# generated using pymatgen
data_Fe503C216
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.14166343
_cell_length_b   20.13584488
_cell_length_c   16.31124400
_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   5729.05389143
_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  0.148782  0.184539  0.064726  1
  Fe  Fe2  1  0.148544  0.184442  0.312014  1
  Fe  Fe3  1  0.148716  0.184166  0.563844  1
  Fe  Fe4  1  0.148679  0.184036  0.814258  1
  Fe  Fe5  1  0.148826  0.517836  0.063585  1
  Fe  Fe6  1  0.148748  0.517913  0.313767  1
  Fe  Fe7  1  0.148803  0.517586  0.563704  1
  Fe  Fe8  1  0.148790  0.517666  0.813855  1
  Fe  Fe9  1  0.148629  0.850980  0.063770  1
  Fe  Fe10  1  0.148985  0.851020  0.313681  1
  Fe  Fe11  1  0.148806  0.851164  0.563735  1
  Fe  Fe12  1  0.148897  0.851239  0.813798  1
  Fe  Fe13  1  0.482393  0.184591  0.063420  1
  Fe  Fe14  1  0.482272  0.184358  0.314058  1
  Fe  Fe15  1  0.482107  0.184380  0.563812  1
  Fe  Fe16  1  0.482130  0.184356  0.814018  1
  Fe  Fe17  1  0.482244  0.517897  0.063536  1
  Fe  Fe18  1  0.482245  0.517729  0.314095  1
  Fe  Fe19  1  0.482098  0.517637  0.563850  1
  Fe  Fe20  1  0.482121  0.517680  0.813822  1
  Fe  Fe21  1  0.482172  0.851092  0.063739  1
  Fe  Fe22  1  0.482052  0.850976  0.313863  1
  Fe  Fe23  1  0.482115  0.851009  0.563892  1
  Fe  Fe24  1  0.482168  0.851110  0.813767  1
  Fe  Fe25  1  0.815382  0.184539  0.063716  1
  Fe  Fe26  1  0.815327  0.184513  0.314081  1
  Fe  Fe27  1  0.815616  0.184299  0.563848  1
  Fe  Fe28  1  0.815545  0.184395  0.813788  1
  Fe  Fe29  1  0.815557  0.517925  0.063781  1
  Fe  Fe30  1  0.815532  0.517842  0.313897  1
  Fe  Fe31  1  0.815507  0.517815  0.563895  1
  Fe  Fe32  1  0.815580  0.517898  0.813766  1
  Fe  Fe33  1  0.816146  0.851398  0.065051  1
  Fe  Fe34  1  0.815436  0.851185  0.313205  1
  Fe  Fe35  1  0.815494  0.851042  0.563811  1
  Fe  Fe36  1  0.815625  0.851227  0.813969  1
  Fe  Fe37  1  0.185904  0.036175  0.187112  1
  Fe  Fe38  1  0.184475  0.035631  0.438188  1
  Fe  Fe39  1  0.184266  0.035428  0.688857  1
  Fe  Fe40  1  0.183824  0.035129  0.940299  1
  Fe  Fe41  1  0.184476  0.369147  0.189274  1
  Fe  Fe42  1  0.184032  0.368259  0.438540  1
  Fe  Fe43  1  0.184166  0.368526  0.688992  1
  Fe  Fe44  1  0.184287  0.368768  0.938665  1
  Fe  Fe45  1  0.184210  0.702005  0.188966  1
  Fe  Fe46  1  0.184222  0.702081  0.439054  1
  Fe  Fe47  1  0.184275  0.702080  0.688804  1
  Fe  Fe48  1  0.184282  0.702145  0.938752  1
  Fe  Fe49  1  0.517737  0.035670  0.188471  1
  Fe  Fe50  1  0.517651  0.035497  0.438863  1
  Fe  Fe51  1  0.517630  0.035455  0.688881  1
  Fe  Fe52  1  0.517652  0.035497  0.938597  1
  Fe  Fe53  1  0.517831  0.368987  0.188690  1
  Fe  Fe54  1  0.517774  0.368959  0.438834  1
  Fe  Fe55  1  0.517638  0.368793  0.688878  1
  Fe  Fe56  1  0.517698  0.368872  0.938840  1
  Fe  Fe57  1  0.517600  0.702004  0.188966  1
  Fe  Fe58  1  0.517665  0.702081  0.439054  1
  Fe  Fe59  1  0.517610  0.702079  0.688804  1
  Fe  Fe60  1  0.517669  0.702145  0.938754  1
  Fe  Fe61  1  0.850076  0.036177  0.187112  1
  Fe  Fe62  1  0.850961  0.035629  0.438192  1
  Fe  Fe63  1  0.850968  0.035428  0.688856  1
  Fe  Fe64  1  0.851110  0.035127  0.940299  1
  Fe  Fe65  1  0.850960  0.368986  0.188690  1
  Fe  Fe66  1  0.850990  0.368959  0.438835  1
  Fe  Fe67  1  0.850962  0.368793  0.688878  1
