# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.03252863
_cell_length_b   14.20439718
_cell_length_c   49.30171882
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   121.36435756
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe420 C168'
_cell_volume   10184.9326611
_cell_formula_units_Z   84
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  0.224867  0.158655  0.277566  1
  Fe  Fe2  1  0.412844  0.047870  0.322742  1
  Fe  Fe3  1  0.724867  0.658655  0.277566  1
  Fe  Fe4  1  0.912844  0.547870  0.322742  1
  Fe  Fe5  1  0.817651  0.103496  0.300288  1
  Fe  Fe6  1  0.317651  0.603496  0.300288  1
  Fe  Fe7  1  0.743423  0.913416  0.299921  1
  Fe  Fe8  1  0.149782  0.965232  0.277271  1
  Fe  Fe9  1  0.243423  0.413416  0.299921  1
  Fe  Fe10  1  0.649782  0.465232  0.277271  1
  Fe  Fe11  1  0.337111  0.856980  0.322787  1
  Fe  Fe12  1  0.837111  0.356980  0.322787  1
  Fe  Fe13  1  0.132342  0.228323  0.296286  1
  Fe  Fe14  1  0.549647  0.274708  0.274612  1
  Fe  Fe15  1  0.632342  0.728323  0.296286  1
  Fe  Fe16  1  0.049647  0.774708  0.274612  1
  Fe  Fe17  1  0.730958  0.175370  0.319963  1
  Fe  Fe18  1  0.230958  0.675370  0.319963  1
  Fe  Fe19  1  0.985884  0.170424  0.320476  1
  Fe  Fe20  1  0.390041  0.225964  0.298509  1
  Fe  Fe21  1  0.485884  0.670424  0.320476  1
  Fe  Fe22  1  0.890041  0.725964  0.298509  1
  Fe  Fe23  1  0.796879  0.281358  0.276062  1
  Fe  Fe24  1  0.296879  0.781358  0.276062  1
  Fe  Fe25  1  0.763006  0.734242  0.323699  1
  Fe  Fe26  1  0.169559  0.791796  0.301742  1
  Fe  Fe27  1  0.263006  0.234242  0.323699  1
  Fe  Fe28  1  0.669559  0.291796  0.301742  1
  Fe  Fe29  1  0.571497  0.845915  0.279846  1
  Fe  Fe30  1  0.071497  0.345915  0.279846  1
  Fe  Fe31  1  0.142960  0.057622  0.317788  1
  Fe  Fe32  1  0.547529  0.114148  0.295782  1
  Fe  Fe33  1  0.642960  0.557622  0.317788  1
  Fe  Fe34  1  0.047529  0.614148  0.295782  1
  Fe  Fe35  1  0.946369  0.153806  0.271662  1
  Fe  Fe36  1  0.446369  0.653806  0.271662  1
  Fe  Fe37  1  0.920048  0.997918  0.305470  1
  Fe  Fe38  1  0.325526  0.051460  0.281772  1
  Fe  Fe39  1  0.420048  0.497918  0.305470  1
  Fe  Fe40  1  0.825526  0.551460  0.281772  1
  Fe  Fe41  1  0.516194  0.941701  0.326973  1
  Fe  Fe42  1  0.016194  0.441701  0.326973  1
  Fe  Fe43  1  0.604829  0.845857  0.326982  1
  Fe  Fe44  1  0.009000  0.899244  0.303441  1
  Fe  Fe45  1  0.104829  0.345857  0.326982  1
  Fe  Fe46  1  0.509000  0.399244  0.303441  1
  Fe  Fe47  1  0.415741  0.957633  0.280524  1
  Fe  Fe48  1  0.915741  0.457633  0.280524  1
  Fe  Fe49  1  0.832172  0.842117  0.280723  1
  Fe  Fe50  1  0.019193  0.730747  0.325413  1
  Fe  Fe51  1  0.332172  0.342117  0.280723  1
  Fe  Fe52  1  0.519193  0.230747  0.325413  1
  Fe  Fe53  1  0.424732  0.786953  0.303340  1
  Fe  Fe54  1  0.924732  0.286953  0.303340  1
  Fe  Fe55  1  0.034437  0.044654  0.275613  1
  Fe  Fe56  1  0.231514  0.962186  0.318496  1
  Fe  Fe57  1  0.534437  0.544654  0.275613  1
  Fe  Fe58  1  0.731514  0.462186  0.318496  1
  Fe  Fe59  1  0.638616  0.022811  0.295898  1
  Fe  Fe60  1  0.138616  0.522811  0.295898  1
  Fe  Fe61  1  0.007951  0.992822  0.344564  1
  Fe  Fe62  1  0.197459  0.881829  0.389097  1
  Fe  Fe63  1  0.507951  0.492822  0.344564  1
  Fe  Fe64  1  0.697459  0.381829  0.389097  1
  Fe  Fe65  1  0.602872  0.937608  0.366841  1
  Fe  Fe66  1  0.102872  0.437608  0.366841  1
  Fe  Fe67  1  0.526199  0.745373  0.366714  1
  Fe  Fe68  1  0.931249  0.800945  0.344519  1
