# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.11608047
_cell_length_b   22.99289251
_cell_length_c   47.12318646
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe
_chemical_formula_sum   Fe504
_cell_volume   13990.9088665
_cell_formula_units_Z   504
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  0.014176  0.673959  0.284975  1
  Fe  Fe2  1  0.541018  0.472009  0.345046  1
  Fe  Fe3  1  0.634846  0.662274  0.303338  1
  Fe  Fe4  1  0.013995  0.173251  0.285279  1
  Fe  Fe5  1  0.967974  0.328713  0.303289  1
  Fe  Fe6  1  0.920471  0.484750  0.324366  1
  Fe  Fe7  1  0.347254  0.340836  0.284962  1
  Fe  Fe8  1  0.301114  0.494679  0.303099  1
  Fe  Fe9  1  0.253461  0.651542  0.324281  1
  Fe  Fe10  1  0.681173  0.007093  0.284963  1
  Fe  Fe11  1  0.634553  0.162087  0.303190  1
  Fe  Fe12  1  0.587432  0.318689  0.324213  1
  Fe  Fe13  1  0.968122  0.828587  0.303115  1
  Fe  Fe14  1  0.919993  0.984590  0.324373  1
  Fe  Fe15  1  0.347894  0.840492  0.285013  1
  Fe  Fe16  1  0.302039  0.997065  0.303629  1
  Fe  Fe17  1  0.254615  0.150490  0.323381  1
  Fe  Fe18  1  0.586774  0.818252  0.324294  1
  Fe  Fe19  1  0.111749  0.740291  0.313188  1
  Fe  Fe20  1  0.778141  0.573244  0.313029  1
  Fe  Fe21  1  0.731285  0.728140  0.335125  1
  Fe  Fe22  1  0.111687  0.239944  0.313311  1
  Fe  Fe23  1  0.064458  0.394774  0.335165  1
  Fe  Fe24  1  0.157884  0.586117  0.293697  1
  Fe  Fe25  1  0.445268  0.406356  0.313386  1
  Fe  Fe26  1  0.398274  0.561376  0.335268  1
  Fe  Fe27  1  0.491642  0.752742  0.293791  1
  Fe  Fe28  1  0.778083  0.073432  0.313254  1
  Fe  Fe29  1  0.731284  0.228131  0.335101  1
  Fe  Fe30  1  0.825904  0.418970  0.294190  1
  Fe  Fe31  1  0.064736  0.894721  0.335105  1
  Fe  Fe32  1  0.156845  0.085346  0.294423  1
  Fe  Fe33  1  0.444632  0.907057  0.313318  1
  Fe  Fe34  1  0.397065  0.062313  0.334237  1
  Fe  Fe35  1  0.491487  0.253186  0.293787  1
  Fe  Fe36  1  0.824653  0.919374  0.293762  1
  Fe  Fe37  1  0.920247  0.734795  0.324331  1
  Fe  Fe38  1  0.587977  0.567102  0.323375  1
  Fe  Fe39  1  0.680984  0.757323  0.284968  1
  Fe  Fe40  1  0.919921  0.234920  0.324293  1
  Fe  Fe41  1  0.014620  0.423737  0.284977  1
  Fe  Fe42  1  0.967958  0.578701  0.303169  1
  Fe  Fe43  1  0.253343  0.401316  0.324405  1
  Fe  Fe44  1  0.347397  0.589903  0.285244  1
  Fe  Fe45  1  0.301560  0.745352  0.303169  1
  Fe  Fe46  1  0.587070  0.068116  0.324351  1
  Fe  Fe47  1  0.680981  0.257208  0.284995  1
  Fe  Fe48  1  0.635404  0.413708  0.303622  1
  Fe  Fe49  1  0.013785  0.923940  0.284971  1
  Fe  Fe50  1  0.967722  0.078015  0.303113  1
  Fe  Fe51  1  0.254187  0.902042  0.324199  1
  Fe  Fe52  1  0.207677  0.055358  0.345051  1
  Fe  Fe53  1  0.301491  0.245692  0.303354  1
  Fe  Fe54  1  0.634531  0.912052  0.303237  1
  Fe  Fe55  1  0.064610  0.644835  0.335081  1
  Fe  Fe56  1  0.730417  0.478890  0.334254  1
  Fe  Fe57  1  0.824806  0.669535  0.293771  1
  Fe  Fe58  1  0.064898  0.144725  0.335294  1
  Fe  Fe59  1  0.158092  0.336034  0.293841  1
