874  1
  Fe  Fe129  1  0.066786  0.390499  0.454546  1
  Fe  Fe130  1  0.566786  0.890499  0.454546  1
  Fe  Fe131  1  0.623061  0.411104  0.408972  1
  Fe  Fe132  1  0.123061  0.911104  0.408972  1
  Fe  Fe133  1  0.117010  0.460962  0.413883  1
  Fe  Fe134  1  0.617010  0.960962  0.413883  1
  Fe  Fe135  1  0.672732  0.481098  0.368192  1
  Fe  Fe136  1  0.172732  0.981098  0.368192  1
  Fe  Fe137  1  0.428311  0.733180  0.364767  1
  Fe  Fe138  1  0.928311  0.233180  0.364767  1
  Fe  Fe139  1  0.871382  0.712475  0.410573  1
  Fe  Fe140  1  0.371382  0.212475  0.410573  1
  Fe  Fe141  1  0.377190  0.663117  0.405229  1
  Fe  Fe142  1  0.877190  0.163117  0.405229  1
  Fe  Fe143  1  0.820848  0.641995  0.451125  1
  Fe  Fe144  1  0.320848  0.141995  0.451125  1
  Fe  Fe145  1  0.166698  0.541702  0.372890  1
  Fe  Fe146  1  0.666698  0.041702  0.372890  1
  Fe  Fe147  1  0.611825  0.520808  0.418273  1
  Fe  Fe148  1  0.111825  0.020808  0.418273  1
  Fe  Fe149  1  0.130265  0.352334  0.402284  1
  Fe  Fe150  1  0.630265  0.852334  0.402284  1
  Fe  Fe151  1  0.575634  0.331649  0.447647  1
  Fe  Fe152  1  0.075634  0.831649  0.447647  1
  Fe  Fe153  1  0.326524  0.582359  0.446612  1
  Fe  Fe154  1  0.826524  0.082359  0.446612  1
  Fe  Fe155  1  0.882317  0.602877  0.401253  1
  Fe  Fe156  1  0.382317  0.102877  0.401253  1
  Fe  Fe157  1  0.363142  0.771482  0.417028  1
  Fe  Fe158  1  0.863142  0.271482  0.417028  1
  Fe  Fe159  1  0.918366  0.791976  0.371789  1
  Fe  Fe160  1  0.418366  0.291976  0.371789  1
  Fe  Fe161  1  0.175368  0.644846  0.366772  1
  Fe  Fe162  1  0.675368  0.144846  0.366772  1
  Fe  Fe163  1  0.618903  0.623676  0.411987  1
  Fe  Fe164  1  0.118903  0.123676  0.411987  1
  Fe  Fe165  1  0.105527  0.742605  0.423346  1
  Fe  Fe166  1  0.605527  0.242605  0.423346  1
  Fe  Fe167  1  0.661048  0.763412  0.377964  1
  Fe  Fe168  1  0.161048  0.263412  0.377964  1
  Fe  Fe169  1  0.319080  0.479370  0.452661  1
  Fe  Fe170  1  0.819080  0.979370  0.452661  1
  Fe  Fe171  1  0.874773  0.499981  0.407238  1
  Fe  Fe172  1  0.374773  -0.000019  0.407238  1
  Fe  Fe173  1  0.388129  0.381021  0.396356  1
  Fe  Fe174  1  0.888129  0.881021  0.396356  1
  Fe  Fe175  1  0.833272  0.360507  0.441263  1
  Fe  Fe176  1  0.333272  0.860507  0.441263  1
  Fe  Fe177  1  0.467733  0.462151  0.409964  1
  Fe  Fe178  1  0.967733  0.962151  0.409964  1
  Fe  Fe179  1  0.023511  0.482699  0.364158  1
  Fe  Fe180  1  0.523511  0.982699  0.364158  1
  Fe  Fe181  1  0.246861  0.400947  0.433493  1
  Fe  Fe182  1  0.746861  0.900947  0.433493  1
  Fe  Fe183  1  0.802750  0.421678  0.387456  1
  Fe  Fe184  1  0.302750  0.921678  0.387456  1