  Fe  Fe69  1  0.026199  0.245373  0.366714  1
  Fe  Fe70  1  0.431249  0.300945  0.344519  1
  Fe  Fe71  1  0.120386  0.690562  0.389071  1
  Fe  Fe72  1  0.620386  0.190562  0.389071  1
  Fe  Fe73  1  0.919952  0.063289  0.363851  1
  Fe  Fe74  1  0.324074  0.118790  0.341645  1
  Fe  Fe75  1  0.419952  0.563289  0.363851  1
  Fe  Fe76  1  0.824074  0.618790  0.341645  1
  Fe  Fe77  1  0.515188  0.008235  0.386215  1
  Fe  Fe78  1  0.015188  0.508235  0.386215  1
  Fe  Fe79  1  0.770887  0.004180  0.387457  1
  Fe  Fe80  1  0.175888  0.059653  0.365143  1
  Fe  Fe81  1  0.270887  0.504180  0.387457  1
  Fe  Fe82  1  0.675888  0.559653  0.365143  1
  Fe  Fe83  1  0.581196  0.115328  0.343332  1
  Fe  Fe84  1  0.081196  0.615328  0.343332  1
  Fe  Fe85  1  0.547370  0.568021  0.390567  1
  Fe  Fe86  1  0.952562  0.623817  0.368471  1
  Fe  Fe87  1  0.047370  0.068021  0.390567  1
  Fe  Fe88  1  0.452562  0.123817  0.368471  1
  Fe  Fe89  1  0.357230  0.679053  0.346421  1
  Fe  Fe90  1  0.857230  0.179053  0.346421  1
  Fe  Fe91  1  0.928380  0.892459  0.384487  1
  Fe  Fe92  1  0.333650  0.948295  0.362573  1
  Fe  Fe93  1  0.428380  0.392459  0.384487  1
  Fe  Fe94  1  0.833650  0.448295  0.362573  1
  Fe  Fe95  1  0.737826  0.002195  0.340028  1
  Fe  Fe96  1  0.237826  0.502195  0.340028  1
  Fe  Fe97  1  0.706315  0.830712  0.370666  1
  Fe  Fe98  1  0.111348  0.886245  0.348593  1
  Fe  Fe99  1  0.206315  0.330712  0.370666  1
  Fe  Fe100  1  0.611348  0.386245  0.348593  1
  Fe  Fe101  1  0.301185  0.775595  0.393366  1
  Fe  Fe102  1  0.801185  0.275595  0.393366  1
  Fe  Fe103  1  0.389683  0.679654  0.393606  1
  Fe  Fe104  1  0.794785  0.735336  0.371044  1
  Fe  Fe105  1  0.889683  0.179654  0.393606  1
  Fe  Fe106  1  0.294785  0.235336  0.371044  1
  Fe  Fe107  1  0.199960  0.790679  0.348895  1
  Fe  Fe108  1  0.699960  0.290679  0.348895  1
  Fe  Fe109  1  0.614255  0.675297  0.347427  1
  Fe  Fe110  1  0.803600  0.564363  0.392045  1
  Fe  Fe111  1  0.114255  0.175297  0.347427  1
  Fe  Fe112  1  0.303600  0.064363  0.392045  1
  Fe  Fe113  1  0.208596  0.619626  0.369936  1
  Fe  Fe114  1  0.708596  0.119626  0.369936  1
  Fe  Fe115  1  0.826164  0.908025  0.340392  1
  Fe  Fe116  1  0.016855  0.796782  0.384855  1
  Fe  Fe117  1  0.326164  0.408025  0.340392  1
  Fe  Fe118  1  0.516855  0.296782  0.384855  1
  Fe  Fe119  1  0.422447  0.852392  0.362909  1
  Fe  Fe120  1  0.922447  0.352392  0.362909  1
  Fe  Fe121  1  0.792345  0.826392  0.411170  1
  Fe  Fe122  1  0.982166  0.715958  0.455652  1
  Fe  Fe123  1  0.292345  0.326392  0.411170  1
  Fe  Fe124  1  0.482166  0.215958  0.455652  1
  Fe  Fe125  1  0.387216  0.771224  0.433496  1
  Fe  Fe126  1  0.887216  0.271224  0.433496  1
  Fe  Fe127  1  0.310538  0.579524  0.433391  1
  Fe  Fe128  1  0.715263  0.634910  0.411090  1
  Fe  Fe129  1  0.810538  0.079524  0.433391  1
  Fe  Fe130  1  0.215263  0.134910  0.411090  1
  Fe  Fe131  1  0.905228  0.524316  0.455598  1
  Fe  Fe132  1  0.405228  0.024316  0.455598  1
  Fe  Fe133  1  0.704313  0.897141  0.430341  1
  Fe  Fe134  1  0.109291  0.952598  0.408148  1
  Fe  Fe135  1  0.204313  0.397141  0.430341  1
  Fe  Fe136  1  0.609291  0.452598  0.408148  1
  Fe  Fe137  1  0.299325  0.841997  0.452636  1
  Fe  Fe138  1  0.799325  0.341997  0.452636  1
  Fe  Fe139  1  0.555514  0.838089  0.453948  1
  Fe  Fe140  1  0.960551  0.893473  0.431729  1
  Fe  Fe141  1  0.055514  0.338089  0.453948  1