  Fe  Fe60  1  0.111490  0.490117  0.313248  1
  Fe  Fe61  1  0.397988  0.311460  0.335136  1
  Fe  Fe62  1  0.490255  0.502004  0.294394  1
  Fe  Fe63  1  0.445103  0.656615  0.313266  1
  Fe  Fe64  1  0.731155  0.978081  0.335134  1
  Fe  Fe65  1  0.824543  0.169361  0.293708  1
  Fe  Fe66  1  0.777917  0.323721  0.313302  1
  Fe  Fe67  1  0.158345  0.836507  0.293751  1
  Fe  Fe68  1  0.111866  0.989624  0.313339  1
  Fe  Fe69  1  0.398079  0.811473  0.335135  1
  Fe  Fe70  1  0.492474  1.002318  0.294176  1
  Fe  Fe71  1  0.444822  0.156761  0.313049  1
  Fe  Fe72  1  0.778301  0.823456  0.313272  1
  Fe  Fe73  1  0.874686  0.638482  0.344435  1
  Fe  Fe74  1  0.398225  0.436345  0.407423  1
  Fe  Fe75  1  0.493920  0.627008  0.365287  1
  Fe  Fe76  1  0.875286  0.138666  0.344363  1
  Fe  Fe77  1  0.826379  0.294089  0.365689  1
  Fe  Fe78  1  0.779049  0.448455  0.386321  1
  Fe  Fe79  1  0.208120  0.305363  0.344645  1
  Fe  Fe80  1  0.159821  0.460790  0.365672  1
  Fe  Fe81  1  0.112826  0.614853  0.386593  1
  Fe  Fe82  1  0.541424  0.972184  0.344739  1
  Fe  Fe83  1  0.493082  0.127402  0.365481  1
  Fe  Fe84  1  0.445952  0.281367  0.386604  1
  Fe  Fe85  1  0.826480  0.794020  0.365691  1
  Fe  Fe86  1  0.779341  0.948222  0.386667  1
  Fe  Fe87  1  0.208497  0.805557  0.344461  1
  Fe  Fe88  1  0.159867  0.960571  0.365718  1
  Fe  Fe89  1  0.112723  0.114965  0.386761  1
  Fe  Fe90  1  0.446040  0.781563  0.386681  1
  Fe  Fe91  1  0.969215  0.704465  0.376083  1
  Fe  Fe92  1  0.635986  0.537806  0.375862  1
  Fe  Fe93  1  0.588952  0.692148  0.396799  1
  Fe  Fe94  1  0.969299  0.204585  0.376116  1
  Fe  Fe95  1  0.922182  0.359021  0.396957  1
  Fe  Fe96  1  0.017682  0.549486  0.354913  1
  Fe  Fe97  1  0.302583  0.371200  0.376170  1
  Fe  Fe98  1  0.255675  0.525626  0.396849  1
  Fe  Fe99  1  0.351018  0.716047  0.354919  1
  Fe  Fe100  1  0.635966  0.037994  0.376134  1
  Fe  Fe101  1  0.588918  0.192239  0.396821  1
  Fe  Fe102  1  0.684350  0.383150  0.354989  1
  Fe  Fe103  1  0.922248  0.858928  0.396908  1
  Fe  Fe104  1  0.017518  0.049315  0.354847  1
  Fe  Fe105  1  0.302675  0.871355  0.376081  1
  Fe  Fe106  1  0.255637  0.025630  0.397000  1
  Fe  Fe107  1  0.350810  0.215789  0.354744  1
  Fe  Fe108  1  0.684129  0.882783  0.354966  1
  Fe  Fe109  1  0.779293  0.698047  0.386590  1
  Fe  Fe110  1  0.446059  0.531635  0.386746  1
  Fe  Fe111  1  0.541561  0.722105  0.344586  1
  Fe  Fe112  1  0.779457  0.198176  0.386621  1
  Fe  Fe113  1  0.874762  0.388796  0.344761  1
  Fe  Fe114  1  0.826357  0.543943  0.365500  1
  Fe  Fe115  1  0.112632  0.364912  0.386702  1
  Fe  Fe116  1  0.208627  0.555338  0.344350  1
  Fe  Fe117  1  0.159888  0.710814  0.365622  1
  Fe  Fe118  1  0.445737  0.031870  0.386306  1
  Fe  Fe119  1  0.541486  0.222088  0.344405  1
  Fe  Fe120  1  0.493192  0.377236  0.365743  1
  Fe  Fe121  1  0.874942  0.888555  0.344525  1
  Fe  Fe122  1  0.826493  0.044109  0.365655  1
  Fe  Fe123  1  0.112747  0.864797  0.386655  1