  Fe  Fe185  1  0.197649  0.653825  0.426946  1
  Fe  Fe186  1  0.697649  0.153825  0.426946  1
  Fe  Fe187  1  0.752338  0.674334  0.381447  1
  Fe  Fe188  1  0.252338  0.174334  0.381447  1
  Fe  Fe189  1  0.076476  0.730787  0.368786  1
  Fe  Fe190  1  0.576476  0.230787  0.368786  1
  Fe  Fe191  1  0.520196  0.709990  0.413919  1
  Fe  Fe192  1  0.020196  0.209990  0.413919  1
  Fe  Fe193  1  0.030073  0.557087  0.412311  1
  Fe  Fe194  1  0.530073  0.057087  0.412311  1
  Fe  Fe195  1  0.585623  0.577051  0.366207  1
  Fe  Fe196  1  0.085623  0.077051  0.366207  1
  Fe  Fe197  1  0.158939  0.296431  0.451832  1
  Fe  Fe198  1  0.658939  0.796431  0.451832  1
  Fe  Fe199  1  0.715181  0.317239  0.406305  1
  Fe  Fe200  1  0.215181  0.817239  0.406305  1
  Fe  Fe201  1  0.306189  0.575421  0.391219  1
  Fe  Fe202  1  0.806189  0.075421  0.391219  1
  Fe  Fe203  1  0.750191  0.553328  0.436447  1
  Fe  Fe204  1  0.250191  0.053328  0.436447  1
  Fe  Fe205  1  0.492734  0.819828  0.383563  1
  Fe  Fe206  1  0.992734  0.319828  0.383563  1
  Fe  Fe207  1  0.936882  0.799383  0.429305  1
  Fe  Fe208  1  0.436882  0.299383  0.429305  1
  Fe  Fe209  1  0.464273  0.566940  0.407064  1
  Fe  Fe210  1  0.964273  0.066940  0.407064  1
  Fe  Fe211  1  0.907930  0.545997  0.452666  1
  Fe  Fe212  1  0.407930  0.045997  0.452666  1
  Fe  Fe213  1  0.335430  0.826675  0.367302  1
  Fe  Fe214  1  0.835430  0.326675  0.367302  1
  Fe  Fe215  1  0.778609  0.806403  0.413227  1
  Fe  Fe216  1  0.278609  0.306403  0.413227  1
  Fe  Fe217  1  0.187938  0.549597  0.428428  1
  Fe  Fe218  1  0.687938  0.049597  0.428428  1
  Fe  Fe219  1  0.743854  0.570162  0.382789  1
  Fe  Fe220  1  0.243854  0.070162  0.382789  1
  Fe  Fe221  1  0.000817  0.303972  0.435578  1
  Fe  Fe222  1  0.500817  0.803972  0.435578  1
  Fe  Fe223  1  0.557519  0.324395  0.390278  1
  Fe  Fe224  1  0.057519  0.824395  0.390278  1
  Fe  Fe225  1  0.305723  0.351244  0.541677  1
  Fe  Fe226  1  0.805723  0.851244  0.541677  1
  Fe  Fe227  1  0.861722  0.372016  0.496288  1
  Fe  Fe228  1  0.361722  0.872016  0.496288  1
  Fe  Fe229  1  0.185244  0.428405  0.483447  1
  Fe  Fe230  1  0.685244  0.928405  0.483447  1
  Fe  Fe231  1  0.629657  0.407672  0.528822  1
  Fe  Fe232  1  0.129657  0.907672  0.528822  1
  Fe  Fe233  1  0.135388  0.681450  0.477014  1
  Fe  Fe234  1  0.635388  0.181450  0.477014  1
  Fe  Fe235  1  0.579259  0.660563  0.522552  1
  Fe  Fe236  1  0.079259  0.160563  0.522552  1
  Fe  Fe237  1  0.914302  0.620095  0.500495  1
  Fe  Fe238  1  0.414302  0.120095  0.500495  1
  Fe  Fe239  1  0.358703  0.599284  0.546004  1
  Fe  Fe240  1  0.858703  0.099284  0.546004  1
