# generated using pymatgen
data_Fe5C2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.71144009
_cell_length_b   20.63845604
_cell_length_c   48.94865060
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.72254692
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5C2
_chemical_formula_sum   'Fe630 C252'
_cell_volume   16285.7066545
_cell_formula_units_Z   126
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  0.808034  0.922602  0.323277  1
  Fe  Fe2  1  0.808034  0.589269  0.323277  1
  Fe  Fe3  1  0.407308  0.966228  0.302159  1
  Fe  Fe4  1  0.808034  0.255935  0.323277  1
  Fe  Fe5  1  0.407308  0.632895  0.302159  1
  Fe  Fe6  1  0.001385  0.006713  0.281355  1
  Fe  Fe7  1  0.407308  0.299562  0.302159  1
  Fe  Fe8  1  0.001385  0.673380  0.281355  1
  Fe  Fe9  1  0.001385  0.340047  0.281355  1
  Fe  Fe10  1  0.647841  0.801206  0.321479  1
  Fe  Fe11  1  0.647841  0.467873  0.321479  1
  Fe  Fe12  1  0.243483  0.842172  0.299719  1
  Fe  Fe13  1  0.647841  0.134540  0.321479  1
  Fe  Fe14  1  0.243483  0.508839  0.299719  1
  Fe  Fe15  1  0.047900  0.760274  0.342297  1
  Fe  Fe16  1  0.243483  0.175505  0.299719  1
  Fe  Fe17  1  0.047900  0.426941  0.342297  1
  Fe  Fe18  1  0.047900  0.093607  0.342297  1
  Fe  Fe19  1  0.515979  0.999907  0.325569  1
  Fe  Fe20  1  0.515979  0.666574  0.325569  1
  Fe  Fe21  1  0.113326  0.039807  0.304058  1
  Fe  Fe22  1  0.515979  0.333241  0.325569  1
  Fe  Fe23  1  0.113326  0.706473  0.304058  1
  Fe  Fe24  1  0.711546  0.081122  0.283190  1
  Fe  Fe25  1  0.113326  0.373140  0.304058  1
  Fe  Fe26  1  0.711546  0.747789  0.283190  1
  Fe  Fe27  1  0.711546  0.414455  0.283190  1
  Fe  Fe28  1  0.659499  0.013114  0.318910  1
  Fe  Fe29  1  0.659499  0.679781  0.318910  1
  Fe  Fe30  1  0.257890  0.053493  0.297336  1
  Fe  Fe31  1  0.659499  0.346448  0.318910  1
  Fe  Fe32  1  0.257890  0.720160  0.297336  1
  Fe  Fe33  1  0.058317  0.972848  0.339154  1
  Fe  Fe34  1  0.257890  0.386827  0.297336  1
  Fe  Fe35  1  0.058317  0.639514  0.339154  1
  Fe  Fe36  1  0.058317  0.306181  0.339154  1
  Fe  Fe37  1  0.797408  0.712224  0.326793  1
  Fe  Fe38  1  0.797408  0.378891  0.326793  1
  Fe  Fe39  1  0.396255  0.752550  0.305824  1
  Fe  Fe40  1  0.797408  0.045558  0.326793  1
  Fe  Fe41  1  0.396255  0.419216  0.305824  1
  Fe  Fe42  1  0.995431  0.794841  0.284578  1
  Fe  Fe43  1  0.396255  0.085883  0.305824  1
  Fe  Fe44  1  0.995431  0.461508  0.284578  1
  Fe  Fe45  1  0.995431  0.128174  0.284578  1
  Fe  Fe46  1  0.678663  0.901694  0.335067  1
  Fe  Fe47  1  0.678663  0.568361  0.335067  1
  Fe  Fe48  1  0.275661  0.943462  0.314363  1
  Fe  Fe49  1  0.678663  0.235027  0.335067  1
  Fe  Fe50  1  0.275661  0.610128  0.314363  1
  Fe  Fe51  1  0.878225  0.968904  0.292035  1
  Fe  Fe52  1  0.275661  0.276795  0.314363  1
  Fe  Fe53  1  0.878225  0.635571  0.292035  1
  Fe  Fe54  1  0.878225  0.302238  0.292035  1
  Fe  Fe55  1  0.684741  0.941676  0.283200  1
  Fe  Fe56  1  0.684741  0.608342  0.283200  1
  Fe  Fe57  1  0.484221  0.858947  0.324984  1
  Fe  Fe58  1  0.684741  0.275009  0.283200  1
  Fe  Fe59  1  0.484221  0.525614  0.324984  1
  Fe  Fe60  1  0.082115  0.900152  0.302936  1
  Fe  Fe61  1  0.484221  0.192281  0.324984  1
  Fe  Fe62  1  0.082115  0.566819  0.302936  1
  Fe  Fe63  1  0.082115  0.233486  0.302936  1
  Fe  Fe64  1  0.779041  0.822999  0.309674  1
  Fe  Fe65  1  0.779041  0.489666  0.309674  1
  Fe  Fe66  1  0.375323  0.864685  0.288828  1
  Fe  Fe67  1  0.779041  0.156332  0.309674  1
  Fe  Fe68  1  0.375323  0.531352  0.288828  1
  Fe  Fe69  1  0.177794  0.784171  0.331325  1
  Fe  Fe70  1  0.375323  0.198019  0.288828  1
  Fe  Fe71  1  0.177794  0.450838  0.331325  1
  Fe  Fe72  1  0.177794  0.117505  0.331325  1
  Fe  Fe73  1  0.938433  0.725684  0.319647  1
  Fe  Fe74  1  0.938433  0.392350  0.319647  1
  Fe  Fe75  1  0.538195  0.766644  0.298306  1
  Fe  Fe76  1  0.938433  0.059017  0.319647  1
  Fe  Fe77  1  0.538195  0.433311  0.298306  1
  Fe  Fe78  1  0.340500  0.686091  0.340209  1
  Fe  Fe79  1  0.538195  0.099977  0.298306  1
  Fe  Fe80  1  0.340500  0.352758  0.340209  1
  Fe  Fe81  1  0.340500  0.019424  0.340209  1
  Fe  Fe82  1  0.570171  0.907160  0.299698  1
  Fe  Fe83  1  0.570171  0.573826  0.299698  1
  Fe  Fe84  1  0.372433  0.826062  0.341189  1