  Fe  Fe124  1  0.064900  0.019671  0.407410  1
  Fe  Fe125  1  0.160536  0.210321  0.365326  1
  Fe  Fe126  1  0.493128  0.877452  0.365693  1
  Fe  Fe127  1  0.922226  0.608834  0.396823  1
  Fe  Fe128  1  0.588950  0.442279  0.397002  1
  Fe  Fe129  1  0.684153  0.632425  0.354720  1
  Fe  Fe130  1  0.922343  0.108949  0.396850  1
  Fe  Fe131  1  0.017530  0.299360  0.354977  1
  Fe  Fe132  1  0.969287  0.454639  0.376151  1
  Fe  Fe133  1  0.255568  0.275489  0.396833  1
  Fe  Fe134  1  0.350840  0.466012  0.354871  1
  Fe  Fe135  1  0.302690  0.621256  0.376091  1
  Fe  Fe136  1  0.588834  0.942421  0.396955  1
  Fe  Fe137  1  0.684309  0.132841  0.354917  1
  Fe  Fe138  1  0.635892  0.287936  0.376053  1
  Fe  Fe139  1  0.017617  0.799395  0.354922  1
  Fe  Fe140  1  0.969252  0.954506  0.376137  1
  Fe  Fe141  1  0.255692  0.775623  0.396871  1
  Fe  Fe142  1  0.351057  0.966532  0.354986  1
  Fe  Fe143  1  0.302665  0.121165  0.375865  1
  Fe  Fe144  1  0.635917  0.787896  0.376125  1
  Fe  Fe145  1  0.731610  0.602892  0.407307  1
  Fe  Fe146  1  0.255687  0.400161  0.470112  1
  Fe  Fe147  1  0.350798  0.590984  0.428301  1
  Fe  Fe148  1  0.731679  0.103044  0.407396  1
  Fe  Fe149  1  0.684082  0.257596  0.428272  1
  Fe  Fe150  1  0.636583  0.412214  0.449220  1
  Fe  Fe151  1  0.065077  0.269550  0.407304  1
  Fe  Fe152  1  0.017419  0.424318  0.428334  1
  Fe  Fe153  1  0.969903  0.578851  0.449174  1
  Fe  Fe154  1  0.398300  0.936462  0.407411  1
  Fe  Fe155  1  0.350795  0.090960  0.428230  1
  Fe  Fe156  1  0.303264  0.245530  0.449188  1
  Fe  Fe157  1  0.684062  0.757558  0.428270  1
  Fe  Fe158  1  0.636564  0.912281  0.449235  1
  Fe  Fe159  1  0.064920  0.769622  0.407374  1
  Fe  Fe160  1  0.017438  0.924256  0.428323  1
  Fe  Fe161  1  0.969936  0.078934  0.449214  1
  Fe  Fe162  1  0.303338  0.745507  0.449152  1
  Fe  Fe163  1  0.827060  0.668147  0.438737  1
  Fe  Fe164  1  0.493766  0.501568  0.438803  1
  Fe  Fe165  1  0.446213  0.656164  0.459606  1
  Fe  Fe166  1  0.827120  0.168235  0.438780  1
  Fe  Fe167  1  0.779448  0.322877  0.459661  1
  Fe  Fe168  1  0.874441  0.513656  0.417810  1
  Fe  Fe169  1  0.160389  0.334842  0.438772  1
  Fe  Fe170  1  0.112808  0.489546  0.459662  1
  Fe  Fe171  1  0.207874  0.680378  0.417837  1
  Fe  Fe172  1  0.493672  1.001651  0.438715  1
  Fe  Fe173  1  0.446148  0.156189  0.459628  1
  Fe  Fe174  1  0.541115  0.346968  0.417865  1
  Fe  Fe175  1  0.779431  0.822854  0.459643  1
  Fe  Fe176  1  0.874517  0.013727  0.417877  1
  Fe  Fe177  1  0.160429  0.834841  0.438773  1
  Fe  Fe178  1  0.112801  0.989551  0.459657  1
  Fe  Fe179  1  0.207949  0.180343  0.417793  1
  Fe  Fe180  1  0.541164  0.847079  0.417887  1
  Fe  Fe181  1  0.636627  0.662183  0.449161  1
  Fe  Fe182  1  0.303253  0.495582  0.449213  1
  Fe  Fe183  1  0.398506  0.686173  0.407270  1
  Fe  Fe184  1  0.636586  0.162223  0.449183  1
  Fe  Fe185  1  0.731560  0.353067  0.407402  1
  Fe  Fe186  1  0.684128  0.507587  0.428227  1