  Fe  Fe142  1  0.460551  0.393473  0.431729  1
  Fe  Fe143  1  0.365826  0.948829  0.409752  1
  Fe  Fe144  1  0.865826  0.448829  0.409752  1
  Fe  Fe145  1  0.331894  0.401876  0.457203  1
  Fe  Fe146  1  0.737035  0.457392  0.435041  1
  Fe  Fe147  1  0.831894  0.901876  0.457203  1
  Fe  Fe148  1  0.237035  0.957392  0.435041  1
  Fe  Fe149  1  0.142061  0.512698  0.412888  1
  Fe  Fe150  1  0.642061  0.012698  0.412888  1
  Fe  Fe151  1  0.713094  0.726332  0.451163  1
  Fe  Fe152  1  0.118187  0.781811  0.429039  1
  Fe  Fe153  1  0.213094  0.226332  0.451163  1
  Fe  Fe154  1  0.618187  0.281811  0.429039  1
  Fe  Fe155  1  0.523316  0.836887  0.406725  1
  Fe  Fe156  1  0.023316  0.336887  0.406725  1
  Fe  Fe157  1  0.490930  0.664689  0.437525  1
  Fe  Fe158  1  0.896028  0.720131  0.415318  1
  Fe  Fe159  1  0.990930  0.164689  0.437525  1
  Fe  Fe160  1  0.396028  0.220131  0.415318  1
  Fe  Fe161  1  0.085811  0.609419  0.459797  1
  Fe  Fe162  1  0.585811  0.109419  0.459797  1
  Fe  Fe163  1  0.174290  0.513637  0.460105  1
  Fe  Fe164  1  0.579400  0.569108  0.437770  1
  Fe  Fe165  1  0.674290  0.013637  0.460105  1
  Fe  Fe166  1  0.079400  0.069108  0.437770  1
  Fe  Fe167  1  0.984549  0.624440  0.415652  1
  Fe  Fe168  1  0.484549  0.124440  0.415652  1
  Fe  Fe169  1  0.398432  0.508834  0.414196  1
  Fe  Fe170  1  0.588270  0.398335  0.458623  1
  Fe  Fe171  1  0.898432  0.008834  0.414196  1
  Fe  Fe172  1  0.088270  0.898335  0.458623  1
  Fe  Fe173  1  0.993338  0.453654  0.436458  1
  Fe  Fe174  1  0.493338  0.953654  0.436458  1
  Fe  Fe175  1  0.611971  0.741276  0.407026  1
  Fe  Fe176  1  0.801523  0.630666  0.451466  1
  Fe  Fe177  1  0.111971  0.241276  0.407026  1
  Fe  Fe178  1  0.301523  0.130666  0.451466  1
  Fe  Fe179  1  0.206850  0.686153  0.429336  1
  Fe  Fe180  1  0.706850  0.186153  0.429336  1
  Fe  Fe181  1  0.577028  0.660378  0.477809  1
  Fe  Fe182  1  0.766757  0.549834  0.522262  1
  Fe  Fe183  1  0.077028  0.160378  0.477809  1
  Fe  Fe184  1  0.266757  0.049834  0.522262  1
  Fe  Fe185  1  0.171788  0.605156  0.500043  1
  Fe  Fe186  1  0.671788  0.105156  0.500043  1
  Fe  Fe187  1  0.095077  0.413473  0.499957  1
  Fe  Fe188  1  0.500108  0.468795  0.477738  1
  Fe  Fe189  1  0.595077  0.913473  0.499957  1
  Fe  Fe190  1  0.000108  0.968795  0.477738  1
  Fe  Fe191  1  0.689836  0.358250  0.522191  1
  Fe  Fe192  1  0.189836  0.858250  0.522191  1
  Fe  Fe193  1  0.489040  0.731104  0.496978  1
  Fe  Fe194  1  0.893988  0.786456  0.474741  1
  Fe  Fe195  1  0.989040  0.231104  0.496978  1
  Fe  Fe196  1  0.393988  0.286456  0.474741  1
  Fe  Fe197  1  0.083908  0.675931  0.519177  1
  Fe  Fe198  1  0.583908  0.175931  0.519177  1
  Fe  Fe199  1  0.340136  0.672013  0.520548  1
  Fe  Fe200  1  0.745193  0.727375  0.498353  1
  Fe  Fe201  1  0.840136  0.172013  0.520548  1
  Fe  Fe202  1  0.245193  0.227375  0.498353  1
  Fe  Fe203  1  0.150404  0.782754  0.476223  1
  Fe  Fe204  1  0.650404  0.282754  0.476223  1
  Fe  Fe205  1  0.116460  0.235874  0.523777  1
  Fe  Fe206  1  0.521671  0.291253  0.501647  1
  Fe  Fe207  1  0.616460  0.735874  0.523777  1
  Fe  Fe208  1  0.021671  0.791253  0.501647  1
  Fe  Fe209  1  0.926728  0.346616  0.479452  1
  Fe  Fe210  1  0.426728  0.846616  0.479452  1
  Fe  Fe211  1  0.497694  0.560237  0.517753  1
  Fe  Fe212  1  0.902825  0.615659  0.495588  1
  Fe  Fe213  1  0.997694  0.060237  0.517753  1
  Fe  Fe214  1  0.402825  0.115659  0.495588  1
  Fe  Fe215  1  0.307980  0.670966  0.473325  1
