# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.10426438
_cell_length_b   23.02132596
_cell_length_c   47.28718979
_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   14044.2994915
_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  0.021205  0.674802  0.280332  1
  Fe  Fe2  1  0.548163  0.471960  0.342084  1
  Fe  Fe3  1  0.640409  0.661015  0.298962  1
  Fe  Fe4  1  0.023203  0.174465  0.280255  1
  Fe  Fe5  1  0.973660  0.330773  0.299430  1
  Fe  Fe6  1  0.927713  0.483534  0.319979  1
  Fe  Fe7  1  0.354778  0.341122  0.280396  1
  Fe  Fe8  1  0.307452  0.496676  0.299311  1
  Fe  Fe9  1  0.261921  0.650141  0.320244  1
  Fe  Fe10  1  0.689141  0.008138  0.280135  1
  Fe  Fe11  1  0.640777  0.163138  0.299102  1
  Fe  Fe12  1  0.595306  0.316953  0.320189  1
  Fe  Fe13  1  0.973314  0.827779  0.298779  1
  Fe  Fe14  1  0.927645  0.984637  0.320910  1
  Fe  Fe15  1  0.355407  0.841185  0.280124  1
  Fe  Fe16  1  0.306845  0.994565  0.298781  1
  Fe  Fe17  1  0.260834  0.151441  0.320922  1
  Fe  Fe18  1  0.594533  0.817742  0.321087  1
  Fe  Fe19  1  0.117673  0.740021  0.310028  1
  Fe  Fe20  1  0.783070  0.571715  0.308874  1
  Fe  Fe21  1  0.738211  0.727739  0.331822  1
  Fe  Fe22  1  0.117618  0.240919  0.309738  1
  Fe  Fe23  1  0.070734  0.395425  0.331636  1
  Fe  Fe24  1  0.166162  0.585566  0.289553  1
  Fe  Fe25  1  0.450604  0.406676  0.310091  1
  Fe  Fe26  1  0.404459  0.561687  0.331339  1
  Fe  Fe27  1  0.498524  0.751798  0.289320  1
  Fe  Fe28  1  0.784698  0.073962  0.309693  1
  Fe  Fe29  1  0.737913  0.228450  0.331462  1
  Fe  Fe30  1  0.830109  0.419410  0.290191  1
  Fe  Fe31  1  0.071663  0.894548  0.331699  1
  Fe  Fe32  1  0.164921  0.084822  0.289086  1
  Fe  Fe33  1  0.451484  0.906550  0.309721  1
  Fe  Fe34  1  0.405109  0.061442  0.331679  1
  Fe  Fe35  1  0.499276  0.252162  0.289425  1
  Fe  Fe36  1  0.831461  0.918256  0.289040  1
  Fe  Fe37  1  0.927505  0.734425  0.321215  1
  Fe  Fe38  1  0.594281  0.566930  0.319933  1
  Fe  Fe39  1  0.689041  0.758012  0.280155  1
  Fe  Fe40  1  0.927548  0.235174  0.320878  1
  Fe  Fe41  1  0.880694  0.388690  0.341979  1
  Fe  Fe42  1  0.973930  0.577479  0.298960  1
  Fe  Fe43  1  0.260315  0.401868  0.321069  1
  Fe  Fe44  1  0.214143  0.555150  0.341721  1
  Fe  Fe45  1  0.306840  0.743948  0.298718  1
  Fe  Fe46  1  0.594602  0.068212  0.320897  1
  Fe  Fe47  1  0.547892  0.222406  0.341902  1
  Fe  Fe48  1  0.640325  0.411584  0.299077  1
  Fe  Fe49  1  0.022312  0.924575  0.280094  1
  Fe  Fe50  1  0.973020  0.078446  0.298854  1
  Fe  Fe51  1  0.261101  0.901011  0.320979  1
  Fe  Fe52  1  0.355563  0.091491  0.280090  1
  Fe  Fe53  1  0.305979  0.245166  0.298918  1
  Fe  Fe54  1  0.640111  0.911262  0.298771  1
  Fe  Fe55  1  0.071370  0.644451  0.331863  1
  Fe  Fe56  1  0.737054  0.478295  0.331255  1
  Fe  Fe57  1  0.831505  0.668260  0.289389  1
  Fe  Fe58  1  0.071652  0.144917  0.331762  1
  Fe  Fe59  1  0.162579  0.338193  0.289809  1
  Fe  Fe60  1  0.116724  0.487832  0.308399  1
  Fe  Fe61  1  0.404561  0.311592  0.331921  1
  Fe  Fe62  1  0.498183  0.501813  0.290104  1