  Fe  Fe187  1  0.969946  0.328878  0.449202  1
  Fe  Fe188  1  0.065006  0.519709  0.407394  1
  Fe  Fe189  1  0.017423  0.674208  0.428261  1
  Fe  Fe190  1  0.303292  0.995595  0.449229  1
  Fe  Fe191  1  0.398279  0.186246  0.407317  1
  Fe  Fe192  1  0.350716  0.340878  0.428298  1
  Fe  Fe193  1  0.731547  0.853044  0.407416  1
  Fe  Fe194  1  0.684115  0.007667  0.428325  1
  Fe  Fe195  1  0.969888  0.828857  0.449196  1
  Fe  Fe196  1  0.922390  0.983528  0.470120  1
  Fe  Fe197  1  0.017441  0.174343  0.428323  1
  Fe  Fe198  1  0.350776  0.840990  0.428304  1
  Fe  Fe199  1  0.779479  0.572821  0.459613  1
  Fe  Fe200  1  0.446095  0.406183  0.459649  1
  Fe  Fe201  1  0.541319  0.596982  0.417772  1
  Fe  Fe202  1  0.779502  0.072900  0.459663  1
  Fe  Fe203  1  0.874489  0.263730  0.417877  1
  Fe  Fe204  1  0.826985  0.418253  0.438713  1
  Fe  Fe205  1  0.112839  0.239538  0.459643  1
  Fe  Fe206  1  0.207829  0.430399  0.417890  1
  Fe  Fe207  1  0.160457  0.584880  0.438761  1
  Fe  Fe208  1  0.446143  0.906244  0.459666  1
  Fe  Fe209  1  0.541130  0.097039  0.417806  1
  Fe  Fe210  1  0.493728  0.251494  0.438754  1
  Fe  Fe211  1  0.874438  0.763645  0.417841  1
  Fe  Fe212  1  0.827068  0.918232  0.438800  1
  Fe  Fe213  1  0.112796  0.739497  0.459625  1
  Fe  Fe214  1  0.207850  0.930361  0.417885  1
  Fe  Fe215  1  0.160432  0.084924  0.438810  1
  Fe  Fe216  1  0.493765  0.751495  0.438743  1
  Fe  Fe217  1  0.589094  0.566816  0.470067  1
  Fe  Fe218  1  0.113120  0.364038  0.532859  1
  Fe  Fe219  1  0.208180  0.554779  0.491013  1
  Fe  Fe220  1  0.589046  0.066861  0.470098  1
  Fe  Fe221  1  0.541529  0.221446  0.491010  1
  Fe  Fe222  1  0.493935  0.376093  0.511904  1
  Fe  Fe223  1  0.922391  0.233552  0.470130  1
  Fe  Fe224  1  0.874833  0.388113  0.491010  1
  Fe  Fe225  1  0.827329  0.542677  0.511887  1
  Fe  Fe226  1  0.255718  0.900181  0.470105  1
  Fe  Fe227  1  0.208192  0.054812  0.491025  1
  Fe  Fe228  1  0.160653  0.209432  0.511925  1
  Fe  Fe229  1  0.541561  0.721432  0.490988  1
  Fe  Fe230  1  0.493971  0.876083  0.511917  1
  Fe  Fe231  1  0.922356  0.733470  0.470079  1
  Fe  Fe232  1  0.874835  0.888112  0.491018  1
  Fe  Fe233  1  0.827325  0.042745  0.511918  1
  Fe  Fe234  1  0.160645  0.709367  0.511880  1
  Fe  Fe235  1  0.684449  0.632063  0.501415  1
  Fe  Fe236  1  0.351042  0.465423  0.501457  1
  Fe  Fe237  1  0.303549  0.620010  0.522341  1
  Fe  Fe238  1  0.684426  0.132104  0.501451  1
  Fe  Fe239  1  0.636893  0.286724  0.522364  1
  Fe  Fe240  1  0.731950  0.477453  0.480535  1
  Fe  Fe241  1  0.017749  0.298791  0.501480  1
  Fe  Fe242  1  0.970201  0.453343  0.522378  1
  Fe  Fe243  1  0.065279  0.644110  0.480530  1
  Fe  Fe244  1  0.351088  0.965450  0.501467  1
  Fe  Fe245  1  0.303542  0.120044  0.522350  1
  Fe  Fe246  1  0.398602  0.310803  0.480559  1
  Fe  Fe247  1  0.636887  0.786737  0.522369  1
  Fe  Fe248  1  0.731957  0.977508  0.480575  1
  Fe  Fe249  1  0.017720  0.798738  0.501433  1
  Fe  Fe250  1  0.970217  0.953365  0.522362  1