  Fe  Fe85  1  0.570171  0.240493  0.299698  1
  Fe  Fe86  1  0.372433  0.492728  0.341189  1
  Fe  Fe87  1  0.971564  0.866883  0.320898  1
  Fe  Fe88  1  0.372433  0.159395  0.341189  1
  Fe  Fe89  1  0.971564  0.533549  0.320898  1
  Fe  Fe90  1  0.971564  0.200216  0.320898  1
  Fe  Fe91  1  0.011601  0.800979  0.386232  1
  Fe  Fe92  1  0.011601  0.467646  0.386232  1
  Fe  Fe93  1  0.610546  0.842143  0.365227  1
  Fe  Fe94  1  0.011601  0.134312  0.386232  1
  Fe  Fe95  1  0.610546  0.508810  0.365227  1
  Fe  Fe96  1  0.209558  0.883472  0.344546  1
  Fe  Fe97  1  0.610546  0.175476  0.365227  1
  Fe  Fe98  1  0.209558  0.550139  0.344546  1
  Fe  Fe99  1  0.209558  0.216805  0.344546  1
  Fe  Fe100  1  0.850394  0.678082  0.384115  1
  Fe  Fe101  1  0.850394  0.344749  0.384115  1
  Fe  Fe102  1  0.449301  0.719478  0.362815  1
  Fe  Fe103  1  0.850394  0.011415  0.384115  1
  Fe  Fe104  1  0.449301  0.386144  0.362815  1
  Fe  Fe105  1  0.251778  0.636922  0.404479  1
  Fe  Fe106  1  0.449301  0.052811  0.362815  1
  Fe  Fe107  1  0.251778  0.303589  0.404479  1
  Fe  Fe108  1  0.251778  0.970256  0.404479  1
  Fe  Fe109  1  0.719063  0.876393  0.388079  1
  Fe  Fe110  1  0.719063  0.543059  0.388079  1
  Fe  Fe111  1  0.318672  0.917613  0.366758  1
  Fe  Fe112  1  0.719063  0.209726  0.388079  1
  Fe  Fe113  1  0.318672  0.584280  0.366758  1
  Fe  Fe114  1  0.916539  0.958703  0.346323  1
  Fe  Fe115  1  0.318672  0.250946  0.366758  1
  Fe  Fe116  1  0.916539  0.625370  0.346323  1
  Fe  Fe117  1  0.916539  0.292037  0.346323  1
  Fe  Fe118  1  0.862100  0.890267  0.381126  1
  Fe  Fe119  1  0.862100  0.556934  0.381126  1
  Fe  Fe120  1  0.460767  0.932161  0.359725  1
  Fe  Fe121  1  0.862100  0.223601  0.381126  1
  Fe  Fe122  1  0.460767  0.598828  0.359725  1
  Fe  Fe123  1  0.264113  0.848978  0.401751  1
  Fe  Fe124  1  0.460767  0.265495  0.359725  1
  Fe  Fe125  1  0.264113  0.515645  0.401751  1
  Fe  Fe126  1  0.264113  0.182312  0.401751  1
  Fe  Fe127  1  0.999554  0.588994  0.389255  1
  Fe  Fe128  1  0.999554  0.255660  0.389255  1
  Fe  Fe129  1  0.598600  0.629956  0.368305  1
  Fe  Fe130  1  0.999554  0.922327  0.389255  1
  Fe  Fe131  1  0.598600  0.296623  0.368305  1
  Fe  Fe132  1  0.197059  0.671914  0.347161  1
  Fe  Fe133  1  0.598600  0.963289  0.368305  1
  Fe  Fe134  1  0.197059  0.338581  0.347161  1
  Fe  Fe135  1  0.197059  0.005247  0.347161  1
  Fe  Fe136  1  0.881854  0.778915  0.397740  1
  Fe  Fe137  1  0.881854  0.445582  0.397740  1
  Fe  Fe138  1  0.480838  0.820201  0.376470  1
  Fe  Fe139  1  0.881854  0.112248  0.397740  1
  Fe  Fe140  1  0.480838  0.486867  0.376470  1
  Fe  Fe141  1  0.079450  0.860917  0.355976  1
  Fe  Fe142  1  0.480838  0.153534  0.376470  1
  Fe  Fe143  1  0.079450  0.527584  0.355976  1
  Fe  Fe144  1  0.079450  0.194251  0.355976  1
  Fe  Fe145  1  0.885915  0.817972  0.345232  1
  Fe  Fe146  1  0.885915  0.484638  0.345232  1
  Fe  Fe147  1  0.687596  0.735687  0.386919  1
  Fe  Fe148  1  0.885915  0.151305  0.345232  1
  Fe  Fe149  1  0.687596  0.402354  0.386919  1
  Fe  Fe150  1  0.286090  0.777499  0.365426  1
  Fe  Fe151  1  0.687596  0.069020  0.386919  1
  Fe  Fe152  1  0.286090  0.444166  0.365426  1
  Fe  Fe153  1  0.286090  0.110832  0.365426  1
  Fe  Fe154  1  0.980355  0.700539  0.372932  1
  Fe  Fe155  1  0.980355  0.367205  0.372932  1
  Fe  Fe156  1  0.579675  0.741852  0.351746  1
  Fe  Fe157  1  0.980355  0.033872  0.372932  1
  Fe  Fe158  1  0.579675  0.408519  0.351746  1
  Fe  Fe159  1  0.380985  0.659900  0.393285  1
  Fe  Fe160  1  0.579675  0.075186  0.351746  1
  Fe  Fe161  1  0.380985  0.326566  0.393285  1
  Fe  Fe162  1  0.380985  0.993233  0.393285  1
  Fe  Fe163  1  0.143428  0.602725  0.382130  1
  Fe  Fe164  1  0.143428  0.269391  0.382130  1
  Fe  Fe165  1  0.742679  0.643646  0.361410  1
  Fe  Fe166  1  0.143428  0.936058  0.382130  1
  Fe  Fe167  1  0.742679  0.310313  0.361410  1
  Fe  Fe168  1  0.543783  0.562010  0.402725  1
  Fe  Fe169  1  0.742679  0.976980  0.361410  1
  Fe  Fe170  1  0.543783  0.228676  0.402725  1
  Fe  Fe171  1  0.543783  0.895343  0.402725  1
  Fe  Fe172  1  0.772603  0.784994  0.362399  1
  Fe  Fe173  1  0.772603  0.451660  0.362399  1
  Fe  Fe174  1  0.575453  0.702544  0.403913  1
  Fe  Fe175  1  0.772603  0.118327  0.362399  1