  Fe  Fe68  1  0.850981  0.368872  0.938839  1
  Fe  Fe69  1  0.851155  0.702504  0.188514  1
  Fe  Fe70  1  0.851175  0.702545  0.438462  1
  Fe  Fe71  1  0.850993  0.702180  0.688961  1
  Fe  Fe72  1  0.850998  0.702192  0.939167  1
  Fe  Fe73  1  0.040480  0.081180  0.490778  1
  Fe  Fe74  1  0.040219  0.080659  0.741821  1
  Fe  Fe75  1  0.040422  0.081062  0.992628  1
  Fe  Fe76  1  0.040086  0.414108  0.241577  1
  Fe  Fe77  1  0.040086  0.413644  0.491597  1
  Fe  Fe78  1  0.040133  0.413787  0.741633  1
  Fe  Fe79  1  0.040116  0.413828  0.991712  1
  Fe  Fe80  1  0.039854  0.746769  0.241801  1
  Fe  Fe81  1  0.040246  0.747416  0.491462  1
  Fe  Fe82  1  0.040257  0.747280  0.741655  1
  Fe  Fe83  1  0.040389  0.747676  0.991806  1
  Fe  Fe84  1  0.374089  0.081041  0.241545  1
  Fe  Fe85  1  0.373300  0.080294  0.491771  1
  Fe  Fe86  1  0.373538  0.080554  0.741673  1
  Fe  Fe87  1  0.373354  0.080268  0.991611  1
  Fe  Fe88  1  0.373801  0.414111  0.241577  1
  Fe  Fe89  1  0.373337  0.413643  0.491599  1
  Fe  Fe90  1  0.373435  0.413788  0.741634  1
  Fe  Fe91  1  0.373490  0.413826  0.991712  1
  Fe  Fe92  1  0.373490  0.747200  0.241583  1
  Fe  Fe93  1  0.373449  0.747119  0.491776  1
  Fe  Fe94  1  0.373451  0.747123  0.741748  1
  Fe  Fe95  1  0.373489  0.747199  0.991622  1
  Fe  Fe96  1  0.706732  0.081043  0.241546  1
  Fe  Fe97  1  0.706773  0.080293  0.491772  1
  Fe  Fe98  1  0.706794  0.080554  0.741673  1
  Fe  Fe99  1  0.706694  0.080267  0.991611  1
  Fe  Fe100  1  0.706917  0.414055  0.241635  1
  Fe  Fe101  1  0.706864  0.413948  0.491732  1
  Fe  Fe102  1  0.706775  0.413769  0.741684  1
  Fe  Fe103  1  0.706939  0.414098  0.991606  1
  Fe  Fe104  1  0.706694  0.746766  0.241803  1
  Fe  Fe105  1  0.706951  0.747419  0.491461  1
  Fe  Fe106  1  0.706800  0.747277  0.741655  1
  Fe  Fe107  1  0.707069  0.747681  0.991807  1
  Fe  Fe108  1  0.293561  0.039690  0.116893  1
  Fe  Fe109  1  0.293114  0.040115  0.366597  1
  Fe  Fe110  1  0.292910  0.040310  0.616545  1
  Fe  Fe111  1  0.292600  0.040583  0.866888  1
  Fe  Fe112  1  0.293077  0.374100  0.116619  1
  Fe  Fe113  1  0.292987  0.373245  0.366575  1
  Fe  Fe114  1  0.292819  0.373589  0.616461  1
  Fe  Fe115  1  0.293047  0.373394  0.866657  1
  Fe  Fe116  1  0.292956  0.707014  0.116579  1
  Fe  Fe117  1  0.292885  0.706908  0.366728  1
  Fe  Fe118  1  0.292985  0.706786  0.616742  1
  Fe  Fe119  1  0.293030  0.706953  0.866629  1
  Fe  Fe120  1  0.625999  0.040283  0.116657  1
  Fe  Fe121  1  0.626168  0.040164  0.366678  1
  Fe  Fe122  1  0.626334  0.040297  0.616722  1
  Fe  Fe123  1  0.626474  0.040209  0.866626  1
  Fe  Fe124  1  0.626384  0.373693  0.116610  1
  Fe  Fe125  1  0.626337  0.373697  0.366686  1
  Fe  Fe126  1  0.626348  0.373624  0.616758  1
  Fe  Fe127  1  0.626354  0.373642  0.866702  1
  Fe  Fe128  1  0.626390  0.707182  0.116608  1
  Fe  Fe129  1  0.626502  0.707056  0.366776  1
  Fe  Fe130  1  0.626315  0.706822  0.616774  1
  Fe  Fe131  1  0.626354  0.706917  0.866610  1
  Fe  Fe132  1  0.960214  0.040912  0.118345  1
  Fe  Fe133  1  0.960153  0.040335  0.365679  1
  Fe  Fe134  1  0.959364  0.040445  0.616120  1
  Fe  Fe135  1  0.959295  0.040751  0.867124  1
  Fe  Fe136  1  0.959724  0.373835  0.116710  1
  Fe  Fe137  1  0.959578  0.373710  0.366549  1
  Fe  Fe138  1  0.959592  0.373586  0.616680  1
  Fe  Fe139  1  0.959600  0.373533  0.866708  1
  Fe  Fe140  1  0.959770  0.707102  0.116824  1