  Fe  Fe241  1  0.955044  0.348760  0.545562  1
  Fe  Fe242  1  0.455044  0.848760  0.545562  1
  Fe  Fe243  1  0.511095  0.369666  0.499966  1
  Fe  Fe244  1  0.011095  0.869666  0.499966  1
  Fe  Fe245  1  0.005139  0.419357  0.504770  1
  Fe  Fe246  1  0.505139  0.919357  0.504770  1
  Fe  Fe247  1  0.561005  0.440212  0.459193  1
  Fe  Fe248  1  0.061005  0.940212  0.459193  1
  Fe  Fe249  1  0.315393  0.691843  0.455754  1
  Fe  Fe250  1  0.815393  0.191843  0.455754  1
  Fe  Fe251  1  0.759341  0.670937  0.501350  1
  Fe  Fe252  1  0.259341  0.170937  0.501350  1
  Fe  Fe253  1  0.265297  0.621246  0.496546  1
  Fe  Fe254  1  0.765297  0.121246  0.496546  1
  Fe  Fe255  1  0.709431  0.600392  0.542123  1
  Fe  Fe256  1  0.209431  0.100392  0.542123  1
  Fe  Fe257  1  0.055382  0.500107  0.463674  1
  Fe  Fe258  1  0.555382  0.000107  0.463674  1
  Fe  Fe259  1  0.499780  0.479363  0.509092  1
  Fe  Fe260  1  0.999780  0.979363  0.509092  1
  Fe  Fe261  1  0.019167  0.310866  0.493171  1
  Fe  Fe262  1  0.519167  0.810866  0.493171  1
  Fe  Fe263  1  0.463767  0.290011  0.538592  1
  Fe  Fe264  1  0.963767  0.790011  0.538592  1
  Fe  Fe265  1  0.215054  0.540496  0.537642  1
  Fe  Fe266  1  0.715054  0.040496  0.537642  1
  Fe  Fe267  1  0.770656  0.561240  0.492224  1
  Fe  Fe268  1  0.270656  0.061240  0.492224  1
  Fe  Fe269  1  0.251270  0.729737  0.508145  1
  Fe  Fe270  1  0.751270  0.229737  0.508145  1
  Fe  Fe271  1  0.806669  0.750592  0.462724  1
  Fe  Fe272  1  0.306669  0.250592  0.462724  1
  Fe  Fe273  1  0.063096  0.603073  0.457615  1
  Fe  Fe274  1  0.563096  0.103073  0.457615  1
  Fe  Fe275  1  0.507333  0.582268  0.503016  1
  Fe  Fe276  1  0.007333  0.082268  0.503016  1
  Fe  Fe277  1  0.993641  0.701041  0.514233  1
  Fe  Fe278  1  0.493641  0.201041  0.514233  1
  Fe  Fe279  1  0.549125  0.721844  0.468857  1
  Fe  Fe280  1  0.049125  0.221844  0.468857  1
  Fe  Fe281  1  0.207341  0.437530  0.543701  1
  Fe  Fe282  1  0.707341  0.937530  0.543701  1
  Fe  Fe283  1  0.763103  0.458335  0.498300  1
  Fe  Fe284  1  0.263103  0.958335  0.498300  1
  Fe  Fe285  1  0.276795  0.339562  0.487083  1
  Fe  Fe286  1  0.776795  0.839562  0.487083  1
  Fe  Fe287  1  0.721312  0.318759  0.532459  1
  Fe  Fe288  1  0.221312  0.818759  0.532459  1
  Fe  Fe289  1  0.356135  0.420508  0.500821  1
  Fe  Fe290  1  0.856135  0.920508  0.500821  1
  Fe  Fe291  1  0.911734  0.441319  0.455312  1
  Fe  Fe292  1  0.411734  0.941319  0.455312  1
  Fe  Fe293  1  0.135048  0.359153  0.524302  1
  Fe  Fe294  1  0.635048  0.859153  0.524302  1
  Fe  Fe295  1  0.691178  0.380040  0.478764  1
  Fe  Fe296  1  0.191178  0.880040  0.478764  1