  Fe  Fe176  1  0.575453  0.369210  0.403913  1
  Fe  Fe177  1  0.174318  0.743731  0.383097  1
  Fe  Fe178  1  0.575453  0.035877  0.403913  1
  Fe  Fe179  1  0.174318  0.410398  0.383097  1
  Fe  Fe180  1  0.174318  0.077064  0.383097  1
  Fe  Fe181  1  0.215149  0.677727  0.448696  1
  Fe  Fe182  1  0.215149  0.344394  0.448696  1
  Fe  Fe183  1  0.814007  0.718894  0.427944  1
  Fe  Fe184  1  0.215149  0.011061  0.448696  1
  Fe  Fe185  1  0.814007  0.385560  0.427944  1
  Fe  Fe186  1  0.412501  0.760379  0.406893  1
  Fe  Fe187  1  0.814007  0.052227  0.427944  1
  Fe  Fe188  1  0.412501  0.427046  0.406893  1
  Fe  Fe189  1  0.412501  0.093713  0.406893  1
  Fe  Fe190  1  0.053973  0.554664  0.446423  1
  Fe  Fe191  1  0.053973  0.221331  0.446423  1
  Fe  Fe192  1  0.652555  0.595711  0.425537  1
  Fe  Fe193  1  0.053973  0.887997  0.446423  1
  Fe  Fe194  1  0.652555  0.262377  0.425537  1
  Fe  Fe195  1  0.455091  0.513476  0.467106  1
  Fe  Fe196  1  0.652555  0.929044  0.425537  1
  Fe  Fe197  1  0.455091  0.180143  0.467106  1
  Fe  Fe198  1  0.455091  0.846810  0.467106  1
  Fe  Fe199  1  0.922569  0.752881  0.450622  1
  Fe  Fe200  1  0.922569  0.419547  0.450622  1
  Fe  Fe201  1  0.521378  0.794110  0.429639  1
  Fe  Fe202  1  0.922569  0.086214  0.450622  1
  Fe  Fe203  1  0.521378  0.460777  0.429639  1
  Fe  Fe204  1  0.120221  0.835230  0.408906  1
  Fe  Fe205  1  0.521378  0.127444  0.429639  1
  Fe  Fe206  1  0.120221  0.501896  0.408906  1
  Fe  Fe207  1  0.120221  0.168563  0.408906  1
  Fe  Fe208  1  0.066216  0.766705  0.443541  1
  Fe  Fe209  1  0.066216  0.433371  0.443541  1
  Fe  Fe210  1  0.664438  0.808129  0.422620  1
  Fe  Fe211  1  0.066216  0.100038  0.443541  1
  Fe  Fe212  1  0.664438  0.474795  0.422620  1
  Fe  Fe213  1  0.466969  0.725792  0.464189  1
  Fe  Fe214  1  0.664438  0.141462  0.422620  1
  Fe  Fe215  1  0.466969  0.392459  0.464189  1
  Fe  Fe216  1  0.466969  0.059126  0.464189  1
  Fe  Fe217  1  0.203008  0.465609  0.451574  1
  Fe  Fe218  1  0.203008  0.132275  0.451574  1
  Fe  Fe219  1  0.801912  0.506565  0.430934  1
  Fe  Fe220  1  0.203008  0.798942  0.451574  1
  Fe  Fe221  1  0.801912  0.173231  0.430934  1
  Fe  Fe222  1  0.400819  0.547989  0.409771  1
  Fe  Fe223  1  0.801912  0.839898  0.430934  1
  Fe  Fe224  1  0.400819  0.214656  0.409771  1
  Fe  Fe225  1  0.400819  0.881323  0.409771  1
  Fe  Fe226  1  0.085439  0.655107  0.459964  1
  Fe  Fe227  1  0.085439  0.321774  0.459964  1
  Fe  Fe228  1  0.684320  0.696272  0.439140  1
  Fe  Fe229  1  0.085439  0.988441  0.459964  1
  Fe  Fe230  1  0.684320  0.362939  0.439140  1
  Fe  Fe231  1  0.283157  0.737427  0.418097  1
  Fe  Fe232  1  0.684320  0.029606  0.439140  1
  Fe  Fe233  1  0.283157  0.404094  0.418097  1
  Fe  Fe234  1  0.283157  0.070761  0.418097  1
  Fe  Fe235  1  0.088866  0.694535  0.407697  1
  Fe  Fe236  1  0.088866  0.361202  0.407697  1
  Fe  Fe237  1  0.891156  0.612137  0.449581  1
  Fe  Fe238  1  0.088866  0.027868  0.407697  1
  Fe  Fe239  1  0.891156  0.278804  0.449581  1
  Fe  Fe240  1  0.489874  0.653518  0.428444  1
  Fe  Fe241  1  0.891156  0.945470  0.449581  1
  Fe  Fe242  1  0.489874  0.320185  0.428444  1
  Fe  Fe243  1  0.489874  0.986851  0.428444  1
  Fe  Fe244  1  0.183753  0.577241  0.435158  1
  Fe  Fe245  1  0.183753  0.243907  0.435158  1
  Fe  Fe246  1  0.782271  0.618385  0.414401  1
  Fe  Fe247  1  0.183753  0.910574  0.435158  1
  Fe  Fe248  1  0.782271  0.285051  0.414401  1
  Fe  Fe249  1  0.584452  0.536192  0.455944  1
  Fe  Fe250  1  0.782271  0.951718  0.414401  1
  Fe  Fe251  1  0.584452  0.202859  0.455944  1
  Fe  Fe252  1  0.584452  0.869525  0.455944  1
  Fe  Fe253  1  0.346329  0.479588  0.444428  1
  Fe  Fe254  1  0.346329  0.146255  0.444428  1
  Fe  Fe255  1  0.945733  0.520440  0.423883  1
  Fe  Fe256  1  0.346329  0.812921  0.444428  1
  Fe  Fe257  1  0.945733  0.187107  0.423883  1
  Fe  Fe258  1  0.747563  0.438334  0.465422  1
  Fe  Fe259  1  0.945733  0.853774  0.423883  1
  Fe  Fe260  1  0.747563  0.105001  0.465422  1
  Fe  Fe261  1  0.747563  0.771668  0.465422  1
  Fe  Fe262  1  0.976853  0.661177  0.424906  1
  Fe  Fe263  1  0.976853  0.327844  0.424906  1
  Fe  Fe264  1  0.779043  0.578920  0.466554  1
  Fe  Fe265  1  0.976853  0.994510  0.424906  1
  Fe  Fe266  1  0.779043  0.245586  0.466554  1