  Fe  Fe251  1  0.065301  0.144195  0.480579  1
  Fe  Fe252  1  0.398637  0.810801  0.480533  1
  Fe  Fe253  1  0.494010  0.626034  0.511874  1
  Fe  Fe254  1  0.160616  0.459387  0.511922  1
  Fe  Fe255  1  0.255738  0.650175  0.470088  1
  Fe  Fe256  1  0.493992  0.126062  0.511905  1
  Fe  Fe257  1  0.589029  0.316830  0.470103  1
  Fe  Fe258  1  0.541509  0.471437  0.491014  1
  Fe  Fe259  1  0.827311  0.292768  0.511945  1
  Fe  Fe260  1  0.922356  0.483484  0.470095  1
  Fe  Fe261  1  0.874847  0.638078  0.490989  1
  Fe  Fe262  1  0.160628  0.959404  0.511880  1
  Fe  Fe263  1  0.255739  0.150186  0.470086  1
  Fe  Fe264  1  0.208188  0.304792  0.491034  1
  Fe  Fe265  1  0.589038  0.816835  0.470097  1
  Fe  Fe266  1  0.541497  0.971489  0.491013  1
  Fe  Fe267  1  0.827301  0.792745  0.511906  1
  Fe  Fe268  1  0.779768  0.947345  0.532825  1
  Fe  Fe269  1  0.874881  0.138151  0.491027  1
  Fe  Fe270  1  0.208207  0.804749  0.490988  1
  Fe  Fe271  1  0.636895  0.536668  0.522332  1
  Fe  Fe272  1  0.303539  0.370061  0.522393  1
  Fe  Fe273  1  0.398633  0.560814  0.480552  1
  Fe  Fe274  1  0.636882  0.036703  0.522369  1
  Fe  Fe275  1  0.731957  0.227492  0.480554  1
  Fe  Fe276  1  0.684410  0.382101  0.501476  1
  Fe  Fe277  1  0.970217  0.203430  0.522401  1
  Fe  Fe278  1  0.065276  0.394139  0.480570  1
  Fe  Fe279  1  0.017722  0.548733  0.501443  1
  Fe  Fe280  1  0.303560  0.870036  0.522341  1
  Fe  Fe281  1  0.398629  0.060837  0.480544  1
  Fe  Fe282  1  0.351075  0.215429  0.501446  1
  Fe  Fe283  1  0.731957  0.727467  0.480540  1
  Fe  Fe284  1  0.684384  0.882109  0.501460  1
  Fe  Fe285  1  0.970196  0.703331  0.522330  1
  Fe  Fe286  1  0.065274  0.894124  0.480550  1
  Fe  Fe287  1  0.017760  0.048788  0.501459  1
  Fe  Fe288  1  0.351120  0.715406  0.501419  1
  Fe  Fe289  1  0.446433  0.530651  0.532805  1
  Fe  Fe290  1  0.970264  0.327974  0.595649  1
  Fe  Fe291  1  0.065478  0.518637  0.553704  1
  Fe  Fe292  1  0.446457  0.030680  0.532823  1
  Fe  Fe293  1  0.398837  0.185303  0.553671  1
  Fe  Fe294  1  0.351435  0.339895  0.574655  1
  Fe  Fe295  1  0.779824  0.197367  0.532818  1
  Fe  Fe296  1  0.732230  0.352026  0.553771  1
  Fe  Fe297  1  0.684788  0.506554  0.574618  1
  Fe  Fe298  1  0.113096  0.863992  0.532793  1
  Fe  Fe299  1  0.065568  0.018652  0.553679  1
  Fe  Fe300  1  0.018053  0.173271  0.574662  1
  Fe  Fe301  1  0.398887  0.685281  0.553644  1
  Fe  Fe302  1  0.351470  0.839870  0.574558  1
  Fe  Fe303  1  0.779805  0.697354  0.532800  1
  Fe  Fe304  1  0.732170  0.852049  0.553718  1
  Fe  Fe305  1  0.684726  0.006465  0.574630  1
  Fe  Fe306  1  0.018049  0.673113  0.574578  1
  Fe  Fe307  1  0.541832  0.595868  0.564114  1
  Fe  Fe308  1  0.208474  0.429309  0.564219  1
  Fe  Fe309  1  0.160904  0.583829  0.585085  1
  Fe  Fe310  1  0.541851  0.095877  0.564174  1
  Fe  Fe311  1  0.494224  0.250494  0.585018  1
  Fe  Fe312  1  0.589339  0.441356  0.543285  1
  Fe  Fe313  1  0.875128  0.262683  0.564255  1