  Fe  Fe63  1  0.449941  0.655312  0.308903  1
  Fe  Fe64  1  0.738360  0.978108  0.331683  1
  Fe  Fe65  1  0.830156  0.171029  0.289691  1
  Fe  Fe66  1  0.783512  0.321260  0.308573  1
  Fe  Fe67  1  0.164774  0.834699  0.289072  1
  Fe  Fe68  1  0.118005  0.989981  0.309741  1
  Fe  Fe69  1  0.404946  0.811051  0.331720  1
  Fe  Fe70  1  0.498216  1.001736  0.289052  1
  Fe  Fe71  1  0.451397  0.156897  0.309673  1
  Fe  Fe72  1  0.784755  0.823264  0.309813  1
  Fe  Fe73  1  0.880573  0.638195  0.341981  1
  Fe  Fe74  1  0.404328  0.436465  0.404507  1
  Fe  Fe75  1  0.499645  0.626989  0.362647  1
  Fe  Fe76  1  0.881128  0.138884  0.342230  1
  Fe  Fe77  1  0.833015  0.293951  0.362773  1
  Fe  Fe78  1  0.785230  0.448376  0.383502  1
  Fe  Fe79  1  0.214148  0.305621  0.342305  1
  Fe  Fe80  1  0.166135  0.460772  0.362777  1
  Fe  Fe81  1  0.118718  0.614739  0.383470  1
  Fe  Fe82  1  0.547595  0.972154  0.342000  1
  Fe  Fe83  1  0.499740  0.127372  0.362754  1
  Fe  Fe84  1  0.452143  0.281786  0.383619  1
  Fe  Fe85  1  0.832844  0.793837  0.362871  1
  Fe  Fe86  1  0.785362  0.948422  0.383580  1
  Fe  Fe87  1  0.214307  0.805205  0.342041  1
  Fe  Fe88  1  0.166359  0.960517  0.362782  1
  Fe  Fe89  1  0.118728  0.115135  0.383608  1
  Fe  Fe90  1  0.451955  0.781565  0.383537  1
  Fe  Fe91  1  0.975823  0.704259  0.373230  1
  Fe  Fe92  1  0.642448  0.537833  0.373122  1
  Fe  Fe93  1  0.594753  0.692212  0.393923  1
  Fe  Fe94  1  0.975908  0.204564  0.373222  1
  Fe  Fe95  1  0.928051  0.359223  0.394055  1
  Fe  Fe96  1  0.023523  0.549138  0.352012  1
  Fe  Fe97  1  0.309151  0.371279  0.373322  1
  Fe  Fe98  1  0.261506  0.525762  0.393993  1
  Fe  Fe99  1  0.356879  0.716029  0.352205  1
  Fe  Fe100  1  0.642575  0.037810  0.373140  1
  Fe  Fe101  1  0.594829  0.192511  0.394018  1
  Fe  Fe102  1  0.690600  0.382547  0.352262  1
  Fe  Fe103  1  0.928086  0.859066  0.394027  1
  Fe  Fe104  1  0.023668  0.049808  0.352340  1
  Fe  Fe105  1  0.309261  0.871039  0.373149  1
  Fe  Fe106  1  0.261474  0.025769  0.393990  1
  Fe  Fe107  1  0.356998  0.216513  0.352349  1
  Fe  Fe108  1  0.690215  0.883147  0.352355  1
  Fe  Fe109  1  0.785307  0.698166  0.383556  1
  Fe  Fe110  1  0.452213  0.531761  0.383606  1
  Fe  Fe111  1  0.547298  0.721665  0.341978  1
  Fe  Fe112  1  0.785481  0.198532  0.383716  1
  Fe  Fe113  1  0.737544  0.353106  0.404424  1
  Fe  Fe114  1  0.832865  0.543594  0.362601  1
  Fe  Fe115  1  0.118668  0.365297  0.383773  1
  Fe  Fe116  1  0.070804  0.519691  0.404364  1
  Fe  Fe117  1  0.166404  0.710273  0.362786  1
  Fe  Fe118  1  0.452046  0.031811  0.383560  1
  Fe  Fe119  1  0.404228  0.186452  0.404406  1
  Fe  Fe120  1  0.499963  0.377089  0.362835  1
  Fe  Fe121  1  0.880877  0.888749  0.342030  1
  Fe  Fe122  1  0.833063  0.043879  0.362796  1
  Fe  Fe123  1  0.118739  0.865037  0.383597  1
  Fe  Fe124  1  0.214272  0.055499  0.342026  1
  Fe  Fe125  1  0.166344  0.210628  0.362841  1
  Fe  Fe126  1  0.499591  0.877175  0.362792  1
  Fe  Fe127  1  0.928133  0.608787  0.393893  1
  Fe  Fe128  1  0.594906  0.442377  0.393998  1
  Fe  Fe129  1  0.690027  0.632608  0.352158  1