  Fe  Fe297  1  0.085193  0.612198  0.517869  1
  Fe  Fe298  1  0.585193  0.112198  0.517869  1
  Fe  Fe299  1  0.640779  0.632931  0.472494  1
  Fe  Fe300  1  0.140779  0.132931  0.472494  1
  Fe  Fe301  1  0.964713  0.689359  0.459639  1
  Fe  Fe302  1  0.464713  0.189359  0.459639  1
  Fe  Fe303  1  0.408715  0.668587  0.505028  1
  Fe  Fe304  1  0.908715  0.168587  0.505028  1
  Fe  Fe305  1  0.918228  0.515277  0.503223  1
  Fe  Fe306  1  0.418228  0.015277  0.503223  1
  Fe  Fe307  1  0.474121  0.536225  0.457668  1
  Fe  Fe308  1  0.974121  0.036225  0.457668  1
  Fe  Fe309  1  0.047172  0.254837  0.542829  1
  Fe  Fe310  1  0.547172  0.754837  0.542829  1
  Fe  Fe311  1  0.603376  0.275610  0.497254  1
  Fe  Fe312  1  0.103376  0.775610  0.497254  1
  Fe  Fe313  1  0.194267  0.532771  0.481993  1
  Fe  Fe314  1  0.694267  0.032771  0.481993  1
  Fe  Fe315  1  0.638528  0.511795  0.527452  1
  Fe  Fe316  1  0.138528  0.011795  0.527452  1
  Fe  Fe317  1  0.380978  0.778342  0.474628  1
  Fe  Fe318  1  0.880978  0.278342  0.474628  1
  Fe  Fe319  1  0.825005  0.757658  0.520168  1
  Fe  Fe320  1  0.325005  0.257658  0.520168  1
  Fe  Fe321  1  0.352208  0.525326  0.498093  1
  Fe  Fe322  1  0.852208  0.025326  0.498093  1
  Fe  Fe323  1  0.796315  0.504378  0.543648  1
  Fe  Fe324  1  0.296315  0.004378  0.543648  1
  Fe  Fe325  1  0.223264  0.785766  0.458487  1
  Fe  Fe326  1  0.723264  0.285766  0.458487  1
  Fe  Fe327  1  0.667061  0.764993  0.504062  1
  Fe  Fe328  1  0.167061  0.264993  0.504062  1
  Fe  Fe329  1  0.076169  0.507832  0.519323  1
  Fe  Fe330  1  0.576169  0.007832  0.519323  1
  Fe  Fe331  1  0.631908  0.528809  0.473864  1
  Fe  Fe332  1  0.131908  0.028809  0.473864  1
  Fe  Fe333  1  0.889458  0.262261  0.526688  1
  Fe  Fe334  1  0.389458  0.762261  0.526688  1
  Fe  Fe335  1  0.445432  0.282945  0.481148  1
  Fe  Fe336  1  0.945432  0.782945  0.481148  1
  Fe  Fe337  1  0.193960  0.309816  0.632530  1
  Fe  Fe338  1  0.693960  0.809816  0.632530  1
  Fe  Fe339  1  0.750240  0.330613  0.587397  1
  Fe  Fe340  1  0.250240  0.830613  0.587397  1
  Fe  Fe341  1  0.072787  0.386778  0.574370  1
  Fe  Fe342  1  0.572787  0.886778  0.574370  1
  Fe  Fe343  1  0.518099  0.366270  0.619869  1
  Fe  Fe344  1  0.018099  0.866270  0.619869  1
  Fe  Fe345  1  0.023575  0.639656  0.567823  1
  Fe  Fe346  1  0.523575  0.139656  0.567823  1
  Fe  Fe347  1  0.467686  0.618925  0.613860  1
  Fe  Fe348  1  0.967686  0.118925  0.613860  1
  Fe  Fe349  1  0.802704  0.578453  0.591352  1
  Fe  Fe350  1  0.302704  0.078453  0.591352  1
  Fe  Fe351  1  0.246925  0.557904  0.637158  1
  Fe  Fe352  1  0.746925  0.057904  0.637158  1