  Fe  Fe141  1  0.959708  0.707009  0.366633  1
  Fe  Fe142  1  0.959609  0.707087  0.616513  1
  Fe  Fe143  1  0.959642  0.707098  0.866746  1
  Fe  Fe144  1  0.080497  0.040898  0.118339  1
  Fe  Fe145  1  0.079980  0.040320  0.365671  1
  Fe  Fe146  1  0.080887  0.040436  0.616110  1
  Fe  Fe147  1  0.081260  0.040741  0.867118  1
  Fe  Fe148  1  0.080824  0.374088  0.116611  1
  Fe  Fe149  1  0.080059  0.373233  0.366567  1
  Fe  Fe150  1  0.080573  0.373577  0.616454  1
  Fe  Fe151  1  0.080149  0.373381  0.866650  1
  Fe  Fe152  1  0.080594  0.707170  0.116600  1
  Fe  Fe153  1  0.080357  0.707043  0.366768  1
  Fe  Fe154  1  0.080307  0.706810  0.616766  1
  Fe  Fe155  1  0.080364  0.706906  0.866603  1
  Fe  Fe156  1  0.414086  0.040271  0.116649  1
  Fe  Fe157  1  0.413797  0.040152  0.366671  1
  Fe  Fe158  1  0.413765  0.040286  0.616715  1
  Fe  Fe159  1  0.413537  0.040198  0.866619  1
  Fe  Fe160  1  0.413912  0.373823  0.116702  1
  Fe  Fe161  1  0.413934  0.373699  0.366541  1
  Fe  Fe162  1  0.413796  0.373574  0.616673  1
  Fe  Fe163  1  0.413735  0.373522  0.866700  1
  Fe  Fe164  1  0.413861  0.707002  0.116572  1
  Fe  Fe165  1  0.413825  0.706896  0.366720  1
  Fe  Fe166  1  0.413602  0.706775  0.616734  1
  Fe  Fe167  1  0.413724  0.706941  0.866621  1
  Fe  Fe168  1  0.745929  0.039679  0.116887  1
  Fe  Fe169  1  0.746804  0.040105  0.366591  1
  Fe  Fe170  1  0.747199  0.040297  0.616538  1
  Fe  Fe171  1  0.747787  0.040571  0.866880  1
  Fe  Fe172  1  0.747111  0.373682  0.116602  1
  Fe  Fe173  1  0.747162  0.373686  0.366679  1
  Fe  Fe174  1  0.747078  0.373612  0.616752  1
  Fe  Fe175  1  0.747089  0.373630  0.866695  1
  Fe  Fe176  1  0.747135  0.707091  0.116818  1
  Fe  Fe177  1  0.747102  0.706997  0.366627  1
  Fe  Fe178  1  0.747280  0.707076  0.616506  1
  Fe  Fe179  1  0.747258  0.707087  0.866739  1
  Fe  Fe180  1  0.253985  0.293854  0.241577  1
  Fe  Fe181  1  0.251751  0.292574  0.490879  1
  Fe  Fe182  1  0.252437  0.292847  0.741639  1
  Fe  Fe183  1  0.252514  0.293047  0.991872  1
  Fe  Fe184  1  0.252484  0.626264  0.241623  1
  Fe  Fe185  1  0.252837  0.626368  0.491794  1
  Fe  Fe186  1  0.252684  0.626359  0.741585  1
  Fe  Fe187  1  0.252758  0.626441  0.991556  1
  Fe  Fe188  1  0.253021  0.959649  0.241721  1
  Fe  Fe189  1  0.252684  0.959606  0.491719  1
  Fe  Fe190  1  0.252658  0.959721  0.741697  1
  Fe  Fe191  1  0.252583  0.959649  0.991821  1
  Fe  Fe192  1  0.585942  0.293128  0.241593  1
  Fe  Fe193  1  0.586159  0.293148  0.491743  1
  Fe  Fe194  1  0.585936  0.293052  0.741660  1
  Fe  Fe195  1  0.586315  0.293317  0.991624  1
  Fe  Fe196  1  0.585766  0.626232  0.241564  1
  Fe  Fe197  1  0.586107  0.626410  0.491799  1
  Fe  Fe198  1  0.586054  0.626453  0.741665  1
  Fe  Fe199  1  0.586250  0.626546  0.991505  1
  Fe  Fe200  1  0.586016  0.959754  0.241692  1
  Fe  Fe201  1  0.586026  0.959645  0.491678  1
  Fe  Fe202  1  0.586021  0.959735  0.741662  1
  Fe  Fe203  1  0.586002  0.959669  0.991727  1
  Fe  Fe204  1  0.918770  0.293156  0.241642  1
  Fe  Fe205  1  0.919589  0.293041  0.491709  1
  Fe  Fe206  1  0.919317  0.292966  0.741673  1
  Fe  Fe207  1  0.919579  0.293233  0.991666  1
  Fe  Fe208  1  0.919320  0.626514  0.241714  1
  Fe  Fe209  1  0.919476  0.626471  0.491722  1
  Fe  Fe210  1  0.919474  0.626479  0.741679  1
  Fe  Fe211  1  0.919509  0.626655  0.991667  1