  Fe  Fe216  1  0.807980  0.170966  0.473325  1
  Fe  Fe217  1  0.275512  0.498590  0.504121  1
  Fe  Fe218  1  0.680715  0.554068  0.481917  1
  Fe  Fe219  1  0.775512  0.998590  0.504121  1
  Fe  Fe220  1  0.180715  0.054068  0.481917  1
  Fe  Fe221  1  0.870434  0.443404  0.526356  1
  Fe  Fe222  1  0.370434  0.943404  0.526356  1
  Fe  Fe223  1  0.958884  0.347662  0.526675  1
  Fe  Fe224  1  0.364039  0.402969  0.504412  1
  Fe  Fe225  1  0.458884  0.847662  0.526675  1
  Fe  Fe226  1  0.864039  0.902969  0.504412  1
  Fe  Fe227  1  0.769170  0.458391  0.482247  1
  Fe  Fe228  1  0.269170  0.958391  0.482247  1
  Fe  Fe229  1  0.182957  0.342698  0.480823  1
  Fe  Fe230  1  0.372876  0.232173  0.525259  1
  Fe  Fe231  1  0.682957  0.842698  0.480823  1
  Fe  Fe232  1  0.872876  0.732173  0.525259  1
  Fe  Fe233  1  0.777825  0.287525  0.503022  1
  Fe  Fe234  1  0.277825  0.787525  0.503022  1
  Fe  Fe235  1  0.396431  0.575225  0.473644  1
  Fe  Fe236  1  0.586149  0.464561  0.518083  1
  Fe  Fe237  1  0.896431  0.075225  0.473644  1
  Fe  Fe238  1  0.086149  0.964561  0.518083  1
  Fe  Fe239  1  0.991353  0.520039  0.495879  1
  Fe  Fe240  1  0.491353  0.020039  0.495879  1
  Fe  Fe241  1  0.361636  0.494313  0.544402  1
  Fe  Fe242  1  0.551601  0.383719  0.588910  1
  Fe  Fe243  1  0.861636  0.994313  0.544402  1
  Fe  Fe244  1  0.051601  0.883719  0.588910  1
  Fe  Fe245  1  0.956327  0.439105  0.566609  1
  Fe  Fe246  1  0.456327  0.939105  0.566609  1
  Fe  Fe247  1  0.879648  0.247405  0.566504  1
  Fe  Fe248  1  0.284699  0.302670  0.544348  1
  Fe  Fe249  1  0.379648  0.747405  0.566504  1
  Fe  Fe250  1  0.784699  0.802670  0.544348  1
  Fe  Fe251  1  0.474520  0.192236  0.588830  1
  Fe  Fe252  1  0.974520  0.692236  0.588830  1
  Fe  Fe253  1  0.273526  0.564974  0.563542  1
  Fe  Fe254  1  0.678594  0.620293  0.541377  1
  Fe  Fe255  1  0.773526  0.064974  0.563542  1
  Fe  Fe256  1  0.178594  0.120293  0.541377  1
  Fe  Fe257  1  0.868433  0.509794  0.585804  1
  Fe  Fe258  1  0.368433  0.009794  0.585804  1
  Fe  Fe259  1  0.124804  0.505930  0.587112  1
  Fe  Fe260  1  0.529830  0.561236  0.564959  1
  Fe  Fe261  1  0.624804  0.005930  0.587112  1
  Fe  Fe262  1  0.029830  0.061236  0.564959  1
  Fe  Fe263  1  0.934970  0.616752  0.542797  1
  Fe  Fe264  1  0.434970  0.116752  0.542797  1
  Fe  Fe265  1  0.901038  0.069799  0.590248  1
  Fe  Fe266  1  0.306314  0.125155  0.568271  1
  Fe  Fe267  1  0.401038  0.569799  0.590248  1
  Fe  Fe268  1  0.806314  0.625155  0.568271  1
  Fe  Fe269  1  0.711351  0.180540  0.546052  1
  Fe  Fe270  1  0.211351  0.680540  0.546052  1
  Fe  Fe271  1  0.282315  0.394189  0.584348  1
  Fe  Fe272  1  0.687464  0.449521  0.562230  1
  Fe  Fe273  1  0.782315  0.894189  0.584348  1
  Fe  Fe274  1  0.187464  0.949521  0.562230  1
  Fe  Fe275  1  0.092574  0.504992  0.539895  1
  Fe  Fe276  1  0.592574  0.004992  0.539895  1
  Fe  Fe277  1  0.060014  0.332476  0.570664  1
  Fe  Fe278  1  0.465342  0.387963  0.548534  1
  Fe  Fe279  1  0.560014  0.832476  0.570664  1
  Fe  Fe280  1  0.965342  0.887963  0.548534  1
  Fe  Fe281  1  0.654894  0.277353  0.592974  1
  Fe  Fe282  1  0.154894  0.777353  0.592974  1
  Fe  Fe283  1  0.743548  0.181741  0.593275  1
  Fe  Fe284  1  0.148678  0.236818  0.570961  1
  Fe  Fe285  1  0.243548  0.681741  0.593275  1
  Fe  Fe286  1  0.648678  0.736818  0.570961  1
  Fe  Fe287  1  0.553771  0.292297  0.548837  1
  Fe  Fe288  1  0.053771  0.792297  0.548837  1