  Fe  Fe353  1  0.842125  0.307423  0.636549  1
  Fe  Fe354  1  0.342125  0.807423  0.636549  1
  Fe  Fe355  1  0.399054  0.328128  0.590743  1
  Fe  Fe356  1  0.899054  0.828128  0.590743  1
  Fe  Fe357  1  0.893246  0.377486  0.596087  1
  Fe  Fe358  1  0.393246  0.877486  0.596087  1
  Fe  Fe359  1  0.449589  0.398608  0.550191  1
  Fe  Fe360  1  0.949589  0.898608  0.550191  1
  Fe  Fe361  1  0.203650  0.650104  0.546770  1
  Fe  Fe362  1  0.703650  0.150104  0.546770  1
  Fe  Fe363  1  0.647376  0.629499  0.592344  1
  Fe  Fe364  1  0.147376  0.129499  0.592344  1
  Fe  Fe365  1  0.153426  0.579641  0.587433  1
  Fe  Fe366  1  0.653426  0.079641  0.587433  1
  Fe  Fe367  1  0.597705  0.559505  0.633124  1
  Fe  Fe368  1  0.097705  0.059505  0.633124  1
  Fe  Fe369  1  0.943912  0.458244  0.554704  1
  Fe  Fe370  1  0.443912  0.958244  0.554704  1
  Fe  Fe371  1  0.388120  0.437726  0.600063  1
  Fe  Fe372  1  0.888120  0.937726  0.600063  1
  Fe  Fe373  1  0.907295  0.269121  0.584288  1
  Fe  Fe374  1  0.407295  0.769121  0.584288  1
  Fe  Fe375  1  0.352070  0.248627  0.629527  1
  Fe  Fe376  1  0.852070  0.748627  0.629527  1
  Fe  Fe377  1  0.103739  0.498901  0.628426  1
  Fe  Fe378  1  0.603739  0.998901  0.628426  1
  Fe  Fe379  1  0.658612  0.519795  0.583043  1
  Fe  Fe380  1  0.158612  0.019795  0.583043  1
  Fe  Fe381  1  0.140171  0.688269  0.599032  1
  Fe  Fe382  1  0.640171  0.188269  0.599032  1
  Fe  Fe383  1  0.694802  0.708954  0.553669  1
  Fe  Fe384  1  0.194802  0.208954  0.553669  1
  Fe  Fe385  1  0.951357  0.561234  0.548655  1
  Fe  Fe386  1  0.451357  0.061234  0.548655  1
  Fe  Fe387  1  0.395664  0.540622  0.594078  1
  Fe  Fe388  1  0.895664  0.040622  0.594078  1
  Fe  Fe389  1  0.882307  0.659582  0.604960  1
  Fe  Fe390  1  0.382307  0.159582  0.604960  1
  Fe  Fe391  1  0.437164  0.680096  0.560053  1
  Fe  Fe392  1  0.937164  0.180096  0.560053  1
  Fe  Fe393  1  0.095068  0.395758  0.634544  1
  Fe  Fe394  1  0.595068  0.895758  0.634544  1
  Fe  Fe395  1  0.651533  0.416927  0.589329  1
  Fe  Fe396  1  0.151533  0.916927  0.589329  1
  Fe  Fe397  1  0.164909  0.297999  0.577971  1
  Fe  Fe398  1  0.664909  0.797999  0.577971  1
  Fe  Fe399  1  0.609389  0.277191  0.623352  1
  Fe  Fe400  1  0.109389  0.777191  0.623352  1
  Fe  Fe401  1  0.244588  0.378858  0.591768  1
  Fe  Fe402  1  0.744588  0.878858  0.591768  1
  Fe  Fe403  1  0.800290  0.399646  0.546442  1
  Fe  Fe404  1  0.300290  0.899646  0.546442  1
  Fe  Fe405  1  0.022683  0.317779  0.615324  1
  Fe  Fe406  1  0.522683  0.817779  0.615324  1
  Fe  Fe407  1  0.579586  0.338605  0.569691  1
  Fe  Fe408  1  0.079586  0.838605  0.569691  1