  Fe  Fe314  1  0.827710  0.417198  0.585169  1
  Fe  Fe315  1  0.922660  0.607941  0.543249  1
  Fe  Fe316  1  0.208382  0.929334  0.564079  1
  Fe  Fe317  1  0.160996  0.083920  0.585106  1
  Fe  Fe318  1  0.256019  0.274680  0.543292  1
  Fe  Fe319  1  0.494440  0.750498  0.584985  1
  Fe  Fe320  1  0.589298  0.941330  0.543279  1
  Fe  Fe321  1  0.875185  0.762621  0.564149  1
  Fe  Fe322  1  0.827659  0.917244  0.585122  1
  Fe  Fe323  1  0.922717  0.107997  0.543257  1
  Fe  Fe324  1  0.256035  0.774625  0.543227  1
  Fe  Fe325  1  0.351367  0.589781  0.574587  1
  Fe  Fe326  1  0.018098  0.423195  0.574680  1
  Fe  Fe327  1  0.113094  0.613974  0.532799  1
  Fe  Fe328  1  0.351419  0.089847  0.574595  1
  Fe  Fe329  1  0.446435  0.280682  0.532810  1
  Fe  Fe330  1  0.398806  0.435391  0.553740  1
  Fe  Fe331  1  0.684790  0.256532  0.574584  1
  Fe  Fe332  1  0.779798  0.447334  0.532837  1
  Fe  Fe333  1  0.732284  0.601929  0.553633  1
  Fe  Fe334  1  0.018113  0.923220  0.574646  1
  Fe  Fe335  1  0.113127  0.114061  0.532839  1
  Fe  Fe336  1  0.065502  0.268710  0.553734  1
  Fe  Fe337  1  0.446511  0.780681  0.532787  1
  Fe  Fe338  1  0.398872  0.935344  0.553742  1
  Fe  Fe339  1  0.684741  0.756594  0.574616  1
  Fe  Fe340  1  0.636949  0.911338  0.595645  1
  Fe  Fe341  1  0.732212  0.101973  0.553689  1
  Fe  Fe342  1  0.065492  0.768607  0.553651  1
  Fe  Fe343  1  0.494296  0.500587  0.585120  1
  Fe  Fe344  1  0.160987  0.333898  0.585124  1
  Fe  Fe345  1  0.255954  0.524636  0.543267  1
  Fe  Fe346  1  0.494326  1.000486  0.585130  1
  Fe  Fe347  1  0.589369  0.191303  0.543258  1
  Fe  Fe348  1  0.541708  0.346044  0.564095  1
  Fe  Fe349  1  0.827751  0.167182  0.585039  1
  Fe  Fe350  1  0.922659  0.358014  0.543311  1
  Fe  Fe351  1  0.875189  0.512550  0.564195  1
  Fe  Fe352  1  0.160883  0.833798  0.585007  1
  Fe  Fe353  1  0.255997  0.024678  0.543266  1
  Fe  Fe354  1  0.208509  0.179297  0.564181  1
  Fe  Fe355  1  0.589412  0.691287  0.543212  1
  Fe  Fe356  1  0.541802  0.846028  0.564228  1
  Fe  Fe357  1  0.827693  0.667236  0.585062  1
  Fe  Fe358  1  0.922679  0.858011  0.543277  1
  Fe  Fe359  1  0.875161  0.012562  0.564158  1
  Fe  Fe360  1  0.208480  0.679202  0.564128  1
  Fe  Fe361  1  0.303602  0.494674  0.595655  1
  Fe  Fe362  1  0.827233  0.292024  0.658128  1
  Fe  Fe363  1  0.923447  0.482277  0.616501  1
  Fe  Fe364  1  0.303704  0.994687  0.595588  1
  Fe  Fe365  1  0.256676  0.149012  0.616393  1
  Fe  Fe366  1  0.208409  0.304043  0.637570  1
  Fe  Fe367  1  0.637040  0.161146  0.595557  1
  Fe  Fe368  1  0.589396  0.316010  0.616011  1
  Fe  Fe369  1  0.541686  0.470784  0.637591  1
  Fe  Fe370  1  0.970416  0.827947  0.595590  1
  Fe  Fe371  1  0.923320  0.982332  0.616442  1
  Fe  Fe372  1  0.875844  0.136930  0.637205  1
  Fe  Fe373  1  0.256587  0.648834  0.616346  1
  Fe  Fe374  1  0.208123  0.803874  0.637369  1
  Fe  Fe375  1  0.637274  0.661100  0.595428  1
  Fe  Fe376  1  0.589770  0.815884  0.616501  1
  Fe  Fe377  1  0.541842  0.970661  0.637790  1