  Fe  Fe289  1  0.967540  0.176632  0.547364  1
  Fe  Fe290  1  0.157573  0.066031  0.591852  1
  Fe  Fe291  1  0.467540  0.676632  0.547364  1
  Fe  Fe292  1  0.657573  0.566031  0.591852  1
  Fe  Fe293  1  0.562551  0.121487  0.569659  1
  Fe  Fe294  1  0.062551  0.621487  0.569659  1
  Fe  Fe295  1  0.181053  0.409209  0.540203  1
  Fe  Fe296  1  0.370837  0.298497  0.584682  1
  Fe  Fe297  1  0.681053  0.909209  0.540203  1
  Fe  Fe298  1  0.870837  0.798497  0.584682  1
  Fe  Fe299  1  0.775934  0.353940  0.562475  1
  Fe  Fe300  1  0.275934  0.853940  0.562475  1
  Fe  Fe301  1  0.146478  0.328067  0.610929  1
  Fe  Fe302  1  0.335616  0.217684  0.655481  1
  Fe  Fe303  1  0.646478  0.828067  0.610929  1
  Fe  Fe304  1  0.835616  0.717684  0.655481  1
  Fe  Fe305  1  0.740665  0.273255  0.633286  1
  Fe  Fe306  1  0.240665  0.773255  0.633286  1
  Fe  Fe307  1  0.663992  0.081020  0.633159  1
  Fe  Fe308  1  0.069405  0.136800  0.610903  1
  Fe  Fe309  1  0.163992  0.581020  0.633159  1
  Fe  Fe310  1  0.569405  0.636800  0.610903  1
  Fe  Fe311  1  0.258913  0.025807  0.655436  1
  Fe  Fe312  1  0.758913  0.525807  0.655436  1
  Fe  Fe313  1  0.058268  0.399003  0.630064  1
  Fe  Fe314  1  0.463264  0.454266  0.607955  1
  Fe  Fe315  1  0.558268  0.899003  0.630064  1
  Fe  Fe316  1  0.963264  0.954266  0.607955  1
  Fe  Fe317  1  0.652610  0.343332  0.652573  1
  Fe  Fe318  1  0.152610  0.843332  0.652573  1
  Fe  Fe319  1  0.909634  0.339576  0.653579  1
  Fe  Fe320  1  0.314302  0.394812  0.631529  1
  Fe  Fe321  1  0.409634  0.839576  0.653579  1
  Fe  Fe322  1  0.814302  0.894812  0.631529  1
  Fe  Fe323  1  0.719494  0.450607  0.609433  1
  Fe  Fe324  1  0.219494  0.950607  0.609433  1
  Fe  Fe325  1  0.685669  0.903300  0.656668  1
  Fe  Fe326  1  0.090976  0.958975  0.634857  1
  Fe  Fe327  1  0.185669  0.403300  0.656668  1
  Fe  Fe328  1  0.590976  0.458975  0.634857  1
  Fe  Fe329  1  0.495978  0.014449  0.612543  1
  Fe  Fe330  1  0.995978  0.514449  0.612543  1
  Fe  Fe331  1  0.066905  0.227949  0.651105  1
  Fe  Fe332  1  0.472079  0.283292  0.628956  1
  Fe  Fe333  1  0.566905  0.727949  0.651105  1
  Fe  Fe334  1  0.972079  0.783292  0.628956  1
  Fe  Fe335  1  0.877181  0.338975  0.606394  1
  Fe  Fe336  1  0.377181  0.838975  0.606394  1
  Fe  Fe337  1  0.844417  0.166237  0.637091  1
  Fe  Fe338  1  0.250010  0.221846  0.615145  1
  Fe  Fe339  1  0.344417  0.666237  0.637091  1
  Fe  Fe340  1  0.750010  0.721846  0.615145  1
  Fe  Fe341  1  0.440701  0.110603  0.659608  1
  Fe  Fe342  1  0.940701  0.610603  0.659608  1
  Fe  Fe343  1  0.529039  0.016433  0.659972  1
  Fe  Fe344  1  0.933214  0.070333  0.637427  1
  Fe  Fe345  1  0.029039  0.516433  0.659972  1
  Fe  Fe346  1  0.433214  0.570333  0.637427  1
  Fe  Fe347  1  0.338485  0.126170  0.615513  1
  Fe  Fe348  1  0.838485  0.626170  0.615513  1
  Fe  Fe349  1  0.751677  0.010394  0.613785  1
  Fe  Fe350  1  0.942791  0.899838  0.658355  1
  Fe  Fe351  1  0.251677  0.510394  0.613785  1
  Fe  Fe352  1  0.442791  0.399838  0.658355  1
  Fe  Fe353  1  0.346912  0.955340  0.636149  1
  Fe  Fe354  1  0.846912  0.455340  0.636149  1
  Fe  Fe355  1  0.965679  0.243033  0.606634  1
  Fe  Fe356  1  0.155516  0.132384  0.651407  1
  Fe  Fe357  1  0.465679  0.743033  0.606634  1
  Fe  Fe358  1  0.655516  0.632384  0.651407  1
  Fe  Fe359  1  0.560549  0.187916  0.629334  1
  Fe  Fe360  1  0.060549  0.687916  0.629334  1
  Fe  Fe361  1  0.929753  0.161649  0.677213  1
