# generated using pymatgen
data_Fe503C216
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.13711959
_cell_length_b   20.13762180
_cell_length_c   16.32086615
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe503C216
_chemical_formula_sum   'Fe503 C216'
_cell_volume   5731.64606195
_cell_formula_units_Z   1
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  0.148935  0.184415  0.313418  1
  Fe  Fe2  1  0.148891  0.184459  0.563434  1
  Fe  Fe3  1  0.149252  0.184098  0.812990  1
  Fe  Fe4  1  0.149022  0.517487  0.063581  1
  Fe  Fe5  1  0.148924  0.517711  0.313679  1
  Fe  Fe6  1  0.149051  0.517850  0.563499  1
  Fe  Fe7  1  0.149011  0.517673  0.813741  1
  Fe  Fe8  1  0.148848  0.850885  0.063633  1
  Fe  Fe9  1  0.149006  0.851091  0.313564  1
  Fe  Fe10  1  0.148929  0.851032  0.563477  1
  Fe  Fe11  1  0.149063  0.851329  0.814113  1
  Fe  Fe12  1  0.482465  0.184502  0.063632  1
  Fe  Fe13  1  0.482260  0.184344  0.313565  1
  Fe  Fe14  1  0.482318  0.184421  0.563477  1
  Fe  Fe15  1  0.482021  0.184287  0.814114  1
  Fe  Fe16  1  0.482364  0.518052  0.062991  1
  Fe  Fe17  1  0.482288  0.517707  0.313656  1
  Fe  Fe18  1  0.482328  0.517785  0.563511  1
  Fe  Fe19  1  0.482320  0.518006  0.813519  1
  Fe  Fe20  1  0.482213  0.851137  0.063629  1
  Fe  Fe21  1  0.482345  0.851006  0.313528  1
  Fe  Fe22  1  0.482269  0.851081  0.563823  1
  Fe  Fe23  1  0.482189  0.851162  0.813394  1
  Fe  Fe24  1  0.815863  0.184328  0.063581  1
  Fe  Fe25  1  0.815639  0.184426  0.313679  1
  Fe  Fe26  1  0.815500  0.184299  0.563499  1
  Fe  Fe27  1  0.815677  0.184339  0.813741  1
  Fe  Fe28  1  0.815659  0.517691  0.063621  1
  Fe  Fe29  1  0.815649  0.517701  0.313596  1
  Fe  Fe30  1  0.815623  0.517727  0.563814  1
  Fe  Fe31  1  0.815678  0.517672  0.813265  1
  Fe  Fe32  1  0.815298  0.850986  0.062991  1
  Fe  Fe33  1  0.815643  0.851062  0.313656  1
  Fe  Fe34  1  0.815565  0.851022  0.563511  1
  Fe  Fe35  1  0.815344  0.851030  0.813518  1
  Fe  Fe36  1  0.184504  0.035480  0.187755  1
  Fe  Fe37  1  0.184503  0.035356  0.438898  1
  Fe  Fe38  1  0.184600  0.035612  0.687592  1
  Fe  Fe39  1  0.184131  0.036018  0.939698  1
  Fe  Fe40  1  0.184481  0.369150  0.188510  1
  Fe  Fe41  1  0.184370  0.368807  0.438392  1
  Fe  Fe42  1  0.184477  0.369005  0.688391  1
  Fe  Fe43  1  0.184507  0.368888  0.937504  1
  Fe  Fe44  1  0.184383  0.702052  0.188626  1
  Fe  Fe45  1  0.184389  0.702175  0.438482  1
  Fe  Fe46  1  0.184331  0.702157  0.688832  1
  Fe  Fe47  1  0.184533  0.702308  0.938265  1
  Fe  Fe48  1  0.517786  0.035466  0.188662  1
  Fe  Fe49  1  0.517769  0.035524  0.438333  1
  Fe  Fe50  1  0.517551  0.035447  0.689032  1
  Fe  Fe51  1  0.517634  0.035453  0.938612  1
  Fe  Fe52  1  0.517931  0.368972  0.188839  1
  Fe  Fe53  1  0.517637  0.368740  0.438504  1
  Fe  Fe54  1  0.517616  0.368737  0.688808  1
  Fe  Fe55  1  0.517813  0.368788  0.938624  1
  Fe  Fe56  1  0.517761  0.702109  0.188328  1
  Fe  Fe57  1  0.517726  0.702148  0.438672  1
  Fe  Fe58  1  0.517675  0.702161  0.688471  1
  Fe  Fe59  1  0.517716  0.702210  0.938659  1
  Fe  Fe60  1  0.850821  0.035177  0.188738  1
  Fe  Fe61  1  0.851033  0.035523  0.438358  1
  Fe  Fe62  1  0.850922  0.035424  0.688287  1
  Fe  Fe63  1  0.851195  0.035250  0.938952  1
  Fe  Fe64  1  0.851078  0.368785  0.188451  1
  Fe  Fe65  1  0.851045  0.368795  0.438760  1
  Fe  Fe66  1  0.851130  0.368750  0.688366  1