  Fe  Fe409  1  0.973802  0.570933  0.608543  1
  Fe  Fe410  1  0.473802  0.070933  0.608543  1
  Fe  Fe411  1  0.528938  0.591311  0.563482  1
  Fe  Fe412  1  0.028938  0.091311  0.563482  1
  Fe  Fe413  1  0.852958  0.647657  0.550624  1
  Fe  Fe414  1  0.352958  0.147657  0.550624  1
  Fe  Fe415  1  0.297233  0.626892  0.596053  1
  Fe  Fe416  1  0.797233  0.126892  0.596053  1
  Fe  Fe417  1  0.806164  0.473663  0.594252  1
  Fe  Fe418  1  0.306164  0.973663  0.594252  1
  Fe  Fe419  1  0.362507  0.494606  0.548650  1
  Fe  Fe420  1  0.862507  0.994606  0.548650  1
  Fe  Fe421  1  0.935007  0.213928  0.634014  1
  Fe  Fe422  1  0.435007  0.713928  0.634014  1
  Fe  Fe423  1  0.491827  0.234200  0.588089  1
  Fe  Fe424  1  0.991827  0.734200  0.588089  1
  Fe  Fe425  1  0.082498  0.491006  0.572888  1
  Fe  Fe426  1  0.582498  0.991006  0.572888  1
  Fe  Fe427  1  0.526583  0.470441  0.618527  1
  Fe  Fe428  1  0.026583  0.970441  0.618527  1
  Fe  Fe429  1  0.269619  0.736631  0.565739  1
  Fe  Fe430  1  0.769619  0.236631  0.565739  1
  Fe  Fe431  1  0.712918  0.716208  0.611038  1
  Fe  Fe432  1  0.212918  0.216208  0.611038  1
  Fe  Fe433  1  0.240363  0.483516  0.589005  1
  Fe  Fe434  1  0.740363  0.983516  0.589005  1
  Fe  Fe435  1  0.684814  0.463552  0.635109  1
  Fe  Fe436  1  0.184814  0.963552  0.635109  1
  Fe  Fe437  1  0.111498  0.744172  0.549484  1
  Fe  Fe438  1  0.611498  0.244172  0.549484  1
  Fe  Fe439  1  0.555256  0.723364  0.595011  1
  Fe  Fe440  1  0.055256  0.223364  0.595011  1
  Fe  Fe441  1  0.964247  0.465182  0.610098  1
  Fe  Fe442  1  0.464247  0.965182  0.610098  1
  Fe  Fe443  1  0.520246  0.487276  0.564869  1
  Fe  Fe444  1  0.020246  0.987276  0.564869  1
  Fe  Fe445  1  0.777702  0.220775  0.617753  1
  Fe  Fe446  1  0.277702  0.720775  0.617753  1
  Fe  Fe447  1  0.333555  0.241220  0.572011  1
  Fe  Fe448  1  0.833555  0.741220  0.572011  1
  Fe  Fe449  1  0.082594  0.269679  0.723346  1
  Fe  Fe450  1  0.582594  0.769679  0.723346  1
  Fe  Fe451  1  0.637405  0.288721  0.678414  1
  Fe  Fe452  1  0.137405  0.788721  0.678414  1
  Fe  Fe453  1  0.962070  0.345988  0.666082  1
  Fe  Fe454  1  0.462070  0.845988  0.666082  1
  Fe  Fe455  1  0.413890  0.325624  0.710907  1
  Fe  Fe456  1  0.913890  0.825624  0.710907  1
  Fe  Fe457  1  0.911171  0.597303  0.657876  1
  Fe  Fe458  1  0.411171  0.097303  0.657876  1
  Fe  Fe459  1  0.354099  0.577125  0.705007  1
  Fe  Fe460  1  0.854099  0.077125  0.705007  1
  Fe  Fe461  1  0.692558  0.537614  0.681463  1
  Fe  Fe462  1  0.192558  0.037614  0.681463  1
  Fe  Fe463  1  0.160123  0.527118  0.728796  1
  Fe  Fe464  1  0.660123  0.027118  0.728796  1