  Fe  Fe362  1  0.117082  0.053397  0.722729  1
  Fe  Fe363  1  0.429753  0.661649  0.677213  1
  Fe  Fe364  1  0.617082  0.553397  0.722729  1
  Fe  Fe365  1  0.523441  0.105212  0.700079  1
  Fe  Fe366  1  0.023441  0.605212  0.700079  1
  Fe  Fe367  1  0.449213  0.915133  0.699712  1
  Fe  Fe368  1  0.854021  0.970758  0.677258  1
  Fe  Fe369  1  0.949213  0.415133  0.699712  1
  Fe  Fe370  1  0.354021  0.470758  0.677258  1
  Fe  Fe371  1  0.041998  0.859973  0.722434  1
  Fe  Fe372  1  0.541998  0.359973  0.722434  1
  Fe  Fe373  1  0.842132  0.231676  0.696660  1
  Fe  Fe374  1  0.247671  0.287881  0.674587  1
  Fe  Fe375  1  0.342132  0.731676  0.696660  1
  Fe  Fe376  1  0.747671  0.787881  0.674587  1
  Fe  Fe377  1  0.434692  0.176512  0.719277  1
  Fe  Fe378  1  0.934692  0.676512  0.719277  1
  Fe  Fe379  1  0.695368  0.172714  0.720154  1
  Fe  Fe380  1  0.097305  0.226833  0.698258  1
  Fe  Fe381  1  0.195368  0.672714  0.720154  1
  Fe  Fe382  1  0.597305  0.726833  0.698258  1
  Fe  Fe383  1  0.503858  0.284387  0.676301  1
  Fe  Fe384  1  0.003858  0.784387  0.676301  1
  Fe  Fe385  1  0.469986  0.737270  0.723938  1
  Fe  Fe386  1  0.876823  0.792665  0.701491  1
  Fe  Fe387  1  0.969986  0.237270  0.723938  1
  Fe  Fe388  1  0.376823  0.292665  0.701491  1
  Fe  Fe389  1  0.280981  0.848205  0.679524  1
  Fe  Fe390  1  0.780981  0.348205  0.679524  1
  Fe  Fe391  1  0.851123  0.060995  0.719476  1
  Fe  Fe392  1  0.257865  0.119384  0.696559  1
  Fe  Fe393  1  0.351123  0.560995  0.719476  1
  Fe  Fe394  1  0.757865  0.619384  0.696559  1
  Fe  Fe395  1  0.662035  0.172772  0.673018  1
  Fe  Fe396  1  0.162035  0.672772  0.673018  1
  Fe  Fe397  1  0.628249  0.995817  0.704102  1
  Fe  Fe398  1  0.035350  0.056442  0.681504  1
  Fe  Fe399  1  0.128249  0.495817  0.704102  1
  Fe  Fe400  1  0.535350  0.556442  0.681504  1
  Fe  Fe401  1  0.232427  0.973974  0.724387  1
  Fe  Fe402  1  0.732427  0.473974  0.724387  1
  Fe  Fe403  1  0.320495  0.864823  0.728338  1
  Fe  Fe404  1  0.719335  0.904481  0.704218  1
  Fe  Fe405  1  0.820495  0.364823  0.728338  1
  Fe  Fe406  1  0.219335  0.404481  0.704218  1
  Fe  Fe407  1  0.123905  0.961007  0.682212  1
  Fe  Fe408  1  0.623905  0.461007  0.682212  1
  Fe  Fe409  1  0.535906  0.843259  0.680037  1
  Fe  Fe410  1  0.717217  0.743920  0.725388  1
  Fe  Fe411  1  0.035906  0.343259  0.680037  1
  Fe  Fe412  1  0.217217  0.243920  0.725388  1
  Fe  Fe413  1  0.134523  0.790306  0.703714  1
  Fe  Fe414  1  0.634523  0.290306  0.703714  1
  Fe  Fe415  1  0.750670  0.076927  0.673027  1
  Fe  Fe416  1  0.941338  0.967168  0.718228  1
  Fe  Fe417  1  0.250670  0.576927  0.673027  1
  Fe  Fe418  1  0.441338  0.467168  0.718228  1
  Fe  Fe419  1  0.346816  0.020710  0.694530  1
  Fe  Fe420  1  0.846816  0.520710  0.694530  1
  C  C421  1  0.048198  0.091942  0.314157  1
  C  C422  1  0.451759  0.146796  0.292330  1
  C  C423  1  0.548198  0.591942  0.314157  1
  C  C424  1  0.951759  0.646796  0.292330  1
  C  C425  1  0.863507  0.207522  0.270892  1
  C  C426  1  0.363507  0.707522  0.270892  1
  C  C427  1  0.886357  0.850748  0.315519  1
  C  C428  1  0.293435  0.906534  0.293425  1
  C  C429  1  0.386357  0.350748  0.315519  1
  C  C430  1  0.793435  0.406534  0.293425  1
  C  C431  1  0.694898  0.962359  0.271759  1
  C  C432  1  0.194898  0.462359  0.271759  1
  C  C433  1  0.862890  0.055596  0.329625  1
  C  C434  1  0.267476  0.108871  0.307186  1
  C  C435  1  0.362890  0.555596  0.329625  1