  Fe  Fe212  1  0.922055  0.962336  0.241638  1
  Fe  Fe213  1  0.918957  0.959414  0.491013  1
  Fe  Fe214  1  0.919216  0.959592  0.741606  1
  Fe  Fe215  1  0.919061  0.959745  0.992024  1
  Fe  Fe216  1  0.039659  0.293839  0.241584  1
  Fe  Fe217  1  0.040614  0.292562  0.490888  1
  Fe  Fe218  1  0.040201  0.292836  0.741647  1
  Fe  Fe219  1  0.040324  0.293035  0.991879  1
  Fe  Fe220  1  0.040256  0.626221  0.241573  1
  Fe  Fe221  1  0.040095  0.626398  0.491806  1
  Fe  Fe222  1  0.040190  0.626442  0.741673  1
  Fe  Fe223  1  0.040089  0.626533  0.991514  1
  Fe  Fe224  1  0.040081  0.962319  0.241645  1
  Fe  Fe225  1  0.040246  0.959405  0.491022  1
  Fe  Fe226  1  0.040167  0.959579  0.741613  1
  Fe  Fe227  1  0.040473  0.959736  0.992031  1
  Fe  Fe228  1  0.374175  0.293146  0.241650  1
  Fe  Fe229  1  0.373242  0.293029  0.491715  1
  Fe  Fe230  1  0.373442  0.292956  0.741680  1
  Fe  Fe231  1  0.373448  0.293221  0.991673  1
  Fe  Fe232  1  0.373573  0.626253  0.241630  1
  Fe  Fe233  1  0.373321  0.626357  0.491801  1
  Fe  Fe234  1  0.373467  0.626347  0.741592  1
  Fe  Fe235  1  0.373474  0.626430  0.991564  1
  Fe  Fe236  1  0.373528  0.959742  0.241700  1
  Fe  Fe237  1  0.373411  0.959634  0.491685  1
  Fe  Fe238  1  0.373505  0.959724  0.741670  1
  Fe  Fe239  1  0.373460  0.959658  0.991735  1
  Fe  Fe240  1  0.706977  0.293115  0.241600  1
  Fe  Fe241  1  0.706780  0.293136  0.491752  1
  Fe  Fe242  1  0.706908  0.293040  0.741667  1
  Fe  Fe243  1  0.706793  0.293306  0.991630  1
  Fe  Fe244  1  0.706986  0.626503  0.241721  1
  Fe  Fe245  1  0.706786  0.626459  0.491728  1
  Fe  Fe246  1  0.706796  0.626466  0.741686  1
  Fe  Fe247  1  0.706937  0.626644  0.991675  1
  Fe  Fe248  1  0.706419  0.959640  0.241729  1
  Fe  Fe249  1  0.706715  0.959593  0.491726  1
  Fe  Fe250  1  0.706852  0.959710  0.741705  1
  Fe  Fe251  1  0.706858  0.959635  0.991829  1
  Fe  Fe252  1  0.293468  0.253547  0.116877  1
  Fe  Fe253  1  0.293230  0.252885  0.366598  1
  Fe  Fe254  1  0.293034  0.252746  0.616557  1
  Fe  Fe255  1  0.292745  0.252292  0.866830  1
  Fe  Fe256  1  0.293009  0.586193  0.116615  1
  Fe  Fe257  1  0.293051  0.586276  0.366707  1
  Fe  Fe258  1  0.292813  0.585802  0.616579  1
  Fe  Fe259  1  0.293054  0.586284  0.866666  1
  Fe  Fe260  1  0.293014  0.919066  0.116666  1
  Fe  Fe261  1  0.292990  0.919216  0.366745  1
  Fe  Fe262  1  0.292987  0.919531  0.616710  1
  Fe  Fe263  1  0.292990  0.919691  0.866629  1
  Fe  Fe264  1  0.626194  0.252564  0.116456  1
  Fe  Fe265  1  0.626329  0.252835  0.366783  1
  Fe  Fe266  1  0.626382  0.252939  0.616779  1
  Fe  Fe267  1  0.626437  0.253048  0.866564  1
  Fe  Fe268  1  0.626441  0.586247  0.116598  1
  Fe  Fe269  1  0.626379  0.586142  0.366710  1
  Fe  Fe270  1  0.626342  0.586200  0.616734  1
  Fe  Fe271  1  0.626398  0.586262  0.866621  1
  Fe  Fe272  1  0.625878  0.919066  0.116666  1
  Fe  Fe273  1  0.626052  0.919217  0.366745  1
  Fe  Fe274  1  0.626367  0.919529  0.616710  1
  Fe  Fe275  1  0.626526  0.919691  0.866630  1
  Fe  Fe276  1  0.959902  0.253545  0.116877  1
  Fe  Fe277  1  0.959479  0.252884  0.366600  1
  Fe  Fe278  1  0.959538  0.252749  0.616559  1
  Fe  Fe279  1  0.959371  0.252290  0.866829  1
  Fe  Fe280  1  0.959630  0.586246  0.116598  1
  Fe  Fe281  1  0.959589  0.586143  0.366710  1
  Fe  Fe282  1  0.959683  0.586200  0.616733  1
  Fe  Fe283  1  0.959689  0.586262  0.866621  1