  Fe  Fe267  1  0.377821  0.620311  0.445560  1
  Fe  Fe268  1  0.779043  0.912253  0.466554  1
  Fe  Fe269  1  0.377821  0.286978  0.445560  1
  Fe  Fe270  1  0.377821  0.953645  0.445560  1
  Fe  Fe271  1  0.418618  0.554358  0.511153  1
  Fe  Fe272  1  0.418618  0.221024  0.511153  1
  Fe  Fe273  1  0.017386  0.595399  0.490482  1
  Fe  Fe274  1  0.418618  0.887691  0.511153  1
  Fe  Fe275  1  0.017386  0.262066  0.490482  1
  Fe  Fe276  1  0.616227  0.636718  0.469531  1
  Fe  Fe277  1  0.017386  0.928732  0.490482  1
  Fe  Fe278  1  0.616227  0.303384  0.469531  1
  Fe  Fe279  1  0.616227  0.970051  0.469531  1
  Fe  Fe280  1  0.257411  0.431188  0.508792  1
  Fe  Fe281  1  0.257411  0.097854  0.508792  1
  Fe  Fe282  1  0.856179  0.472229  0.488120  1
  Fe  Fe283  1  0.257411  0.764521  0.508792  1
  Fe  Fe284  1  0.856179  0.138895  0.488120  1
  Fe  Fe285  1  0.658570  0.389869  0.529742  1
  Fe  Fe286  1  0.856179  0.805562  0.488120  1
  Fe  Fe287  1  0.658570  0.056535  0.529742  1
  Fe  Fe288  1  0.658570  0.723202  0.529742  1
  Fe  Fe289  1  0.125948  0.629463  0.513024  1
  Fe  Fe290  1  0.125948  0.296129  0.513024  1
  Fe  Fe291  1  0.724933  0.670537  0.492280  1
  Fe  Fe292  1  0.125948  0.962796  0.513024  1
  Fe  Fe293  1  0.724933  0.337204  0.492280  1
  Fe  Fe294  1  0.323804  0.711787  0.471256  1
  Fe  Fe295  1  0.724933  0.003871  0.492280  1
  Fe  Fe296  1  0.323804  0.378454  0.471256  1
  Fe  Fe297  1  0.323804  0.045120  0.471256  1
  Fe  Fe298  1  0.269520  0.643342  0.505924  1
  Fe  Fe299  1  0.269520  0.310009  0.505924  1
  Fe  Fe300  1  0.868181  0.684541  0.485192  1
  Fe  Fe301  1  0.269520  0.976675  0.505924  1
  Fe  Fe302  1  0.868181  0.351208  0.485192  1
  Fe  Fe303  1  0.670453  0.602299  0.526790  1
  Fe  Fe304  1  0.868181  0.017875  0.485192  1
  Fe  Fe305  1  0.670453  0.268965  0.526790  1
  Fe  Fe306  1  0.670453  0.935632  0.526790  1
  Fe  Fe307  1  0.406616  0.342045  0.514081  1
  Fe  Fe308  1  0.406616  0.008712  0.514081  1
  Fe  Fe309  1  0.005277  0.383245  0.493349  1
  Fe  Fe310  1  0.406616  0.675378  0.514081  1
  Fe  Fe311  1  0.005277  0.049911  0.493349  1
  Fe  Fe312  1  0.604344  0.424288  0.472483  1
  Fe  Fe313  1  0.005277  0.716578  0.493349  1
  Fe  Fe314  1  0.604344  0.090954  0.472483  1
  Fe  Fe315  1  0.604344  0.757621  0.472483  1
  Fe  Fe316  1  0.288849  0.531681  0.522379  1
  Fe  Fe317  1  0.288849  0.198348  0.522379  1
  Fe  Fe318  1  0.887828  0.572760  0.501677  1
  Fe  Fe319  1  0.288849  0.865014  0.522379  1
  Fe  Fe320  1  0.887828  0.239427  0.501677  1
  Fe  Fe321  1  0.486678  0.613994  0.480704  1
  Fe  Fe322  1  0.887828  0.906094  0.501677  1
  Fe  Fe323  1  0.486678  0.280661  0.480704  1
  Fe  Fe324  1  0.486678  0.947328  0.480704  1
  Fe  Fe325  1  0.292236  0.571194  0.470120  1
  Fe  Fe326  1  0.292236  0.237861  0.470120  1
  Fe  Fe327  1  0.094542  0.488736  0.511970  1
  Fe  Fe328  1  0.292236  0.904527  0.470120  1
  Fe  Fe329  1  0.094542  0.155403  0.511970  1
  Fe  Fe330  1  0.693483  0.529871  0.491157  1
  Fe  Fe331  1  0.094542  0.822070  0.511970  1
  Fe  Fe332  1  0.693483  0.196537  0.491157  1
  Fe  Fe333  1  0.693483  0.863204  0.491157  1
  Fe  Fe334  1  0.386969  0.453826  0.497596  1
  Fe  Fe335  1  0.386969  0.120493  0.497596  1
  Fe  Fe336  1  0.985948  0.494905  0.476894  1
  Fe  Fe337  1  0.386969  0.787159  0.497596  1
  Fe  Fe338  1  0.985948  0.161572  0.476894  1
  Fe  Fe339  1  0.788119  0.412592  0.518569  1
  Fe  Fe340  1  0.985948  0.828239  0.476894  1
  Fe  Fe341  1  0.788119  0.079259  0.518569  1
  Fe  Fe342  1  0.788119  0.745925  0.518569  1
  Fe  Fe343  1  0.549864  0.356049  0.506993  1
  Fe  Fe344  1  0.549864  0.022716  0.506993  1
  Fe  Fe345  1  0.148849  0.397124  0.486249  1
  Fe  Fe346  1  0.549864  0.689382  0.506993  1
  Fe  Fe347  1  0.148849  0.063790  0.486249  1
  Fe  Fe348  1  0.950993  0.314800  0.528017  1
  Fe  Fe349  1  0.148849  0.730457  0.486249  1
  Fe  Fe350  1  0.950993  0.981466  0.528017  1
  Fe  Fe351  1  0.950993  0.648133  0.528017  1
  Fe  Fe352  1  0.180255  0.537850  0.487303  1
  Fe  Fe353  1  0.180255  0.204517  0.487303  1
  Fe  Fe354  1  0.982561  0.455393  0.529153  1
  Fe  Fe355  1  0.180255  0.871184  0.487303  1
  Fe  Fe356  1  0.982561  0.122059  0.529153  1
  Fe  Fe357  1  0.581313  0.496716  0.508116  1