  C  C436  1  0.767476  0.608871  0.307186  1
  C  C437  1  0.673528  0.170549  0.286010  1
  C  C438  1  0.173528  0.670549  0.286010  1
  C  C439  1  0.699968  0.811871  0.329863  1
  C  C440  1  0.105046  0.867614  0.307989  1
  C  C441  1  0.199968  0.311871  0.329863  1
  C  C442  1  0.605046  0.367614  0.307989  1
  C  C443  1  0.511045  0.926034  0.286915  1
  C  C444  1  0.011045  0.426034  0.286915  1
  C  C445  1  0.833047  0.925798  0.380813  1
  C  C446  1  0.238102  0.981185  0.358734  1
  C  C447  1  0.333047  0.425798  0.380813  1
  C  C448  1  0.738102  0.481185  0.358734  1
  C  C449  1  0.643426  0.037163  0.336510  1
  C  C450  1  0.143426  0.537163  0.336510  1
  C  C451  1  0.670438  0.683930  0.381885  1
  C  C452  1  0.075725  0.739558  0.359818  1
  C  C453  1  0.170438  0.183930  0.381885  1
  C  C454  1  0.575725  0.239558  0.359818  1
  C  C455  1  0.480489  0.794573  0.337805  1
  C  C456  1  0.980489  0.294573  0.337805  1
  C  C457  1  0.647695  0.888138  0.395942  1
  C  C458  1  0.052779  0.943670  0.373734  1
  C  C459  1  0.147695  0.388138  0.395942  1
  C  C460  1  0.552779  0.443670  0.373734  1
  C  C461  1  0.458101  0.999333  0.351917  1
  C  C462  1  0.958101  0.499333  0.351917  1
  C  C463  1  0.485005  0.646217  0.397123  1
  C  C464  1  0.889912  0.701743  0.374922  1
  C  C465  1  0.985005  0.146217  0.397123  1
  C  C466  1  0.389912  0.201743  0.374922  1
  C  C467  1  0.295306  0.757648  0.353155  1
  C  C468  1  0.795306  0.257648  0.353155  1
  C  C469  1  0.617856  0.759815  0.447457  1
  C  C470  1  0.022937  0.815237  0.425269  1
  C  C471  1  0.117856  0.259815  0.447457  1
  C  C472  1  0.522937  0.315237  0.425269  1
  C  C473  1  0.428244  0.870715  0.403158  1
  C  C474  1  0.928244  0.370715  0.403158  1
  C  C475  1  0.455037  0.517753  0.448593  1
  C  C476  1  0.860188  0.573277  0.426445  1
  C  C477  1  0.955037  0.017753  0.448593  1
  C  C478  1  0.360188  0.073277  0.426445  1
  C  C479  1  0.265256  0.628534  0.404319  1
  C  C480  1  0.765256  0.128534  0.404319  1
  C  C481  1  0.432407  0.722203  0.462591  1
  C  C482  1  0.837427  0.777539  0.440336  1
  C  C483  1  0.932407  0.222203  0.462591  1
  C  C484  1  0.337427  0.277539  0.440336  1
  C  C485  1  0.242565  0.833029  0.418267  1
  C  C486  1  0.742565  0.333029  0.418267  1
  C  C487  1  0.269489  0.480046  0.463732  1
  C  C488  1  0.674640  0.535635  0.441477  1
  C  C489  1  0.769489  0.980046  0.463732  1
  C  C490  1  0.174640  0.035635  0.441477  1
  C  C491  1  0.079891  0.591154  0.419428  1
  C  C492  1  0.579891  0.091154  0.419428  1
  C  C493  1  0.402449  0.593711  0.514042  1
  C  C494  1  0.807606  0.649173  0.491890  1
  C  C495  1  0.902449  0.093711  0.514042  1
  C  C496  1  0.307606  0.149173  0.491890  1
  C  C497  1  0.212779  0.704550  0.469685  1
  C  C498  1  0.712779  0.204550  0.469685  1
  C  C499  1  0.239663  0.351684  0.515205  1
  C  C500  1  0.644792  0.407169  0.493029  1
  C  C501  1  0.739663  0.851684  0.515205  1
  C  C502  1  0.144792  0.907169  0.493029  1
  C  C503  1  0.049891  0.462464  0.470854  1
  C  C504  1  0.549891  0.962464  0.470854  1
  C  C505  1  0.216974  0.556164  0.529146  1
  C  C506  1  0.622072  0.611459  0.506971  1
  C  C507  1  0.716974  0.056164  0.529146  1
  C  C508  1  0.122072  0.111459  0.506971  1
  C  C509  1  0.027202  0.666944  0.484795  1
  C  C510  1  0.527202  0.166944  0.484795  1
  C  C511  1  0.054086  0.314078  0.530315  1
  C  C512  1  0.459258  0.369456  0.508110  1