  Fe  Fe378  1  0.875049  0.637527  0.637542  1
  Fe  Fe379  1  0.399395  0.559505  0.626907  1
  Fe  Fe380  1  0.066113  0.392831  0.626903  1
  Fe  Fe381  1  0.017537  0.548198  0.648136  1
  Fe  Fe382  1  0.399537  0.059561  0.626818  1
  Fe  Fe383  1  0.351028  0.214854  0.648020  1
  Fe  Fe384  1  0.446459  0.405490  0.605942  1
  Fe  Fe385  1  0.732783  0.226064  0.626686  1
  Fe  Fe386  1  0.684664  0.382020  0.648046  1
  Fe  Fe387  1  0.779990  0.572024  0.605845  1
  Fe  Fe388  1  0.066167  0.892873  0.626910  1
  Fe  Fe389  1  0.017797  0.048038  0.648072  1
  Fe  Fe390  1  0.113215  0.238667  0.605858  1
  Fe  Fe391  1  0.350976  0.714508  0.647792  1
  Fe  Fe392  1  0.446557  0.905401  0.606107  1
  Fe  Fe393  1  0.732775  0.726240  0.626818  1
  Fe  Fe394  1  0.684382  0.881423  0.647914  1
  Fe  Fe395  1  0.779931  0.071870  0.605807  1
  Fe  Fe396  1  0.113200  0.738513  0.605788  1
  Fe  Fe397  1  0.208334  0.554158  0.637686  1
  Fe  Fe398  1  0.875104  0.387327  0.637753  1
  Fe  Fe399  1  0.970294  0.577872  0.595607  1
  Fe  Fe400  1  0.208368  0.054078  0.637582  1
  Fe  Fe401  1  0.303719  0.244612  0.595612  1
  Fe  Fe402  1  0.256621  0.399026  0.616427  1
  Fe  Fe403  1  0.541504  0.220641  0.637380  1
  Fe  Fe404  1  0.637082  0.411399  0.595609  1
  Fe  Fe405  1  0.589946  0.565712  0.616394  1
  Fe  Fe406  1  0.875138  0.887326  0.637560  1
  Fe  Fe407  1  0.970556  0.077796  0.595486  1
  Fe  Fe408  1  0.923130  0.232522  0.616566  1
  Fe  Fe409  1  0.303699  0.744493  0.595496  1
  Fe  Fe410  1  0.256075  0.899297  0.616010  1
  Fe  Fe411  1  0.542466  0.720303  0.637126  1
  Fe  Fe412  1  0.493891  0.875313  0.658096  1
  Fe  Fe413  1  0.590035  0.065444  0.616444  1
  Fe  Fe414  1  0.923375  0.732368  0.616350  1
  Fe  Fe415  1  0.350909  0.464849  0.648093  1
  Fe  Fe416  1  0.017661  0.298156  0.647938  1
  Fe  Fe417  1  0.113218  0.488739  0.605913  1
  Fe  Fe418  1  0.351328  0.965295  0.648064  1
  Fe  Fe419  1  0.446563  0.155256  0.605807  1
  Fe  Fe420  1  0.399471  0.309553  0.626902  1
  Fe  Fe421  1  0.684254  0.131085  0.647918  1
  Fe  Fe422  1  0.779878  0.322019  0.606121  1
  Fe  Fe423  1  0.732914  0.476363  0.626843  1
  Fe  Fe424  1  0.017790  0.798176  0.647998  1
  Fe  Fe425  1  0.113198  0.988757  0.605933  1
  Fe  Fe426  1  0.066112  0.142851  0.626887  1
  Fe  Fe427  1  0.446585  0.655185  0.605750  1
  Fe  Fe428  1  0.399426  0.809453  0.626627  1
  Fe  Fe429  1  0.684450  0.631489  0.647980  1
  Fe  Fe430  1  0.779910  0.822007  0.605833  1
  Fe  Fe431  1  0.732819  0.976155  0.626940  1
  Fe  Fe432  1  0.066007  0.642700  0.626826  1
  Fe  Fe433  1  0.161217  0.458764  0.657456  1
  Fe  Fe434  1  0.688549  0.257858  0.717403  1
  Fe  Fe435  1  0.781326  0.447619  0.679247  1
  Fe  Fe436  1  0.161331  0.958795  0.657658  1
  Fe  Fe437  1  0.114048  0.113244  0.679307  1
  Fe  Fe438  1  0.067363  0.267173  0.698835  1
  Fe  Fe439  1  0.494559  0.125368  0.657424  1
  Fe  Fe440  1  0.447439  0.280046  0.679444  1