  Fe  Fe358  1  0.982561  0.788726  0.529153  1
  Fe  Fe359  1  0.581313  0.163382  0.508116  1
  Fe  Fe360  1  0.581313  0.830049  0.508116  1
  Fe  Fe361  1  0.622242  0.430876  0.573736  1
  Fe  Fe362  1  0.622242  0.097542  0.573736  1
  Fe  Fe363  1  0.220824  0.471922  0.552850  1
  Fe  Fe364  1  0.622242  0.764209  0.573736  1
  Fe  Fe365  1  0.220824  0.138589  0.552850  1
  Fe  Fe366  1  0.819706  0.513110  0.532167  1
  Fe  Fe367  1  0.220824  0.805256  0.552850  1
  Fe  Fe368  1  0.819706  0.179777  0.532167  1
  Fe  Fe369  1  0.819706  0.846444  0.532167  1
  Fe  Fe370  1  0.460790  0.307693  0.571329  1
  Fe  Fe371  1  0.460790  0.974360  0.571329  1
  Fe  Fe372  1  0.059648  0.348859  0.550577  1
  Fe  Fe373  1  0.460790  0.641026  0.571329  1
  Fe  Fe374  1  0.059648  0.015526  0.550577  1
  Fe  Fe375  1  0.862296  0.266207  0.592380  1
  Fe  Fe376  1  0.059648  0.682192  0.550577  1
  Fe  Fe377  1  0.862296  0.932874  0.592380  1
  Fe  Fe378  1  0.862296  0.599541  0.592380  1
  Fe  Fe379  1  0.329064  0.506146  0.575390  1
  Fe  Fe380  1  0.329064  0.172813  0.575390  1
  Fe  Fe381  1  0.928468  0.546998  0.554846  1
  Fe  Fe382  1  0.329064  0.839480  0.575390  1
  Fe  Fe383  1  0.928468  0.213665  0.554846  1
  Fe  Fe384  1  0.527234  0.588252  0.533851  1
  Fe  Fe385  1  0.928468  0.880332  0.554846  1
  Fe  Fe386  1  0.527234  0.254919  0.533851  1
  Fe  Fe387  1  0.527234  0.921586  0.533851  1
  Fe  Fe388  1  0.472885  0.520022  0.568339  1
  Fe  Fe389  1  0.472885  0.186689  0.568339  1
  Fe  Fe390  1  0.071789  0.560978  0.547699  1
  Fe  Fe391  1  0.472885  0.853355  0.568339  1
  Fe  Fe392  1  0.071789  0.227644  0.547699  1
  Fe  Fe393  1  0.873977  0.478597  0.589502  1
  Fe  Fe394  1  0.071789  0.894311  0.547699  1
  Fe  Fe395  1  0.873977  0.145264  0.589502  1
  Fe  Fe396  1  0.873977  0.811930  0.589502  1
  Fe  Fe397  1  0.610358  0.218458  0.576653  1
  Fe  Fe398  1  0.610358  0.885125  0.576653  1
  Fe  Fe399  1  0.208580  0.259882  0.555732  1
  Fe  Fe400  1  0.610358  0.551791  0.576653  1
  Fe  Fe401  1  0.208580  0.926548  0.555732  1
  Fe  Fe402  1  0.807828  0.300794  0.535084  1
  Fe  Fe403  1  0.208580  0.593215  0.555732  1
  Fe  Fe404  1  0.807828  0.967461  0.535084  1
  Fe  Fe405  1  0.807828  0.634127  0.535084  1
  Fe  Fe406  1  0.492526  0.408202  0.584873  1
  Fe  Fe407  1  0.492526  0.074868  0.584873  1
  Fe  Fe408  1  0.091044  0.449346  0.564115  1
  Fe  Fe409  1  0.492526  0.741535  0.584873  1
  Fe  Fe410  1  0.091044  0.116013  0.564115  1
  Fe  Fe411  1  0.690345  0.490394  0.543329  1
  Fe  Fe412  1  0.091044  0.782679  0.564115  1
  Fe  Fe413  1  0.690345  0.157061  0.543329  1
  Fe  Fe414  1  0.690345  0.823728  0.543329  1
  Fe  Fe415  1  0.495754  0.447667  0.532719  1
  Fe  Fe416  1  0.495754  0.114333  0.532719  1
  Fe  Fe417  1  0.297944  0.365409  0.574367  1
  Fe  Fe418  1  0.495754  0.781000  0.532719  1
  Fe  Fe419  1  0.297944  0.032076  0.574367  1
  Fe  Fe420  1  0.896976  0.406275  0.553714  1
  Fe  Fe421  1  0.297944  0.698743  0.574367  1
  Fe  Fe422  1  0.896976  0.072942  0.553714  1
  Fe  Fe423  1  0.896976  0.739608  0.553714  1
  Fe  Fe424  1  0.590476  0.330314  0.560133  1
  Fe  Fe425  1  0.590476  0.996981  0.560133  1
  Fe  Fe426  1  0.189358  0.371479  0.539309  1
  Fe  Fe427  1  0.590476  0.663648  0.560133  1
  Fe  Fe428  1  0.189358  0.038146  0.539309  1
  Fe  Fe429  1  0.991640  0.289159  0.581176  1
  Fe  Fe430  1  0.189358  0.704812  0.539309  1
  Fe  Fe431  1  0.991640  0.955826  0.581176  1
  Fe  Fe432  1  0.991640  0.622492  0.581176  1
  Fe  Fe433  1  0.753419  0.232476  0.569634  1
  Fe  Fe434  1  0.753419  0.899143  0.569634  1
  Fe  Fe435  1  0.352228  0.273706  0.548651  1
  Fe  Fe436  1  0.753419  0.565809  0.569634  1
  Fe  Fe437  1  0.352228  0.940372  0.548651  1
  Fe  Fe438  1  0.154576  0.191357  0.590367  1
  Fe  Fe439  1  0.352228  0.607039  0.548651  1
  Fe  Fe440  1  0.154576  0.858023  0.590367  1
  Fe  Fe441  1  0.154576  0.524690  0.590367  1
  Fe  Fe442  1  0.383640  0.414450  0.549692  1
  Fe  Fe443  1  0.383640  0.081116  0.549692  1
  Fe  Fe444  1  0.185931  0.332051  0.591576  1
  Fe  Fe445  1  0.383640  0.747783  0.549692  1
  Fe  Fe446  1  0.185931  0.998718  0.591576  1
  Fe  Fe447  1  0.784922  0.373069  0.570829  1
  Fe  Fe448  1  0.185931  0.665385  0.591576  1