  Fe  Fe67  1  0.851230  0.368646  0.938856  1
  Fe  Fe68  1  0.851026  0.701939  0.188949  1
  Fe  Fe69  1  0.851133  0.702279  0.438350  1
  Fe  Fe70  1  0.851067  0.702136  0.688766  1
  Fe  Fe71  1  0.850977  0.701918  0.938415  1
  Fe  Fe72  1  0.039931  0.079874  0.242187  1
  Fe  Fe73  1  0.040146  0.080394  0.491289  1
  Fe  Fe74  1  0.039791  0.079718  0.740678  1
  Fe  Fe75  1  0.041946  0.083131  0.991145  1
  Fe  Fe76  1  0.040247  0.413950  0.241406  1
  Fe  Fe77  1  0.040206  0.413834  0.491367  1
  Fe  Fe78  1  0.040432  0.414146  0.741317  1
  Fe  Fe79  1  0.040691  0.413556  0.991462  1
  Fe  Fe80  1  0.040235  0.747118  0.241454  1
  Fe  Fe81  1  0.040270  0.747239  0.491285  1
  Fe  Fe82  1  0.040533  0.747602  0.741366  1
  Fe  Fe83  1  0.040273  0.747066  0.991457  1
  Fe  Fe84  1  0.373607  0.080445  0.241398  1
  Fe  Fe85  1  0.373711  0.080679  0.491268  1
  Fe  Fe86  1  0.373473  0.080871  0.741498  1
  Fe  Fe87  1  0.373267  0.080399  0.991624  1
  Fe  Fe88  1  0.373497  0.413954  0.241233  1
  Fe  Fe89  1  0.373611  0.413981  0.491377  1
  Fe  Fe90  1  0.373927  0.414447  0.741530  1
  Fe  Fe91  1  0.373395  0.413380  0.991453  1
  Fe  Fe92  1  0.373601  0.747170  0.241316  1
  Fe  Fe93  1  0.373715  0.747408  0.491363  1
  Fe  Fe94  1  0.373542  0.747186  0.741398  1
  Fe  Fe95  1  0.373672  0.747414  0.991292  1
  Fe  Fe96  1  0.707096  0.080816  0.241282  1
  Fe  Fe97  1  0.706944  0.080556  0.491402  1
  Fe  Fe98  1  0.706959  0.080699  0.741399  1
  Fe  Fe99  1  0.706920  0.080385  0.991422  1
  Fe  Fe100  1  0.707029  0.413975  0.241457  1
  Fe  Fe101  1  0.706992  0.414033  0.491488  1
  Fe  Fe102  1  0.706893  0.413587  0.741392  1
  Fe  Fe103  1  0.707279  0.414112  0.991295  1
  Fe  Fe104  1  0.707047  0.747295  0.241308  1
  Fe  Fe105  1  0.707057  0.747259  0.491342  1
  Fe  Fe106  1  0.707002  0.747338  0.741404  1
  Fe  Fe107  1  0.706865  0.746978  0.991385  1
  Fe  Fe108  1  0.293515  0.039831  0.116570  1
  Fe  Fe109  1  0.292712  0.040634  0.366070  1
  Fe  Fe110  1  0.293348  0.039997  0.616503  1
  Fe  Fe111  1  0.292330  0.041016  0.866540  1
  Fe  Fe112  1  0.293271  0.374592  0.116283  1
  Fe  Fe113  1  0.293002  0.373522  0.366349  1
  Fe  Fe114  1  0.293101  0.373783  0.616191  1
  Fe  Fe115  1  0.293695  0.374007  0.865930  1
  Fe  Fe116  1  0.292907  0.706956  0.116287  1
  Fe  Fe117  1  0.293109  0.706893  0.366362  1
  Fe  Fe118  1  0.292845  0.707160  0.616377  1
  Fe  Fe119  1  0.293128  0.706849  0.866434  1
  Fe  Fe120  1  0.626390  0.040438  0.116286  1
  Fe  Fe121  1  0.626452  0.040237  0.366362  1
  Fe  Fe122  1  0.626186  0.040501  0.616377  1
  Fe  Fe123  1  0.626497  0.040218  0.866434  1
  Fe  Fe124  1  0.626320  0.373846  0.116369  1
  Fe  Fe125  1  0.626545  0.373487  0.366591  1
  Fe  Fe126  1  0.626335  0.373755  0.616276  1
  Fe  Fe127  1  0.626548  0.373604  0.866320  1
  Fe  Fe128  1  0.626494  0.706852  0.116271  1
  Fe  Fe129  1  0.626299  0.707047  0.366204  1
  Fe  Fe130  1  0.626428  0.706918  0.616312  1
  Fe  Fe131  1  0.626225  0.707120  0.866296  1
  Fe  Fe132  1  0.958755  0.040075  0.116282  1
  Fe  Fe133  1  0.959824  0.040343  0.366349  1
  Fe  Fe134  1  0.959563  0.040245  0.616191  1
  Fe  Fe135  1  0.959339  0.039651  0.865930  1
  Fe  Fe136  1  0.959803  0.373543  0.116480  1
  Fe  Fe137  1  0.959561  0.373785  0.366439  1
  Fe  Fe138  1  0.959846  0.373500  0.616403  1
  Fe  Fe139  1  0.959801  0.373544  0.866149  1