  Fe  Fe441  1  0.400898  0.433806  0.698913  1
  Fe  Fe442  1  0.827931  0.791984  0.657433  1
  Fe  Fe443  1  0.781013  0.946251  0.679316  1
  Fe  Fe444  1  0.734576  0.101164  0.698972  1
  Fe  Fe445  1  0.114238  0.613511  0.679367  1
  Fe  Fe446  1  0.067493  0.767142  0.698827  1
  Fe  Fe447  1  0.494577  0.625536  0.657467  1
  Fe  Fe448  1  0.448521  0.779013  0.678381  1
  Fe  Fe449  1  0.401680  0.935715  0.699180  1
  Fe  Fe450  1  0.734100  0.600517  0.698804  1
  Fe  Fe451  1  0.257889  0.524863  0.689476  1
  Fe  Fe452  1  0.924711  0.357632  0.689544  1
  Fe  Fe453  1  0.878957  0.513368  0.707628  1
  Fe  Fe454  1  0.257471  0.024879  0.689501  1
  Fe  Fe455  1  0.211303  0.179469  0.707593  1
  Fe  Fe456  1  0.305472  0.368648  0.668239  1
  Fe  Fe457  1  0.590984  0.191679  0.689168  1
  Fe  Fe458  1  0.545834  0.345607  0.708103  1
  Fe  Fe459  1  0.638550  0.535481  0.668200  1
  Fe  Fe460  1  0.924292  0.857874  0.689414  1
  Fe  Fe461  1  0.877606  0.012909  0.707592  1
  Fe  Fe462  1  0.972164  0.202087  0.668385  1
  Fe  Fe463  1  0.211660  0.679669  0.707684  1
  Fe  Fe464  1  0.304129  0.869556  0.667302  1
  Fe  Fe465  1  0.591230  0.691413  0.689452  1
  Fe  Fe466  1  0.543769  0.845155  0.708419  1
  Fe  Fe467  1  0.639441  0.035070  0.668549  1
  Fe  Fe468  1  0.972188  0.702109  0.668137  1
  Fe  Fe469  1  0.068010  0.517538  0.698849  1
  Fe  Fe470  1  0.735076  0.352553  0.699172  1
  Fe  Fe471  1  0.828027  0.542310  0.657454  1
  Fe  Fe472  1  0.067407  0.017043  0.698937  1
  Fe  Fe473  1  0.161193  0.208720  0.657444  1
  Fe  Fe474  1  0.114325  0.363134  0.679305  1
  Fe  Fe475  1  0.400750  0.183849  0.698825  1
  Fe  Fe476  1  0.494642  0.375531  0.657641  1
  Fe  Fe477  1  0.447465  0.529924  0.679320  1
  Fe  Fe478  1  0.733978  0.850234  0.698824  1
  Fe  Fe479  1  0.827945  0.042121  0.657493  1
  Fe  Fe480  1  0.782068  0.195746  0.678428  1
  Fe  Fe481  1  0.161178  0.708471  0.657407  1
  Fe  Fe482  1  0.114178  0.863295  0.679454  1
  Fe  Fe483  1  0.400926  0.684360  0.698923  1
  Fe  Fe484  1  0.354940  0.841012  0.717399  1
  Fe  Fe485  1  0.448043  0.030816  0.679313  1
  Fe  Fe486  1  0.780594  0.696696  0.679249  1
  Fe  Fe487  1  0.211379  0.429606  0.707561  1
  Fe  Fe488  1  0.877286  0.262049  0.708443  1
  Fe  Fe489  1  0.972588  0.451840  0.668414  1
  Fe  Fe490  1  0.212462  0.928892  0.708117  1
  Fe  Fe491  1  0.305294  0.118704  0.668189  1
  Fe  Fe492  1  0.257608  0.274694  0.689411  1
  Fe  Fe493  1  0.545489  0.096713  0.707710  1
  Fe  Fe494  1  0.637516  0.286338  0.667302  1
  Fe  Fe495  1  0.590891  0.441593  0.689495  1
  Fe  Fe496  1  0.878140  0.762601  0.707598  1
  Fe  Fe497  1  0.972076  0.951908  0.668283  1
  Fe  Fe498  1  0.924748  0.107997  0.689496  1
  Fe  Fe499  1  0.305805  0.618720  0.668349  1
  Fe  Fe500  1  0.257549  0.774730  0.689153  1
  Fe  Fe501  1  0.544436  0.596306  0.707605  1
  Fe  Fe502  1  0.638649  0.785419  0.668294  1
  Fe  Fe503  1  0.591379  0.940744  0.689557  1
  Fe  Fe504  1  0.924379  0.608582  0.689436  1