  Fe  Fe284  1  0.959909  0.919992  0.116354  1
  Fe  Fe285  1  0.959631  0.919436  0.366833  1
  Fe  Fe286  1  0.959716  0.919608  0.616702  1
  Fe  Fe287  1  0.959831  0.919837  0.866571  1
  Fe  Fe288  1  0.035584  0.184552  0.064690  1
  Fe  Fe289  1  0.035719  0.184453  0.311984  1
  Fe  Fe290  1  0.035277  0.184180  0.563808  1
  Fe  Fe291  1  0.035185  0.184050  0.814219  1
  Fe  Fe292  1  0.035478  0.517910  0.063503  1
  Fe  Fe293  1  0.035312  0.517743  0.314055  1
  Fe  Fe294  1  0.035364  0.517650  0.563816  1
  Fe  Fe295  1  0.035384  0.517693  0.813787  1
  Fe  Fe296  1  0.035081  0.851411  0.065008  1
  Fe  Fe297  1  0.035573  0.851196  0.313175  1
  Fe  Fe298  1  0.035375  0.851057  0.563773  1
  Fe  Fe299  1  0.035429  0.851241  0.813936  1
  Fe  Fe300  1  0.368983  0.184553  0.063682  1
  Fe  Fe301  1  0.369009  0.184525  0.314046  1
  Fe  Fe302  1  0.368508  0.184312  0.563813  1
  Fe  Fe303  1  0.368679  0.184410  0.813752  1
  Fe  Fe304  1  0.368836  0.517850  0.063549  1
  Fe  Fe305  1  0.368993  0.517928  0.313732  1
  Fe  Fe306  1  0.368609  0.517599  0.563669  1
  Fe  Fe307  1  0.368701  0.517679  0.813822  1
  Fe  Fe308  1  0.368746  0.851106  0.063704  1
  Fe  Fe309  1  0.368752  0.850990  0.313827  1
  Fe  Fe310  1  0.368721  0.851023  0.563857  1
  Fe  Fe311  1  0.368766  0.851123  0.813733  1
  Fe  Fe312  1  0.702024  0.184604  0.063385  1
  Fe  Fe313  1  0.701911  0.184371  0.314025  1
  Fe  Fe314  1  0.702099  0.184394  0.563777  1
  Fe  Fe315  1  0.702052  0.184368  0.813983  1
  Fe  Fe316  1  0.702195  0.517940  0.063746  1
  Fe  Fe317  1  0.702137  0.517856  0.313861  1
  Fe  Fe318  1  0.702135  0.517829  0.563860  1
  Fe  Fe319  1  0.702144  0.517911  0.813732  1
  Fe  Fe320  1  0.702176  0.850992  0.063738  1
  Fe  Fe321  1  0.701861  0.851034  0.313645  1
  Fe  Fe322  1  0.702185  0.851177  0.563701  1
  Fe  Fe323  1  0.702168  0.851253  0.813761  1
  Fe  Fe324  1  0.298658  0.149260  0.189023  1
  Fe  Fe325  1  0.298221  0.149228  0.439150  1
  Fe  Fe326  1  0.297590  0.148865  0.688587  1
  Fe  Fe327  1  0.297674  0.148832  0.939536  1
  Fe  Fe328  1  0.297831  0.482484  0.188650  1
  Fe  Fe329  1  0.297519  0.482014  0.438518  1
  Fe  Fe330  1  0.297667  0.482143  0.688926  1
  Fe  Fe331  1  0.297685  0.482328  0.938565  1
  Fe  Fe332  1  0.297702  0.815404  0.188602  1
  Fe  Fe333  1  0.297683  0.815475  0.438860  1
  Fe  Fe334  1  0.297712  0.815587  0.688815  1
  Fe  Fe335  1  0.297657  0.815540  0.938558  1
  Fe  Fe336  1  0.631119  0.148996  0.188960  1
  Fe  Fe337  1  0.631057  0.148930  0.438936  1
  Fe  Fe338  1  0.631101  0.148930  0.688844  1
  Fe  Fe339  1  0.631025  0.148838  0.938546  1
  Fe  Fe340  1  0.631196  0.482367  0.188751  1
  Fe  Fe341  1  0.631131  0.482290  0.438844  1
  Fe  Fe342  1  0.631052  0.482262  0.688799  1
  Fe  Fe343  1  0.631080  0.482327  0.938590  1
  Fe  Fe344  1  0.630815  0.815426  0.188878  1
  Fe  Fe345  1  0.631066  0.815550  0.438855  1
  Fe  Fe346  1  0.631044  0.815620  0.688760  1
  Fe  Fe347  1  0.631017  0.815565  0.938499  1
  Fe  Fe348  1  0.963772  0.149108  0.188338  1
  Fe  Fe349  1  0.964310  0.148906  0.438164  1
  Fe  Fe350  1  0.964470  0.148854  0.688829  1
  Fe  Fe351  1  0.964602  0.148728  0.939962  1
  Fe  Fe352  1  0.964428  0.482492  0.188639  1
  Fe  Fe353  1  0.964483  0.482298  0.438922  1
  Fe  Fe354  1  0.964423  0.482215  0.688855  1