  Fe  Fe449  1  0.784922  0.039735  0.570829  1
  Fe  Fe450  1  0.784922  0.706402  0.570829  1
  Fe  Fe451  1  0.825496  0.307109  0.636458  1
  Fe  Fe452  1  0.825496  0.973775  0.636458  1
  Fe  Fe453  1  0.424403  0.348504  0.615159  1
  Fe  Fe454  1  0.825496  0.640442  0.636458  1
  Fe  Fe455  1  0.424403  0.015171  0.615159  1
  Fe  Fe456  1  0.023019  0.389664  0.594794  1
  Fe  Fe457  1  0.424403  0.681838  0.615159  1
  Fe  Fe458  1  0.023019  0.056331  0.594794  1
  Fe  Fe459  1  0.023019  0.722997  0.594794  1
  Fe  Fe460  1  0.664251  0.184443  0.634046  1
  Fe  Fe461  1  0.664251  0.851110  0.634046  1
  Fe  Fe462  1  0.263196  0.225607  0.613041  1
  Fe  Fe463  1  0.664251  0.517777  0.634046  1
  Fe  Fe464  1  0.263196  0.892274  0.613041  1
  Fe  Fe465  1  0.065239  0.143114  0.654727  1
  Fe  Fe466  1  0.263196  0.558941  0.613041  1
  Fe  Fe467  1  0.065239  0.809781  0.654727  1
  Fe  Fe468  1  0.065239  0.476448  0.654727  1
  Fe  Fe469  1  0.532118  0.382940  0.637863  1
  Fe  Fe470  1  0.532118  0.049607  0.637863  1
  Fe  Fe471  1  0.131368  0.423862  0.617143  1
  Fe  Fe472  1  0.532118  0.716273  0.637863  1
  Fe  Fe473  1  0.131368  0.090529  0.617143  1
  Fe  Fe474  1  0.731014  0.464577  0.596549  1
  Fe  Fe475  1  0.131368  0.757195  0.617143  1
  Fe  Fe476  1  0.731014  0.131243  0.596549  1
  Fe  Fe477  1  0.731014  0.797910  0.596549  1
  Fe  Fe478  1  0.676197  0.396631  0.630968  1
  Fe  Fe479  1  0.676197  0.063297  0.630968  1
  Fe  Fe480  1  0.275243  0.437593  0.610018  1
  Fe  Fe481  1  0.676197  0.729964  0.630968  1
  Fe  Fe482  1  0.275243  0.104259  0.610018  1
  Fe  Fe483  1  0.077738  0.354673  0.652112  1
  Fe  Fe484  1  0.275243  0.770926  0.610018  1
  Fe  Fe485  1  0.077738  0.021339  0.652112  1
  Fe  Fe486  1  0.077738  0.688006  0.652112  1
  Fe  Fe487  1  0.814030  0.094425  0.639548  1
  Fe  Fe488  1  0.814030  0.761092  0.639548  1
  Fe  Fe489  1  0.412697  0.136319  0.618148  1
  Fe  Fe490  1  0.814030  0.427758  0.639548  1
  Fe  Fe491  1  0.412697  0.802986  0.618148  1
  Fe  Fe492  1  0.010684  0.177608  0.597522  1
  Fe  Fe493  1  0.412697  0.469652  0.618148  1
  Fe  Fe494  1  0.010684  0.844275  0.597522  1
  Fe  Fe495  1  0.010684  0.510941  0.597522  1
  Fe  Fe496  1  0.695122  0.284734  0.647527  1
  Fe  Fe497  1  0.695122  0.951401  0.647527  1
  Fe  Fe498  1  0.294441  0.326048  0.626342  1
  Fe  Fe499  1  0.695122  0.618067  0.647527  1
  Fe  Fe500  1  0.294441  0.992714  0.626342  1
  Fe  Fe501  1  0.893812  0.366687  0.605989  1
  Fe  Fe502  1  0.294441  0.659381  0.626342  1
  Fe  Fe503  1  0.893812  0.033353  0.605989  1
  Fe  Fe504  1  0.893812  0.700020  0.605989  1
  Fe  Fe505  1  0.699344  0.324043  0.595360  1
  Fe  Fe506  1  0.699344  0.990710  0.595360  1
  Fe  Fe507  1  0.502194  0.241593  0.636874  1
  Fe  Fe508  1  0.699344  0.657376  0.595360  1
  Fe  Fe509  1  0.502194  0.908259  0.636874  1
  Fe  Fe510  1  0.100479  0.282855  0.616176  1
  Fe  Fe511  1  0.502194  0.574926  0.636874  1
  Fe  Fe512  1  0.100479  0.949522  0.616176  1
  Fe  Fe513  1  0.100479  0.616189  0.616176  1
  Fe  Fe514  1  0.793959  0.206386  0.622803  1
  Fe  Fe515  1  0.793959  0.873052  0.622803  1
  Fe  Fe516  1  0.392943  0.247671  0.601533  1
  Fe  Fe517  1  0.793959  0.539719  0.622803  1
  Fe  Fe518  1  0.392943  0.914338  0.601533  1
  Fe  Fe519  1  0.195347  0.165669  0.643297  1
  Fe  Fe520  1  0.392943  0.581005  0.601533  1
  Fe  Fe521  1  0.195347  0.832336  0.643297  1
  Fe  Fe522  1  0.195347  0.499003  0.643297  1
  Fe  Fe523  1  0.956125  0.108973  0.632515  1
  Fe  Fe524  1  0.956125  0.775640  0.632515  1
  Fe  Fe525  1  0.555734  0.150194  0.611194  1
  Fe  Fe526  1  0.956125  0.442307  0.632515  1
  Fe  Fe527  1  0.555734  0.816860  0.611194  1
  Fe  Fe528  1  0.358258  0.067883  0.652950  1
  Fe  Fe529  1  0.555734  0.483527  0.611194  1
  Fe  Fe530  1  0.358258  0.734550  0.652950  1
  Fe  Fe531  1  0.358258  0.401216  0.652950  1
  Fe  Fe532  1  0.587201  0.290899  0.612355  1
  Fe  Fe533  1  0.587201  0.957566  0.612355  1
  Fe  Fe534  1  0.388882  0.208615  0.654041  1
  Fe  Fe535  1  0.587201  0.624233  0.612355  1
  Fe  Fe536  1  0.388882  0.875281  0.654041  1
  Fe  Fe537  1  0.988707  0.249087  0.633847  1
  Fe  Fe538  1  0.388882  0.541948  0.654041  1
  Fe  Fe539  1  0.988707  0.915754  0.633847  1