  Fe  Fe465  1  0.726940  0.267805  0.724859  1
  Fe  Fe466  1  0.226940  0.767805  0.724859  1
  Fe  Fe467  1  0.287209  0.287015  0.681471  1
  Fe  Fe468  1  0.787209  0.787015  0.681471  1
  Fe  Fe469  1  0.781241  0.337080  0.685484  1
  Fe  Fe470  1  0.281241  0.837080  0.685484  1
  Fe  Fe471  1  0.336440  0.356925  0.641070  1
  Fe  Fe472  1  0.836440  0.856925  0.641070  1
  Fe  Fe473  1  0.092169  0.608074  0.637358  1
  Fe  Fe474  1  0.592169  0.108074  0.637358  1
  Fe  Fe475  1  0.536578  0.588395  0.683023  1
  Fe  Fe476  1  0.036578  0.088395  0.683023  1
  Fe  Fe477  1  0.040651  0.537435  0.677715  1
  Fe  Fe478  1  0.540651  0.037435  0.677715  1
  Fe  Fe479  1  0.489242  0.523227  0.722222  1
  Fe  Fe480  1  0.989242  0.023227  0.722222  1
  Fe  Fe481  1  0.831508  0.417422  0.645916  1
  Fe  Fe482  1  0.331508  0.917422  0.645916  1
  Fe  Fe483  1  0.276112  0.395389  0.691104  1
  Fe  Fe484  1  0.776112  0.895389  0.691104  1
  Fe  Fe485  1  0.795877  0.227645  0.675310  1
  Fe  Fe486  1  0.295877  0.727645  0.675310  1
  Fe  Fe487  1  0.243612  0.210213  0.720361  1
  Fe  Fe488  1  0.743612  0.710213  0.720361  1
  Fe  Fe489  1  0.018877  0.466238  0.717314  1
  Fe  Fe490  1  0.518877  0.966238  0.717314  1
  Fe  Fe491  1  0.546161  0.478865  0.673780  1
  Fe  Fe492  1  0.046161  0.978865  0.673780  1
  Fe  Fe493  1  0.024073  0.643849  0.685642  1
  Fe  Fe494  1  0.524073  0.143849  0.685642  1
  Fe  Fe495  1  0.582622  0.667843  0.644809  1
  Fe  Fe496  1  0.082622  0.167843  0.644809  1
  Fe  Fe497  1  0.838649  0.519402  0.639663  1
  Fe  Fe498  1  0.338649  0.019402  0.639663  1
  Fe  Fe499  1  0.282907  0.498374  0.685351  1
  Fe  Fe500  1  0.782907  0.998374  0.685351  1
  Fe  Fe501  1  0.765524  0.618492  0.698331  1
  Fe  Fe502  1  0.265524  0.118492  0.698331  1
  Fe  Fe503  1  0.324407  0.638884  0.651529  1
  Fe  Fe504  1  0.824407  0.138884  0.651529  1
  Fe  Fe505  1  0.976347  0.358943  0.726414  1
  Fe  Fe506  1  0.476347  0.858943  0.726414  1
  Fe  Fe507  1  0.538810  0.376062  0.680339  1
  Fe  Fe508  1  0.038810  0.876062  0.680339  1
  Fe  Fe509  1  0.052755  0.257180  0.668839  1
  Fe  Fe510  1  0.552755  0.757180  0.668839  1
  Fe  Fe511  1  0.500935  0.234658  0.714689  1
  Fe  Fe512  1  0.000935  0.734658  0.714689  1
  Fe  Fe513  1  0.130800  0.337920  0.682906  1
  Fe  Fe514  1  0.630800  0.837920  0.682906  1
  Fe  Fe515  1  0.687814  0.357686  0.637292  1
  Fe  Fe516  1  0.187814  0.857686  0.637292  1
  Fe  Fe517  1  0.912864  0.276640  0.706422  1
  Fe  Fe518  1  0.412864  0.776640  0.706422  1
  Fe  Fe519  1  0.469316  0.297307  0.660484  1
  Fe  Fe520  1  0.969316  0.797307  0.660484  1