  Fe  Fe355  1  0.964386  0.482339  0.938780  1
  Fe  Fe356  1  0.964543  0.815950  0.189175  1
  Fe  Fe357  1  0.964652  0.815866  0.438773  1
  Fe  Fe358  1  0.964461  0.815669  0.688770  1
  Fe  Fe359  1  0.964510  0.815707  0.938770  1
  Fe  Fe360  1  0.185128  0.149120  0.188370  1
  Fe  Fe361  1  0.184390  0.148918  0.438192  1
  Fe  Fe362  1  0.184176  0.148870  0.688867  1
  Fe  Fe363  1  0.183918  0.148744  0.940002  1
  Fe  Fe364  1  0.184444  0.482497  0.188687  1
  Fe  Fe365  1  0.184287  0.482028  0.438553  1
  Fe  Fe366  1  0.184267  0.482156  0.688962  1
  Fe  Fe367  1  0.184435  0.482341  0.938598  1
  Fe  Fe368  1  0.184402  0.815440  0.188913  1
  Fe  Fe369  1  0.184276  0.815563  0.438892  1
  Fe  Fe370  1  0.184367  0.815634  0.688794  1
  Fe  Fe371  1  0.184340  0.815578  0.938535  1
  Fe  Fe372  1  0.517669  0.149010  0.188996  1
  Fe  Fe373  1  0.517664  0.148944  0.438970  1
  Fe  Fe374  1  0.517621  0.148944  0.688880  1
  Fe  Fe375  1  0.517606  0.148851  0.938580  1
  Fe  Fe376  1  0.517856  0.482507  0.188674  1
  Fe  Fe377  1  0.517606  0.482312  0.438959  1
  Fe  Fe378  1  0.517585  0.482229  0.688888  1
  Fe  Fe379  1  0.517746  0.482352  0.938815  1
  Fe  Fe380  1  0.517494  0.815418  0.188637  1
  Fe  Fe381  1  0.517584  0.815488  0.438895  1
  Fe  Fe382  1  0.517666  0.815600  0.688850  1
  Fe  Fe383  1  0.517675  0.815554  0.938592  1
  Fe  Fe384  1  0.850394  0.149275  0.189058  1
  Fe  Fe385  1  0.850800  0.149241  0.439188  1
  Fe  Fe386  1  0.851067  0.148878  0.688622  1
  Fe  Fe387  1  0.850948  0.148845  0.939575  1
  Fe  Fe388  1  0.850962  0.482381  0.188787  1
  Fe  Fe389  1  0.850951  0.482304  0.438880  1
  Fe  Fe390  1  0.851003  0.482275  0.688834  1
  Fe  Fe391  1  0.851040  0.482340  0.938624  1
  Fe  Fe392  1  0.851200  0.815964  0.189214  1
  Fe  Fe393  1  0.851005  0.815879  0.438807  1
  Fe  Fe394  1  0.850999  0.815682  0.688806  1
  Fe  Fe395  1  0.850988  0.815721  0.938806  1
  Fe  Fe396  1  0.149013  0.298226  0.064344  1
  Fe  Fe397  1  0.148986  0.298174  0.313067  1
  Fe  Fe398  1  0.148819  0.297839  0.563872  1
  Fe  Fe399  1  0.148739  0.297679  0.814073  1
  Fe  Fe400  1  0.148892  0.631279  0.063653  1
  Fe  Fe401  1  0.148888  0.631293  0.314100  1
  Fe  Fe402  1  0.148775  0.631081  0.563832  1
  Fe  Fe403  1  0.148769  0.631121  0.813719  1
  Fe  Fe404  1  0.148673  0.964382  0.064669  1
  Fe  Fe405  1  0.148921  0.963774  0.313106  1
  Fe  Fe406  1  0.148922  0.964623  0.563762  1
  Fe  Fe407  1  0.148866  0.964703  0.813943  1
  Fe  Fe408  1  0.482373  0.297887  0.063442  1
  Fe  Fe409  1  0.482300  0.297980  0.313872  1
  Fe  Fe410  1  0.482107  0.297767  0.563710  1
  Fe  Fe411  1  0.482120  0.297865  0.813974  1
  Fe  Fe412  1  0.482186  0.631280  0.063651  1
  Fe  Fe413  1  0.482204  0.631294  0.314101  1
  Fe  Fe414  1  0.482105  0.631081  0.563832  1
  Fe  Fe415  1  0.482151  0.631122  0.813721  1
  Fe  Fe416  1  0.482136  0.964474  0.063688  1
  Fe  Fe417  1  0.482058  0.964317  0.313706  1
  Fe  Fe418  1  0.482134  0.964469  0.563814  1
  Fe  Fe419  1  0.482168  0.964537  0.813978  1
  Fe  Fe420  1  0.815312  0.297887  0.063441  1
  Fe  Fe421  1  0.815479  0.297981  0.313875  1
  Fe  Fe422  1  0.815460  0.297767  0.563710  1
  Fe  Fe423  1  0.815544  0.297863  0.813974  1
  Fe  Fe424  1  0.815570  0.631341  0.063761  1
  Fe  Fe425  1  0.815512  0.631225  0.313849  1
  Fe  Fe426  1  0.815573  0.631347  0.563895  1