  Fe  Fe140  1  0.959500  0.707026  0.116369  1
  Fe  Fe141  1  0.959858  0.706801  0.366591  1
  Fe  Fe142  1  0.959590  0.707010  0.616276  1
  Fe  Fe143  1  0.959741  0.706798  0.866320  1
  Fe  Fe144  1  0.078437  0.038898  0.117542  1
  Fe  Fe145  1  0.081383  0.040746  0.365867  1
  Fe  Fe146  1  0.079974  0.039969  0.616043  1
  Fe  Fe147  1  0.082388  0.041278  0.866296  1
  Fe  Fe148  1  0.080842  0.373808  0.116298  1
  Fe  Fe149  1  0.080347  0.373510  0.366407  1
  Fe  Fe150  1  0.080673  0.373616  0.616271  1
  Fe  Fe151  1  0.080672  0.373356  0.866304  1
  Fe  Fe152  1  0.080781  0.706943  0.116293  1
  Fe  Fe153  1  0.080491  0.706969  0.366389  1
  Fe  Fe154  1  0.080861  0.707123  0.616411  1
  Fe  Fe155  1  0.080258  0.706751  0.866542  1
  Fe  Fe156  1  0.414202  0.040266  0.116414  1
  Fe  Fe157  1  0.413733  0.040180  0.366346  1
  Fe  Fe158  1  0.414217  0.040438  0.616306  1
  Fe  Fe159  1  0.413446  0.040420  0.866414  1
  Fe  Fe160  1  0.414393  0.373793  0.116345  1
  Fe  Fe161  1  0.413662  0.373449  0.366336  1
  Fe  Fe162  1  0.414176  0.373806  0.616419  1
  Fe  Fe163  1  0.413819  0.373623  0.866473  1
  Fe  Fe164  1  0.413687  0.706776  0.116326  1
  Fe  Fe165  1  0.414234  0.707137  0.366250  1
  Fe  Fe166  1  0.413813  0.707040  0.616387  1
  Fe  Fe167  1  0.413999  0.707124  0.866345  1
  Fe  Fe168  1  0.747401  0.040362  0.116447  1
  Fe  Fe169  1  0.747050  0.040189  0.366430  1
  Fe  Fe170  1  0.747112  0.040295  0.616240  1
  Fe  Fe171  1  0.747496  0.040448  0.866353  1
  Fe  Fe172  1  0.747168  0.373501  0.116363  1
  Fe  Fe173  1  0.747496  0.373783  0.366356  1
  Fe  Fe174  1  0.747080  0.373541  0.616445  1
  Fe  Fe175  1  0.747593  0.373697  0.866406  1
  Fe  Fe176  1  0.747533  0.707016  0.116383  1
  Fe  Fe177  1  0.747122  0.706886  0.366524  1
  Fe  Fe178  1  0.747378  0.707042  0.616385  1
  Fe  Fe179  1  0.747011  0.706847  0.866404  1
  Fe  Fe180  1  0.253477  0.293421  0.242190  1
  Fe  Fe181  1  0.252956  0.293206  0.491291  1
  Fe  Fe182  1  0.253631  0.293561  0.740679  1
  Fe  Fe183  1  0.250217  0.291406  0.991147  1
  Fe  Fe184  1  0.252533  0.626256  0.241284  1
  Fe  Fe185  1  0.252794  0.626408  0.491403  1
  Fe  Fe186  1  0.252650  0.626392  0.741400  1
  Fe  Fe187  1  0.252964  0.626432  0.991423  1
  Fe  Fe188  1  0.252906  0.959745  0.241400  1
  Fe  Fe189  1  0.252670  0.959640  0.491269  1
  Fe  Fe190  1  0.252480  0.959879  0.741499  1
  Fe  Fe191  1  0.252949  0.960083  0.991625  1
  Fe  Fe192  1  0.586231  0.293117  0.241455  1
  Fe  Fe193  1  0.586110  0.293082  0.491286  1
  Fe  Fe194  1  0.585747  0.292819  0.741368  1
  Fe  Fe195  1  0.586284  0.293079  0.991458  1
  Fe  Fe196  1  0.586055  0.626304  0.241309  1
  Fe  Fe197  1  0.586091  0.626295  0.491343  1
  Fe  Fe198  1  0.586011  0.626349  0.741405  1
  Fe  Fe199  1  0.586371  0.626487  0.991386  1
  Fe  Fe200  1  0.586180  0.959751  0.241318  1
  Fe  Fe201  1  0.585942  0.959637  0.491364  1
  Fe  Fe202  1  0.586164  0.959810  0.741399  1
  Fe  Fe203  1  0.585936  0.959679  0.991294  1
  Fe  Fe204  1  0.919400  0.293105  0.241407  1
  Fe  Fe205  1  0.919515  0.293146  0.491368  1
  Fe  Fe206  1  0.919204  0.292920  0.741318  1
  Fe  Fe207  1  0.919793  0.292660  0.991463  1
  Fe  Fe208  1  0.919375  0.626323  0.241458  1
  Fe  Fe209  1  0.919317  0.626360  0.491489  1
  Fe  Fe210  1  0.919762  0.626459  0.741393  1
  Fe  Fe211  1  0.919238  0.626072  0.991296  1