  Fe  Fe540  1  0.988707  0.582421  0.633847  1
  Fe  Fe541  1  0.031313  0.184415  0.699554  1
  Fe  Fe542  1  0.031313  0.851081  0.699554  1
  Fe  Fe543  1  0.626956  0.225380  0.677794  1
  Fe  Fe544  1  0.031313  0.517748  0.699554  1
  Fe  Fe545  1  0.626956  0.892047  0.677794  1
  Fe  Fe546  1  0.226897  0.266312  0.656977  1
  Fe  Fe547  1  0.626956  0.558713  0.677794  1
  Fe  Fe548  1  0.226897  0.932979  0.656977  1
  Fe  Fe549  1  0.226897  0.599646  0.656977  1
  Fe  Fe550  1  0.867489  0.060358  0.697115  1
  Fe  Fe551  1  0.867489  0.727025  0.697115  1
  Fe  Fe552  1  0.466763  0.103985  0.675996  1
  Fe  Fe553  1  0.867489  0.393692  0.697115  1
  Fe  Fe554  1  0.466763  0.770651  0.675996  1
  Fe  Fe555  1  0.273412  0.019873  0.717918  1
  Fe  Fe556  1  0.466763  0.437318  0.675996  1
  Fe  Fe557  1  0.273412  0.686540  0.717918  1
  Fe  Fe558  1  0.273412  0.353207  0.717918  1
  Fe  Fe559  1  0.736601  0.259942  0.700967  1
  Fe  Fe560  1  0.736601  0.926609  0.700967  1
  Fe  Fe561  1  0.336364  0.300903  0.679626  1
  Fe  Fe562  1  0.736601  0.593276  0.700967  1
  Fe  Fe563  1  0.336364  0.967569  0.679626  1
  Fe  Fe564  1  0.934297  0.340496  0.659064  1
  Fe  Fe565  1  0.336364  0.634236  0.679626  1
  Fe  Fe566  1  0.934297  0.007162  0.659064  1
  Fe  Fe567  1  0.934297  0.673829  0.659064  1
  Fe  Fe568  1  0.878542  0.274037  0.693450  1
  Fe  Fe569  1  0.878542  0.940703  0.693450  1
  Fe  Fe570  1  0.477389  0.314362  0.672481  1
  Fe  Fe571  1  0.878542  0.607370  0.693450  1
  Fe  Fe572  1  0.477389  0.981029  0.672481  1
  Fe  Fe573  1  0.279366  0.231745  0.714695  1
  Fe  Fe574  1  0.477389  0.647695  0.672481  1
  Fe  Fe575  1  0.279366  0.898412  0.714695  1
  Fe  Fe576  1  0.279366  0.565079  0.714695  1
  Fe  Fe577  1  0.016907  0.973093  0.701938  1
  Fe  Fe578  1  0.016907  0.639760  0.701938  1
  Fe  Fe579  1  0.615298  0.013472  0.680363  1
  Fe  Fe580  1  0.016907  0.306426  0.701938  1
  Fe  Fe581  1  0.615298  0.680139  0.680363  1
  Fe  Fe582  1  0.216480  0.053739  0.660119  1
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  Fe  Fe584  1  0.216480  0.720405  0.660119  1
  Fe  Fe585  1  0.216480  0.387072  0.660119  1
  Fe  Fe586  1  0.899474  0.161901  0.710445  1
  Fe  Fe587  1  0.899474  0.828568  0.710445  1
  Fe  Fe588  1  0.495756  0.203587  0.689599  1
  Fe  Fe589  1  0.899474  0.495234  0.710445  1
  Fe  Fe590  1  0.495756  0.870254  0.689599  1
  Fe  Fe591  1  0.097003  0.242415  0.667948  1
  Fe  Fe592  1  0.495756  0.536921  0.689599  1
  Fe  Fe593  1  0.097003  0.909082  0.667948  1
  Fe  Fe594  1  0.097003  0.575749  0.667948  1
  Fe  Fe595  1  0.902364  0.200525  0.658084  1
  Fe  Fe596  1  0.902364  0.867191  0.658084  1
  Fe  Fe597  1  0.704626  0.119427  0.699575  1
  Fe  Fe598  1  0.902364  0.533858  0.658084  1
  Fe  Fe599  1  0.704626  0.786093  0.699575  1
  Fe  Fe600  1  0.303233  0.159704  0.678375  1
  Fe  Fe601  1  0.704626  0.452760  0.699575  1
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  Fe  Fe603  1  0.303233  0.493037  0.678375  1
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  Fe  Fe605  1  0.999136  0.749791  0.684911  1
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  Fe  Fe614  1  0.161471  0.653446  0.695215  1
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  Fe  Fe619  1  0.758818  0.360013  0.673704  1
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  Fe  Fe629  1  0.192682  0.793101  0.696337  1
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  C  C632  1  0.578914  0.667498  0.292769  1
  C  C633  1  0.379471  0.920858  0.333653  1
  C  C634  1  0.578914  0.334164  0.292769  1
  C  C635  1  0.379471  0.587524  0.333653  1
  C  C636  1  0.977546  0.960325  0.313128  1
  C  C637  1  0.379471  0.254191  0.333653  1
  C  C638  1  0.977546  0.626991  0.313128  1
  C  C639  1  0.977546  0.293658  0.313128  1
  C  C640  1  0.895622  0.815545  0.306063  1
  C  C641  1  0.895622  0.482212  0.306063  1
  C  C642  1  0.492063  0.857086  0.285789  1
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  C  C644  1  0.492063  0.523753  0.285789  1
  C  C645  1  0.294291  0.775144  0.326211  1
  C  C646  1  0.492063  0.190420  0.285789  1
  C  C647  1  0.294291  0.441811  0.326211  1
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  C  C649  1  0.561866  0.910188  0.338895  1