  C  C513  1  0.554086  0.814078  0.530315  1
  C  C514  1  0.959258  0.869456  0.508110  1
  C  C515  1  0.864416  0.424917  0.485958  1
  C  C516  1  0.364416  0.924917  0.485958  1
  C  C517  1  0.186974  0.427475  0.580572  1
  C  C518  1  0.592224  0.482993  0.558523  1
  C  C519  1  0.686974  0.927475  0.580572  1
  C  C520  1  0.092224  0.982993  0.558523  1
  C  C521  1  0.997375  0.538582  0.536268  1
  C  C522  1  0.497375  0.038582  0.536268  1
  C  C523  1  0.024299  0.185600  0.581733  1
  C  C524  1  0.429438  0.241090  0.559664  1
  C  C525  1  0.524299  0.685600  0.581733  1
  C  C526  1  0.929438  0.741090  0.559664  1
  C  C527  1  0.834458  0.296425  0.537409  1
  C  C528  1  0.334458  0.796425  0.537409  1
  C  C529  1  0.001608  0.390095  0.595681  1
  C  C530  1  0.406676  0.445351  0.573555  1
  C  C531  1  0.501608  0.890095  0.595681  1
  C  C532  1  0.906676  0.945351  0.573555  1
  C  C533  1  0.811828  0.500875  0.551407  1
  C  C534  1  0.311828  0.000875  0.551407  1
  C  C535  1  0.838621  0.147913  0.596842  1
  C  C536  1  0.243928  0.203391  0.574731  1
  C  C537  1  0.338621  0.647913  0.596842  1
  C  C538  1  0.743928  0.703391  0.574731  1
  C  C539  1  0.649009  0.258814  0.552543  1
  C  C540  1  0.149009  0.758814  0.552543  1
  C  C541  1  0.971558  0.260980  0.646845  1
  C  C542  1  0.376952  0.316885  0.625078  1
  C  C543  1  0.471558  0.760980  0.646845  1
  C  C544  1  0.876952  0.816885  0.625078  1
  C  C545  1  0.781859  0.372411  0.602877  1
  C  C546  1  0.281859  0.872411  0.602877  1
  C  C547  1  0.808763  0.019296  0.648083  1
  C  C548  1  0.214085  0.074958  0.626266  1
  C  C549  1  0.308763  0.519296  0.648083  1
  C  C550  1  0.714085  0.574958  0.626266  1
  C  C551  1  0.619170  0.130490  0.604058  1
  C  C552  1  0.119170  0.630490  0.604058  1
  C  C553  1  0.786375  0.224055  0.662195  1
  C  C554  1  0.191140  0.279071  0.640182  1
  C  C555  1  0.286375  0.724055  0.662195  1
  C  C556  1  0.691140  0.779071  0.640182  1
  C  C557  1  0.596427  0.334698  0.618115  1
  C  C558  1  0.096427  0.834698  0.618115  1
  C  C559  1  0.623438  0.981466  0.663490  1
  C  C560  1  0.028763  0.037444  0.641266  1
  C  C561  1  0.123438  0.481466  0.663490  1
  C  C562  1  0.528763  0.537444  0.641266  1
  C  C563  1  0.433817  0.092830  0.619187  1
  C  C564  1  0.933817  0.592830  0.619187  1
  C  C565  1  0.755819  0.092595  0.713085  1
  C  C566  1  0.161819  0.151015  0.692011  1
  C  C567  1  0.255819  0.592595  0.713085  1
  C  C568  1  0.661819  0.651015  0.692011  1
  C  C569  1  0.566897  0.206757  0.670137  1
  C  C570  1  0.066897  0.706757  0.670137  1
  C  C571  1  0.593336  0.848080  0.713990  1
  C  C572  1  0.999388  0.909758  0.692814  1
  C  C573  1  0.093336  0.348080  0.713990  1
  C  C574  1  0.499388  0.409758  0.692814  1
  C  C575  1  0.403975  0.963032  0.670375  1
  C  C576  1  0.903975  0.463032  0.670375  1
  C  C577  1  0.571966  0.056270  0.728241  1
  C  C578  1  0.973429  0.112094  0.706575  1
  C  C579  1  0.071966  0.556270  0.728241  1
  C  C580  1  0.473429  0.612094  0.706575  1
  C  C581  1  0.380507  0.167880  0.684481  1
  C  C582  1  0.880507  0.667880  0.684481  1
  C  C583  1  0.403358  0.811106  0.729108  1
  C  C584  1  0.815105  0.871833  0.707670  1
  C  C585  1  0.903358  0.311106  0.729108  1
  C  C586  1  0.315105  0.371833  0.707670  1
  C  C587  1  0.218666  0.926686  0.685843  1
  C  C588  1  0.718666  0.426686  0.685843  1