  Fe  Fe212  1  0.919395  0.959855  0.241234  1
  Fe  Fe213  1  0.919369  0.959740  0.491378  1
  Fe  Fe214  1  0.918903  0.959425  0.741531  1
  Fe  Fe215  1  0.919969  0.959956  0.991454  1
  Fe  Fe216  1  0.040473  0.292881  0.240962  1
  Fe  Fe217  1  0.040424  0.292929  0.491220  1
  Fe  Fe218  1  0.040007  0.293346  0.741174  1
  Fe  Fe219  1  0.040609  0.292744  0.990720  1
  Fe  Fe220  1  0.040350  0.626230  0.241242  1
  Fe  Fe221  1  0.040301  0.626452  0.491371  1
  Fe  Fe222  1  0.040497  0.626348  0.741444  1
  Fe  Fe223  1  0.040236  0.626415  0.991439  1
  Fe  Fe224  1  0.040565  0.960073  0.241438  1
  Fe  Fe225  1  0.040289  0.959680  0.491226  1
  Fe  Fe226  1  0.040122  0.959328  0.741286  1
  Fe  Fe227  1  0.039856  0.959079  0.991617  1
  Fe  Fe228  1  0.373281  0.292788  0.241438  1
  Fe  Fe229  1  0.373673  0.293065  0.491227  1
  Fe  Fe230  1  0.374025  0.293231  0.741286  1
  Fe  Fe231  1  0.374273  0.293497  0.991618  1
  Fe  Fe232  1  0.373726  0.626317  0.241172  1
  Fe  Fe233  1  0.373634  0.626458  0.491237  1
  Fe  Fe234  1  0.373843  0.626365  0.741242  1
  Fe  Fe235  1  0.373599  0.626460  0.991384  1
  Fe  Fe236  1  0.373618  0.959735  0.241426  1
  Fe  Fe237  1  0.373669  0.959685  0.491305  1
  Fe  Fe238  1  0.373496  0.959857  0.741233  1
  Fe  Fe239  1  0.373717  0.959636  0.991469  1
  Fe  Fe240  1  0.707123  0.293004  0.241242  1
  Fe  Fe241  1  0.706902  0.293052  0.491371  1
  Fe  Fe242  1  0.707005  0.292856  0.741444  1
  Fe  Fe243  1  0.706939  0.293118  0.991439  1
  Fe  Fe244  1  0.706982  0.626371  0.241494  1
  Fe  Fe245  1  0.706970  0.626383  0.491471  1
  Fe  Fe246  1  0.706906  0.626447  0.741310  1
  Fe  Fe247  1  0.707237  0.626117  0.991270  1
  Fe  Fe248  1  0.707036  0.959627  0.241172  1
  Fe  Fe249  1  0.706896  0.959719  0.491237  1
  Fe  Fe250  1  0.706988  0.959511  0.741242  1
  Fe  Fe251  1  0.706894  0.959754  0.991384  1
  Fe  Fe252  1  0.294450  0.254915  0.117542  1
  Fe  Fe253  1  0.292601  0.251967  0.365867  1
  Fe  Fe254  1  0.293379  0.253375  0.616042  1
  Fe  Fe255  1  0.292069  0.250960  0.866295  1
  Fe  Fe256  1  0.292986  0.585948  0.116446  1
  Fe  Fe257  1  0.293159  0.586301  0.366429  1
  Fe  Fe258  1  0.293053  0.586238  0.616239  1
  Fe  Fe259  1  0.292900  0.585854  0.866351  1
  Fe  Fe260  1  0.293082  0.919148  0.116413  1
  Fe  Fe261  1  0.293168  0.919617  0.366345  1
  Fe  Fe262  1  0.292910  0.919132  0.616305  1
  Fe  Fe263  1  0.292928  0.919903  0.866413  1
  Fe  Fe264  1  0.626405  0.252569  0.116291  1
  Fe  Fe265  1  0.626378  0.252859  0.366388  1
  Fe  Fe266  1  0.626225  0.252489  0.616410  1
  Fe  Fe267  1  0.626596  0.253092  0.866541  1
  Fe  Fe268  1  0.626331  0.585816  0.116382  1
  Fe  Fe269  1  0.626462  0.586228  0.366523  1
  Fe  Fe270  1  0.626306  0.585972  0.616384  1
  Fe  Fe271  1  0.626501  0.586339  0.866403  1
  Fe  Fe272  1  0.626571  0.919663  0.116325  1
  Fe  Fe273  1  0.626211  0.919115  0.366249  1
  Fe  Fe274  1  0.626307  0.919537  0.616385  1
  Fe  Fe275  1  0.626224  0.919351  0.866344  1
  Fe  Fe276  1  0.959540  0.252508  0.116296  1
  Fe  Fe277  1  0.959838  0.253003  0.366405  1
  Fe  Fe278  1  0.959731  0.252676  0.616270  1
  Fe  Fe279  1  0.959992  0.252677  0.866303  1
  Fe  Fe280  1  0.959847  0.586181  0.116362  1
  Fe  Fe281  1  0.959565  0.585854  0.366354  1
  Fe  Fe282  1  0.959807  0.586270  0.616444  1
  Fe  Fe283  1  0.959651  0.585756  0.866404  1