  Fe  Fe427  1  0.815579  0.631360  0.813891  1
  Fe  Fe428  1  0.815510  0.964382  0.064673  1
  Fe  Fe429  1  0.814653  0.963775  0.313104  1
  Fe  Fe430  1  0.815500  0.964623  0.563765  1
  Fe  Fe431  1  0.815635  0.964702  0.813941  1
  Fe  Fe432  1  0.222403  0.111325  0.063165  1
  Fe  Fe433  1  0.224716  0.112334  0.314196  1
  Fe  Fe434  1  0.221726  0.110917  0.562067  1
  Fe  Fe435  1  0.222031  0.110991  0.812530  1
  Fe  Fe436  1  0.222092  0.444430  0.062504  1
  Fe  Fe437  1  0.222113  0.444472  0.312677  1
  Fe  Fe438  1  0.221955  0.444156  0.562347  1
  Fe  Fe439  1  0.222049  0.444341  0.812517  1
  Fe  Fe440  1  0.222061  0.777715  0.062503  1
  Fe  Fe441  1  0.222009  0.777578  0.312633  1
  Fe  Fe442  1  0.222009  0.777621  0.562682  1
  Fe  Fe443  1  0.222142  0.777767  0.812584  1
  Fe  Fe444  1  0.555475  0.111192  0.062330  1
  Fe  Fe445  1  0.555556  0.111357  0.312741  1
  Fe  Fe446  1  0.555375  0.110995  0.562512  1
  Fe  Fe447  1  0.555462  0.111168  0.812577  1
  Fe  Fe448  1  0.555516  0.444581  0.062554  1
  Fe  Fe449  1  0.555652  0.444615  0.312700  1
  Fe  Fe450  1  0.555310  0.444356  0.562586  1
  Fe  Fe451  1  0.555377  0.444434  0.812524  1
  Fe  Fe452  1  0.555409  0.777714  0.062503  1
  Fe  Fe453  1  0.555325  0.777578  0.312633  1
  Fe  Fe454  1  0.555367  0.777621  0.562681  1
  Fe  Fe455  1  0.555379  0.777765  0.812585  1
  Fe  Fe456  1  0.888680  0.111325  0.063164  1
  Fe  Fe457  1  0.887373  0.112334  0.314196  1
  Fe  Fe458  1  0.888946  0.110916  0.562068  1
  Fe  Fe459  1  0.888714  0.110990  0.812530  1
  Fe  Fe460  1  0.888820  0.444580  0.062553  1
  Fe  Fe461  1  0.888716  0.444614  0.312701  1
  Fe  Fe462  1  0.888802  0.444357  0.562586  1
  Fe  Fe463  1  0.888814  0.444435  0.812524  1
  Fe  Fe464  1  0.888914  0.778072  0.062586  1
  Fe  Fe465  1  0.889303  0.778849  0.311946  1
  Fe  Fe466  1  0.888737  0.777720  0.562459  1
  Fe  Fe467  1  0.888719  0.777682  0.812575  1
  Fe  Fe468  1  0.111649  0.223449  0.188478  1
  Fe  Fe469  1  0.111163  0.222475  0.437087  1
  Fe  Fe470  1  0.110978  0.222106  0.687231  1
  Fe  Fe471  1  0.111084  0.222318  0.937780  1
  Fe  Fe472  1  0.111091  0.555863  0.187479  1
  Fe  Fe473  1  0.110892  0.555494  0.437500  1
  Fe  Fe474  1  0.111017  0.555441  0.687534  1
  Fe  Fe475  1  0.111042  0.555565  0.937480  1
  Fe  Fe476  1  0.111188  0.889129  0.187786  1
  Fe  Fe477  1  0.110973  0.889186  0.437223  1
  Fe  Fe478  1  0.110989  0.888916  0.687491  1
  Fe  Fe479  1  0.110979  0.888909  0.937647  1
  Fe  Fe480  1  0.444446  0.222233  0.187365  1
  Fe  Fe481  1  0.444429  0.222171  0.437650  1
  Fe  Fe482  1  0.444397  0.222210  0.687598  1
  Fe  Fe483  1  0.444382  0.222213  0.937598  1
  Fe  Fe484  1  0.444622  0.555863  0.187478  1
  Fe  Fe485  1  0.444453  0.555495  0.437499  1
  Fe  Fe486  1  0.444273  0.555442  0.687535  1
  Fe  Fe487  1  0.444372  0.555565  0.937481  1
  Fe  Fe488  1  0.444295  0.888739  0.187837  1
  Fe  Fe489  1  0.444293  0.888736  0.437764  1
  Fe  Fe490  1  0.444377  0.888906  0.687508  1
  Fe  Fe491  1  0.444415  0.888981  0.937502  1
  Fe  Fe492  1  0.777635  0.222234  0.187364  1
  Fe  Fe493  1  0.777590  0.222172  0.437651  1
  Fe  Fe494  1  0.777662  0.222210  0.687599  1
  Fe  Fe495  1  0.777680  0.222213  0.937598  1
  Fe  Fe496  1  0.777754  0.555658  0.187564  1
  Fe  Fe497  1  0.777735  0.555622  0.437658  1
  Fe  Fe498  1  0.777760  0.555671  0.687546  1