  Fe  Fe521  1  0.871156  0.527781  0.699594  1
  Fe  Fe522  1  0.371156  0.027781  0.699594  1
  Fe  Fe523  1  0.416300  0.550849  0.653945  1
  Fe  Fe524  1  0.916300  0.050849  0.653945  1
  Fe  Fe525  1  0.741128  0.605980  0.641613  1
  Fe  Fe526  1  0.241128  0.105980  0.641613  1
  Fe  Fe527  1  0.186036  0.585194  0.686705  1
  Fe  Fe528  1  0.686036  0.085194  0.686705  1
  Fe  Fe529  1  0.695061  0.433493  0.684969  1
  Fe  Fe530  1  0.195061  0.933493  0.684969  1
  Fe  Fe531  1  0.250363  0.452624  0.639628  1
  Fe  Fe532  1  0.750363  0.952624  0.639628  1
  Fe  Fe533  1  0.826423  0.173752  0.724907  1
  Fe  Fe534  1  0.326423  0.673752  0.724907  1
  Fe  Fe535  1  0.378660  0.193253  0.678756  1
  Fe  Fe536  1  0.878660  0.693253  0.678756  1
  Fe  Fe537  1  0.972003  0.449146  0.663845  1
  Fe  Fe538  1  0.472003  0.949146  0.663845  1
  Fe  Fe539  1  0.416992  0.429636  0.708970  1
  Fe  Fe540  1  0.916992  0.929636  0.708970  1
  Fe  Fe541  1  0.157614  0.694764  0.656818  1
  Fe  Fe542  1  0.657614  0.194764  0.656818  1
  Fe  Fe543  1  0.602172  0.676114  0.702003  1
  Fe  Fe544  1  0.102172  0.176114  0.702003  1
  Fe  Fe545  1  0.129646  0.441948  0.680580  1
  Fe  Fe546  1  0.629646  0.941948  0.680580  1
  Fe  Fe547  1  0.577877  0.420673  0.724366  1
  Fe  Fe548  1  0.077877  0.920673  0.724366  1
  Fe  Fe549  1  0.999522  0.702918  0.640216  1
  Fe  Fe550  1  0.499522  0.202918  0.640216  1
  Fe  Fe551  1  0.443953  0.682161  0.686559  1
  Fe  Fe552  1  0.943953  0.182161  0.686559  1
  Fe  Fe553  1  0.853560  0.423947  0.701855  1
  Fe  Fe554  1  0.353560  0.923947  0.701855  1
  Fe  Fe555  1  0.408051  0.445540  0.655780  1
  Fe  Fe556  1  0.908051  0.945540  0.655780  1
  Fe  Fe557  1  0.663001  0.177322  0.708924  1
  Fe  Fe558  1  0.163001  0.677322  0.708924  1
  Fe  Fe559  1  0.222405  0.199948  0.662989  1
  Fe  Fe560  1  0.722405  0.699948  0.662989  1
  C  C561  1  0.435563  0.373738  0.358546  1
  C  C562  1  0.935563  0.873738  0.358546  1
  C  C563  1  0.991868  0.394017  0.311816  1
  C  C564  1  0.491868  0.894017  0.311816  1
  C  C565  1  0.469134  0.560581  0.327686  1
  C  C566  1  0.969134  0.060581  0.327686  1
  C  C567  1  0.024198  0.583088  0.282308  1
  C  C568  1  0.524198  0.083088  0.282308  1
  C  C569  1  0.280792  0.832369  0.278888  1
  C  C570  1  0.780792  0.332369  0.278888  1
  C  C571  1  0.726638  0.812759  0.324911  1
  C  C572  1  0.226638  0.312759  0.324911  1
  C  C573  1  0.245950  0.645000  0.308290  1
  C  C574  1  0.745950  0.145000  0.308290  1
  C  C575  1  0.689497  0.625223  0.354441  1
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