  Fe  Fe284  1  0.959555  0.918957  0.116343  1
  Fe  Fe285  1  0.959899  0.919687  0.366335  1
  Fe  Fe286  1  0.959542  0.919173  0.616418  1
  Fe  Fe287  1  0.959724  0.919531  0.866472  1
  Fe  Fe288  1  0.037584  0.185013  0.062824  1
  Fe  Fe289  1  0.035596  0.184300  0.313482  1
  Fe  Fe290  1  0.035436  0.184531  0.563437  1
  Fe  Fe291  1  0.035811  0.184661  0.812072  1
  Fe  Fe292  1  0.035580  0.517683  0.063427  1
  Fe  Fe293  1  0.035433  0.517741  0.313620  1
  Fe  Fe294  1  0.035555  0.517812  0.563565  1
  Fe  Fe295  1  0.035384  0.517479  0.813990  1
  Fe  Fe296  1  0.035189  0.850586  0.063462  1
  Fe  Fe297  1  0.035583  0.851229  0.313553  1
  Fe  Fe298  1  0.035472  0.851035  0.563332  1
  Fe  Fe299  1  0.035314  0.851152  0.814051  1
  Fe  Fe300  1  0.369405  0.184716  0.063843  1
  Fe  Fe301  1  0.368657  0.184282  0.313333  1
  Fe  Fe302  1  0.368904  0.184403  0.563587  1
  Fe  Fe303  1  0.368601  0.184404  0.813538  1
  Fe  Fe304  1  0.368565  0.517385  0.063616  1
  Fe  Fe305  1  0.368893  0.517802  0.313555  1
  Fe  Fe306  1  0.368861  0.517747  0.563463  1
  Fe  Fe307  1  0.368683  0.517578  0.814033  1
  Fe  Fe308  1  0.368679  0.851015  0.063634  1
  Fe  Fe309  1  0.368892  0.851077  0.313474  1
  Fe  Fe310  1  0.368751  0.851103  0.563554  1
  Fe  Fe311  1  0.368695  0.851182  0.813610  1
  Fe  Fe312  1  0.702298  0.184431  0.063283  1
  Fe  Fe313  1  0.702177  0.184449  0.313648  1
  Fe  Fe314  1  0.702056  0.184375  0.563494  1
  Fe  Fe315  1  0.702247  0.184434  0.813712  1
  Fe  Fe316  1  0.702166  0.517721  0.063729  1
  Fe  Fe317  1  0.702229  0.517770  0.313662  1
  Fe  Fe318  1  0.702111  0.517686  0.563695  1
  Fe  Fe319  1  0.702231  0.517640  0.813386  1
  Fe  Fe320  1  0.702105  0.850960  0.063538  1
  Fe  Fe321  1  0.702059  0.850996  0.313488  1
  Fe  Fe322  1  0.702148  0.851007  0.563467  1
  Fe  Fe323  1  0.701989  0.851007  0.813739  1
  Fe  Fe324  1  0.297873  0.148847  0.187760  1
  Fe  Fe325  1  0.297997  0.148848  0.438905  1
  Fe  Fe326  1  0.297742  0.148752  0.687598  1
  Fe  Fe327  1  0.297337  0.149222  0.939707  1
  Fe  Fe328  1  0.298177  0.482530  0.188745  1
  Fe  Fe329  1  0.297830  0.482319  0.438364  1
  Fe  Fe330  1  0.297930  0.482430  0.688293  1
  Fe  Fe331  1  0.298103  0.482157  0.938959  1
  Fe  Fe332  1  0.297888  0.815565  0.188669  1
  Fe  Fe333  1  0.297830  0.815583  0.438339  1
  Fe  Fe334  1  0.297907  0.815800  0.689038  1
  Fe  Fe335  1  0.297901  0.815718  0.938618  1
  Fe  Fe336  1  0.631301  0.148968  0.188632  1
  Fe  Fe337  1  0.631180  0.148963  0.438488  1
  Fe  Fe338  1  0.631196  0.149021  0.688839  1
  Fe  Fe339  1  0.631045  0.148819  0.938270  1
  Fe  Fe340  1  0.631415  0.482326  0.188956  1
  Fe  Fe341  1  0.631074  0.482218  0.438356  1
  Fe  Fe342  1  0.631218  0.482284  0.688773  1
  Fe  Fe343  1  0.631435  0.482374  0.938421  1
  Fe  Fe344  1  0.631245  0.815590  0.188334  1
  Fe  Fe345  1  0.631206  0.815625  0.438678  1
  Fe  Fe346  1  0.631193  0.815676  0.688477  1
  Fe  Fe347  1  0.631144  0.815636  0.938665  1
  Fe  Fe348  1  0.964205  0.148870  0.188516  1
  Fe  Fe349  1  0.964546  0.148981  0.438398  1
  Fe  Fe350  1  0.964348  0.148875  0.688397  1
  Fe  Fe351  1  0.964465  0.148844  0.937510  1
  Fe  Fe352  1  0.964569  0.482273  0.188457  1
  Fe  Fe353  1  0.964558  0.482307  0.438767  1
  Fe  Fe354  1  0.964603  0.482222  0.688372  1