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  C  C651  1  0.159133  0.950910  0.318203  1
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  C  C663  1  0.075848  0.806042  0.310979  1
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  C  C665  1  0.075848  0.472709  0.310979  1
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  C  C667  1  0.781082  0.878122  0.355128  1
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  C  C669  1  0.583044  0.796477  0.396665  1
  C  C670  1  0.781082  0.211455  0.355128  1
  C  C671  1  0.583044  0.463144  0.396665  1
  C  C672  1  0.182021  0.837801  0.375978  1
  C  C673  1  0.583044  0.129810  0.396665  1
  C  C674  1  0.182021  0.504467  0.375978  1
  C  C675  1  0.182021  0.171134  0.375978  1
  C  C676  1  0.096956  0.692049  0.368490  1
  C  C677  1  0.096956  0.358716  0.368490  1
  C  C678  1  0.696514  0.733003  0.347732  1
  C  C679  1  0.096956  0.025383  0.368490  1
  C  C680  1  0.696514  0.399670  0.347732  1
  C  C681  1  0.497685  0.651552  0.389231  1
  C  C682  1  0.696514  0.066337  0.347732  1
  C  C683  1  0.497685  0.318218  0.389231  1
  C  C684  1  0.497685  0.984885  0.389231  1
  C  C685  1  0.765185  0.786900  0.401616  1
  C  C686  1  0.765185  0.453567  0.401616  1
  C  C687  1  0.364200  0.828134  0.380401  1
  C  C688  1  0.765185  0.120233  0.401616  1
  C  C689  1  0.364200  0.494801  0.380401  1
  C  C690  1  0.962738  0.869408  0.360074  1
  C  C691  1  0.364200  0.161467  0.380401  1
  C  C692  1  0.962738  0.536075  0.360074  1
  C  C693  1  0.962738  0.202742  0.360074  1
  C  C694  1  0.877787  0.724741  0.352963  1
  C  C695  1  0.877787  0.391407  0.352963  1
  C  C696  1  0.680047  0.641759  0.394211  1
  C  C697  1  0.877787  0.058074  0.352963  1
  C  C698  1  0.680047  0.308426  0.394211  1
  C  C699  1  0.278734  0.683108  0.373107  1
  C  C700  1  0.680047  0.975093  0.394211  1
  C  C701  1  0.278734  0.349775  0.373107  1
  C  C702  1  0.278734  0.016441  0.373107  1
  C  C703  1  0.984475  0.755192  0.417695  1
  C  C704  1  0.984475  0.421859  0.417695  1
  C  C705  1  0.786588  0.672925  0.459305  1
  C  C706  1  0.984475  0.088525  0.417695  1
  C  C707  1  0.786588  0.339592  0.459305  1
  C  C708  1  0.385396  0.714285  0.438273  1
  C  C709  1  0.786588  0.006258  0.459305  1
  C  C710  1  0.385396  0.380952  0.438273  1
  C  C711  1  0.385396  0.047618  0.438273  1
  C  C712  1  0.300335  0.569116  0.430913  1
  C  C713  1  0.300335  0.235783  0.430913  1
  C  C714  1  0.899020  0.609867  0.410373  1
  C  C715  1  0.300335  0.902450  0.430913  1
  C  C716  1  0.899020  0.276534  0.410373  1
  C  C717  1  0.701168  0.527843  0.451943  1
  C  C718  1  0.899020  0.943200  0.410373  1
  C  C719  1  0.701168  0.194510  0.451943  1
  C  C720  1  0.701168  0.861176  0.451943  1
  C  C721  1  0.968793  0.663362  0.464112  1
  C  C722  1  0.968793  0.330029  0.464112  1
  C  C723  1  0.567607  0.704584  0.443124  1
  C  C724  1  0.968793  0.996696  0.464112  1
  C  C725  1  0.567607  0.371251  0.443124  1
  C  C726  1  0.166539  0.745641  0.422310  1
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  C  C730  1  0.081414  0.600563  0.415045  1
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  C  C732  1  0.883617  0.518219  0.456769  1
  C  C733  1  0.081414  0.933897  0.415045  1
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  C  C863  1  0.514486  0.699920  0.701322  1
  C  C864  1  0.514486  0.366587  0.701322  1
  C  C865  1  0.782733  0.169500  0.713484  1
  C  C866  1  0.782733  0.836167  0.713484  1
  C  C867  1  0.379175  0.211042  0.693211  1
  C  C868  1  0.782733  0.502834  0.713484  1
  C  C869  1  0.379175  0.877708  0.693211  1
  C  C870  1  0.980506  0.251442  0.673062  1
  C  C871  1  0.379175  0.544375  0.693211  1
  C  C872  1  0.980506  0.918109  0.673062  1
  C  C873  1  0.980506  0.584776  0.673062  1
  C  C874  1  0.895326  0.105729  0.665620  1
  C  C875  1  0.895326  0.772396  0.665620  1
  C  C876  1  0.695883  0.025755  0.706504  1
  C  C877  1  0.895326  0.439062  0.665620  1
  C  C878  1  0.695883  0.692422  0.706504  1
  C  C879  1  0.297251  0.066262  0.686145  1
  C  C880  1  0.695883  0.359089  0.706504  1
  C  C881  1  0.297251  0.732928  0.686145  1
  C  C882  1  0.297251  0.399595  0.686145  1