  Fe  Fe499  1  0.777733  0.555616  0.937534  1
  Fe  Fe500  1  0.777791  0.889130  0.187789  1
  Fe  Fe501  1  0.778065  0.889188  0.437220  1
  Fe  Fe502  1  0.777775  0.888915  0.687492  1
  Fe  Fe503  1  0.777779  0.888908  0.937646  1
  C  C504  1  0.271145  0.209221  0.009000  1
  C  C505  1  0.271646  0.209366  0.258341  1
  C  C506  1  0.270795  0.209056  0.508376  1
  C  C507  1  0.271032  0.208963  0.758479  1
  C  C508  1  0.271103  0.542400  0.008475  1
  C  C509  1  0.271114  0.542419  0.258604  1
  C  C510  1  0.270981  0.542156  0.508370  1
  C  C511  1  0.271086  0.542364  0.758592  1
  C  C512  1  0.271033  0.875636  0.008370  1
  C  C513  1  0.271242  0.875529  0.258562  1
  C  C514  1  0.271056  0.875587  0.508643  1
  C  C515  1  0.271107  0.875741  0.758564  1
  C  C516  1  0.604453  0.209099  0.008163  1
  C  C517  1  0.604530  0.209253  0.258553  1
  C  C518  1  0.604436  0.209066  0.508685  1
  C  C519  1  0.604462  0.209116  0.758499  1
  C  C520  1  0.604591  0.542509  0.008435  1
  C  C521  1  0.604575  0.542503  0.258503  1
  C  C522  1  0.604447  0.542360  0.508622  1
  C  C523  1  0.604418  0.542415  0.758512  1
  C  C524  1  0.604410  0.875635  0.008370  1
  C  C525  1  0.604094  0.875530  0.258562  1
  C  C526  1  0.604339  0.875587  0.508643  1
  C  C527  1  0.604440  0.875740  0.758565  1
  C  C528  1  0.937884  0.209220  0.009000  1
  C  C529  1  0.937525  0.209365  0.258343  1
  C  C530  1  0.938067  0.209056  0.508380  1
  C  C531  1  0.937738  0.208961  0.758478  1
  C  C532  1  0.937724  0.542508  0.008435  1
  C  C533  1  0.937734  0.542502  0.258504  1
  C  C534  1  0.937720  0.542360  0.508621  1
  C  C535  1  0.937804  0.542416  0.758512  1
  C  C536  1  0.937874  0.875941  0.008342  1
  C  C537  1  0.938374  0.876937  0.258119  1
  C  C538  1  0.937788  0.875770  0.508592  1
  C  C539  1  0.937744  0.875681  0.758602  1
  C  C540  1  0.062158  0.271632  0.133899  1
  C  C541  1  0.061792  0.270730  0.382378  1
  C  C542  1  0.061898  0.271069  0.633362  1
  C  C543  1  0.061880  0.271026  0.883645  1
  C  C544  1  0.062052  0.604677  0.133232  1
  C  C545  1  0.062002  0.604638  0.383620  1
  C  C546  1  0.062014  0.604424  0.633564  1
  C  C547  1  0.062026  0.604511  0.883461  1
  C  C548  1  0.062154  0.938427  0.134541  1
  C  C549  1  0.062255  0.938156  0.382630  1
  C  C550  1  0.062088  0.937932  0.633374  1
  C  C551  1  0.062107  0.938029  0.883679  1
  C  C552  1  0.395730  0.271448  0.133273  1
  C  C553  1  0.395607  0.271345  0.383701  1
  C  C554  1  0.395412  0.271164  0.633530  1
  C  C555  1  0.395281  0.271093  0.883624  1
  C  C556  1  0.395400  0.604561  0.133367  1
  C  C557  1  0.395346  0.604472  0.383728  1
  C  C558  1  0.395257  0.604358  0.633452  1
  C  C559  1  0.395403  0.604548  0.883440  1
  C  C560  1  0.395498  0.937802  0.133618  1
  C  C561  1  0.395421  0.937753  0.383599  1
  C  C562  1  0.395357  0.937857  0.633504  1
  C  C563  1  0.395286  0.937839  0.883532  1
  C  C564  1  0.728670  0.271239  0.133361  1
  C  C565  1  0.728724  0.271268  0.383632  1
  C  C566  1  0.728739  0.271199  0.633476  1
  C  C567  1  0.728725  0.271229  0.883601  1
  C  C568  1  0.728833  0.604691  0.133527  1
  C  C569  1  0.728788  0.604626  0.383617  1
  C  C570  1  0.728746  0.604632  0.633549  1
  C  C571  1  0.728766  0.604633  0.883560  1
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