  Fe  Fe355  1  0.964708  0.482122  0.938862  1
  Fe  Fe356  1  0.964382  0.815420  0.188845  1
  Fe  Fe357  1  0.964614  0.815715  0.438510  1
  Fe  Fe358  1  0.964617  0.815736  0.688814  1
  Fe  Fe359  1  0.964566  0.815539  0.938631  1
  Fe  Fe360  1  0.184326  0.149024  0.187258  1
  Fe  Fe361  1  0.184474  0.148875  0.438557  1
  Fe  Fe362  1  0.184413  0.148937  0.688003  1
  Fe  Fe363  1  0.181746  0.151603  0.944591  1
  Fe  Fe364  1  0.184377  0.482297  0.188855  1
  Fe  Fe365  1  0.184420  0.482316  0.438546  1
  Fe  Fe366  1  0.184444  0.482380  0.688523  1
  Fe  Fe367  1  0.184392  0.482079  0.938767  1
  Fe  Fe368  1  0.184435  0.815495  0.188692  1
  Fe  Fe369  1  0.184390  0.815619  0.438423  1
  Fe  Fe370  1  0.184264  0.815612  0.688840  1
  Fe  Fe371  1  0.184336  0.815657  0.938483  1
  Fe  Fe372  1  0.517854  0.148914  0.188691  1
  Fe  Fe373  1  0.517730  0.148959  0.438423  1
  Fe  Fe374  1  0.517737  0.149085  0.688840  1
  Fe  Fe375  1  0.517692  0.149013  0.938483  1
  Fe  Fe376  1  0.517801  0.482173  0.188821  1
  Fe  Fe377  1  0.517751  0.482326  0.438545  1
  Fe  Fe378  1  0.517837  0.482365  0.688586  1
  Fe  Fe379  1  0.518244  0.482347  0.938001  1
  Fe  Fe380  1  0.517767  0.815582  0.188331  1
  Fe  Fe381  1  0.517724  0.815625  0.438641  1
  Fe  Fe382  1  0.517709  0.815640  0.688469  1
  Fe  Fe383  1  0.517672  0.815677  0.938635  1
  Fe  Fe384  1  0.851052  0.148972  0.188854  1
  Fe  Fe385  1  0.851033  0.148929  0.438546  1
  Fe  Fe386  1  0.850969  0.148905  0.688523  1
  Fe  Fe387  1  0.851270  0.148957  0.938766  1
  Fe  Fe388  1  0.851178  0.482171  0.188370  1
  Fe  Fe389  1  0.851067  0.482282  0.438789  1
  Fe  Fe390  1  0.851116  0.482233  0.688643  1
  Fe  Fe391  1  0.851177  0.482172  0.938596  1
  Fe  Fe392  1  0.851176  0.815548  0.188821  1
  Fe  Fe393  1  0.851023  0.815598  0.438545  1
  Fe  Fe394  1  0.850984  0.815512  0.688586  1
  Fe  Fe395  1  0.851002  0.815105  0.938000  1
  Fe  Fe396  1  0.148335  0.295761  0.062819  1
  Fe  Fe397  1  0.149048  0.297749  0.313476  1
  Fe  Fe398  1  0.148816  0.297909  0.563431  1
  Fe  Fe399  1  0.148686  0.297535  0.812067  1
  Fe  Fe400  1  0.148917  0.631048  0.063277  1
  Fe  Fe401  1  0.148899  0.631168  0.313642  1
  Fe  Fe402  1  0.148972  0.631290  0.563487  1
  Fe  Fe403  1  0.148913  0.631098  0.813706  1
  Fe  Fe404  1  0.148632  0.963939  0.063836  1
  Fe  Fe405  1  0.149066  0.964689  0.313326  1
  Fe  Fe406  1  0.148945  0.964441  0.563581  1
  Fe  Fe407  1  0.148944  0.964743  0.813530  1
  Fe  Fe408  1  0.482762  0.298157  0.063456  1
  Fe  Fe409  1  0.482119  0.297762  0.313548  1
  Fe  Fe410  1  0.482313  0.297873  0.563326  1
  Fe  Fe411  1  0.482196  0.298031  0.814045  1
  Fe  Fe412  1  0.482387  0.631240  0.063532  1
  Fe  Fe413  1  0.482351  0.631286  0.313482  1
  Fe  Fe414  1  0.482341  0.631198  0.563461  1
  Fe  Fe415  1  0.482340  0.631357  0.813733  1
  Fe  Fe416  1  0.482333  0.964666  0.063628  1
  Fe  Fe417  1  0.482271  0.964454  0.313468  1
  Fe  Fe418  1  0.482244  0.964595  0.563548  1
  Fe  Fe419  1  0.482166  0.964651  0.813603  1
  Fe  Fe420  1  0.815665  0.297765  0.063422  1
  Fe  Fe421  1  0.815606  0.297912  0.313613  1
  Fe  Fe422  1  0.815536  0.297790  0.563560  1
  Fe  Fe423  1  0.815868  0.297961  0.813984  1
  Fe  Fe424  1  0.815627  0.631179  0.063722  1
  Fe  Fe425  1  0.815578  0.631116  0.313655  1
  Fe  Fe426  1  0.815662  0.631234  0.563688  1
  Fe  Fe427  1  0.815708  0.631115  0.813380  1
  Fe  Fe428  1  0.815963  0.964781  0.063609  1
  Fe  Fe429  1  0.815546  0.964453  0.313548  1
  Fe  Fe430  1  0.815601  0.964484  0.563457  1
  Fe  Fe431  1  0.815769  0.964662  0.814027  1
  Fe  Fe432  1  0.221997  0.111359  0.062843  1
  Fe  Fe433  1  0.222366  0.110991  0.312338  1
  Fe  Fe434  1  0.222202  0.111155  0.562145  1
  Fe  Fe435  1  0.221929  0.111429  0.811743  1
  Fe  Fe436  1  0.222674  0.444271  0.062053  1
  Fe  Fe437  1  0.222086  0.444538  0.312362  1
  Fe  Fe438  1  0.222163  0.444464  0.562166  1
  Fe  Fe439  1  0.222336  0.444587  0.812065  1
  Fe  Fe440  1  0.222350  0.777927  0.062113  1
  Fe  Fe441  1  0.222194  0.777706  0.312263  1
  Fe  Fe442  1  0.222269  0.777810  0.562163  1
  Fe  Fe443  1  0.222341  0.778004  0.812334  1
  Fe  Fe444  1  0.555431  0.111008  0.062113  1
  Fe  Fe445  1  0.555652  0.111164  0.312263  1
  Fe  Fe446  1  0.555548  0.111089  0.562163  1
  Fe  Fe447  1  0.555353  0.111017  0.812334  1
  Fe  Fe448  1  0.555991  0.444556  0.062352  1
  Fe  Fe449  1  0.555273  0.444301  0.312169  1
  Fe  Fe450  1  0.555504  0.444383  0.562249  1
  Fe  Fe451  1  0.555739  0.444462  0.812348  1
  Fe  Fe452  1  0.555561  0.777797  0.062247  1
  Fe  Fe453  1  0.555602  0.777755  0.312005  1
  Fe  Fe454  1  0.555630  0.777728  0.562190  1
  Fe  Fe455  1  0.555583  0.777774  0.812189  1
  Fe  Fe456  1  0.889087  0.110683  0.062053  1
  Fe  Fe457  1  0.888820  0.111272  0.312362  1
  Fe  Fe458  1  0.888893  0.111195  0.562166  1
  Fe  Fe459  1  0.888771  0.111021  0.812065  1
  Fe  Fe460  1  0.889226  0.444131  0.061997  1
  Fe  Fe461  1  0.888872  0.444486  0.312315  1
  Fe  Fe462  1  0.888851  0.444507  0.562355  1
  Fe  Fe463  1  0.888950  0.444408  0.812166  1
  Fe  Fe464  1  0.888801  0.777366  0.062352  1
  Fe  Fe465  1  0.889057  0.778085  0.312169  1
  Fe  Fe466  1  0.888975  0.777854  0.562249  1
  Fe  Fe467  1  0.888895  0.777619  0.812348  1
  Fe  Fe468  1  0.111088  0.222253  0.186643  1
  Fe  Fe469  1  0.111118  0.222224  0.437221  1
  Fe  Fe470  1  0.111199  0.222143  0.687064  1
  Fe  Fe471  1  0.111541  0.221801  0.936035  1
  Fe  Fe472  1  0.111178  0.555566  0.187311  1
  Fe  Fe473  1  0.111055  0.555576  0.437250  1
  Fe  Fe474  1  0.111073  0.555515  0.687197  1
  Fe  Fe475  1  0.111055  0.555335  0.937294  1
  Fe  Fe476  1  0.111276  0.888551  0.187561  1
  Fe  Fe477  1  0.111194  0.889055  0.437107  1
  Fe  Fe478  1  0.111033  0.888820  0.687161  1
  Fe  Fe479  1  0.110839  0.888905  0.937302  1
  Fe  Fe480  1  0.444790  0.222065  0.187561  1
  Fe  Fe481  1  0.444287  0.222148  0.437107  1
  Fe  Fe482  1  0.444521  0.222308  0.687161  1
  Fe  Fe483  1  0.444437  0.222503  0.937302  1
  Fe  Fe484  1  0.444595  0.555738  0.187320  1
  Fe  Fe485  1  0.444418  0.555534  0.437147  1
  Fe  Fe486  1  0.444388  0.555661  0.687148  1
  Fe  Fe487  1  0.444562  0.555970  0.937543  1
  Fe  Fe488  1  0.444570  0.888772  0.187252  1
  Fe  Fe489  1  0.444483  0.888858  0.437225  1
  Fe  Fe490  1  0.444392  0.888949  0.687323  1
  Fe  Fe491  1  0.444273  0.889068  0.937034  1
  Fe  Fe492  1  0.777775  0.222164  0.187311  1
  Fe  Fe493  1  0.777766  0.222286  0.437250  1
  Fe  Fe494  1  0.777826  0.222269  0.687197  1
  Fe  Fe495  1  0.778006  0.222287  0.937294  1
  Fe  Fe496  1  0.777824  0.555518  0.187306  1
  Fe  Fe497  1  0.777791  0.555550  0.437439  1
  Fe  Fe498  1  0.777738  0.555603  0.687329  1
  Fe  Fe499  1  0.777800  0.555542  0.937101  1
  Fe  Fe500  1  0.777604  0.888746  0.187320  1
  Fe  Fe501  1  0.777807  0.888923  0.437147  1
  Fe  Fe502  1  0.777681  0.888953  0.687148  1
  Fe  Fe503  1  0.777372  0.888780  0.937543  1
  C  C504  1  0.271994  0.209911  0.010103  1
  C  C505  1  0.270819  0.208577  0.257588  1
  C  C506  1  0.271248  0.209137  0.508192  1
  C  C507  1  0.271498  0.209187  0.757279  1
  C  C508  1  0.271257  0.542353  0.008286  1
  C  C509  1  0.271275  0.542502  0.258366  1
  C  C510  1  0.271255  0.542430  0.508173  1
  C  C511  1  0.271332  0.542547  0.758058  1
  C  C512  1  0.271138  0.875887  0.008100  1
  C  C513  1  0.271232  0.875702  0.258332  1
  C  C514  1  0.271218  0.875723  0.508055  1
  C  C515  1  0.271074  0.875997  0.758392  1
  C  C516  1  0.604568  0.208977  0.008124  1
  C  C517  1  0.604674  0.209137  0.258285  1
  C  C518  1  0.604478  0.209057  0.508167  1
  C  C519  1  0.604511  0.209093  0.758570  1
  C  C520  1  0.604679  0.542409  0.008130  1
  C  C521  1  0.604574  0.542411  0.258469  1
  C  C522  1  0.604565  0.542340  0.508235  1
  C  C523  1  0.604542  0.542440  0.758383  1
  C  C524  1  0.604479  0.875783  0.008297  1
  C  C525  1  0.604568  0.875716  0.257994  1
  C  C526  1  0.604511  0.875751  0.508313  1
  C  C527  1  0.604474  0.875737  0.758188  1
  C  C528  1  0.938340  0.208727  0.008228  1
  C  C529  1  0.937969  0.209221  0.258335  1
  C  C530  1  0.937907  0.209120  0.508089  1
  C  C531  1  0.937790  0.209032  0.758159  1
  C  C532  1  0.937912  0.542266  0.008348  1
  C  C533  1  0.937873  0.542365  0.258141  1
  C  C534  1  0.937904  0.542479  0.508374  1
  C  C535  1  0.938046  0.542365  0.758148  1
  C  C536  1  0.937330  0.875264  0.008227  1
  C  C537  1  0.938114  0.876062  0.258186  1
  C  C538  1  0.937845  0.875775  0.508160  1
  C  C539  1  0.937618  0.875628  0.758451  1
  C  C540  1  0.062110  0.271240  0.132644  1
  C  C541  1  0.062188  0.271162  0.383019  1
  C  C542  1  0.062157  0.271194  0.633341  1
  C  C543  1  0.062426  0.270924  0.882575  1
  C  C544  1  0.062233  0.604478  0.133093  1
  C  C545  1  0.062075  0.604557  0.383242  1
  C  C546  1  0.062208  0.604621  0.633205  1
  C  C547  1  0.062144  0.604446  0.883410  1
  C  C548  1  0.061833  0.937077  0.133587  1
  C  C549  1  0.062341  0.938146  0.383063  1
  C  C550  1  0.062039  0.937753  0.633076  1
  C  C551  1  0.062255  0.938279  0.883285  1
  C  C552  1  0.396274  0.271517  0.133586  1
  C  C553  1  0.395204  0.271010  0.383063  1
  C  C554  1  0.395597  0.271312  0.633076  1
  C  C555  1  0.395071  0.271095  0.883286  1
  C  C556  1  0.395447  0.604407  0.133020  1
  C  C557  1  0.395560  0.604640  0.383145  1
  C  C558  1  0.395471  0.604626  0.632972  1
  C  C559  1  0.395444  0.604669  0.883245  1
  C  C560  1  0.395558  0.937793  0.133399  1
  C  C561  1  0.395515  0.937836  0.383186  1
  C  C562  1  0.395442  0.937908  0.633211  1
  C  C563  1  0.395278  0.938072  0.883091  1
  C  C564  1  0.728872  0.271117  0.133093  1
  C  C565  1  0.728793  0.271276  0.383242  1
  C  C566  1  0.728730  0.271143  0.633205  1
  C  C567  1  0.728904  0.271206  0.883410  1
  C  C568  1  0.728828  0.604522  0.133378  1
  C  C569  1  0.728831  0.604520  0.383369  1
  C  C570  1  0.728785  0.604565  0.633228  1
  C  C571  1  0.728858  0.604492  0.882945  1
  C  C572  1  0.728944  0.937904  0.133019  1
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