  Fe  Fe130  1  0.928195  0.109093  0.394073  1
  Fe  Fe131  1  0.023517  0.299823  0.352589  1
  Fe  Fe132  1  0.975578  0.454606  0.373179  1
  Fe  Fe133  1  0.261514  0.275811  0.394115  1
  Fe  Fe134  1  0.356975  0.466412  0.352590  1
  Fe  Fe135  1  0.309154  0.620989  0.373138  1
  Fe  Fe136  1  0.594734  0.942426  0.393991  1
  Fe  Fe137  1  0.690434  0.133132  0.352526  1
  Fe  Fe138  1  0.642626  0.287845  0.373228  1
  Fe  Fe139  1  0.023515  0.799749  0.352441  1
  Fe  Fe140  1  0.975944  0.954427  0.373138  1
  Fe  Fe141  1  0.261435  0.775589  0.393967  1
  Fe  Fe142  1  0.356950  0.966458  0.352312  1
  Fe  Fe143  1  0.309294  0.121188  0.373140  1
  Fe  Fe144  1  0.642468  0.787663  0.373179  1
  Fe  Fe145  1  0.737514  0.602941  0.404327  1
  Fe  Fe146  1  0.260765  0.400536  0.466863  1
  Fe  Fe147  1  0.356388  0.591037  0.425192  1
  Fe  Fe148  1  0.737567  0.103092  0.404452  1
  Fe  Fe149  1  0.689744  0.257812  0.425254  1
  Fe  Fe150  1  0.641885  0.412468  0.446018  1
  Fe  Fe151  1  0.070896  0.269838  0.404511  1
  Fe  Fe152  1  0.023012  0.424508  0.425267  1
  Fe  Fe153  1  0.975175  0.579035  0.445952  1
  Fe  Fe154  1  0.404145  0.936410  0.404374  1
  Fe  Fe155  1  0.356391  0.091108  0.425162  1
  Fe  Fe156  1  0.308584  0.245805  0.446023  1
  Fe  Fe157  1  0.689648  0.757641  0.425130  1
  Fe  Fe158  1  0.641824  0.912401  0.445943  1
  Fe  Fe159  1  0.070819  0.769654  0.404410  1
  Fe  Fe160  1  0.023061  0.924385  0.425165  1
  Fe  Fe161  1  0.975251  0.079087  0.445984  1
  Fe  Fe162  1  0.308507  0.745664  0.445929  1
  Fe  Fe163  1  0.832450  0.668303  0.435521  1
  Fe  Fe164  1  0.499197  0.501782  0.435630  1
  Fe  Fe165  1  0.451288  0.656397  0.456357  1
  Fe  Fe166  1  0.832517  0.168473  0.435642  1
  Fe  Fe167  1  0.784646  0.323179  0.456434  1
  Fe  Fe168  1  0.880173  0.513684  0.414769  1
  Fe  Fe169  1  0.165840  0.335194  0.435688  1
  Fe  Fe170  1  0.117967  0.489830  0.456434  1
  Fe  Fe171  1  0.213531  0.680254  0.414747  1
  Fe  Fe172  1  0.499105  1.001770  0.435546  1
  Fe  Fe173  1  0.451328  0.156450  0.456372  1
  Fe  Fe174  1  0.546989  0.347110  0.414850  1
  Fe  Fe175  1  0.784595  0.823033  0.456335  1
  Fe  Fe176  1  0.880330  0.013708  0.414784  1
  Fe  Fe177  1  0.165798  0.835024  0.435553  1
  Fe  Fe178  1  0.117998  0.989731  0.456351  1
  Fe  Fe179  1  0.213671  0.180435  0.414817  1
  Fe  Fe180  1  0.546868  0.847008  0.414753  1
  Fe  Fe181  1  0.641880  0.662367  0.445937  1
  Fe  Fe182  1  0.308589  0.495827  0.446047  1
  Fe  Fe183  1  0.404125  0.686266  0.404332  1
  Fe  Fe184  1  0.641897  0.162467  0.445999  1
  Fe  Fe185  1  0.594068  0.317167  0.466828  1
  Fe  Fe186  1  0.689698  0.507717  0.425178  1
  Fe  Fe187  1  0.975219  0.329200  0.446053  1
  Fe  Fe188  1  0.927354  0.483823  0.466814  1
  Fe  Fe189  1  0.023004  0.674248  0.425129  1
  Fe  Fe190  1  0.308552  0.995754  0.445951  1
  Fe  Fe191  1  0.260745  0.150446  0.466766  1
  Fe  Fe192  1  0.356431  0.341154  0.425267  1
  Fe  Fe193  1  0.737417  0.853057  0.404400  1
  Fe  Fe194  1  0.689698  0.007751  0.425161  1
  Fe  Fe195  1  0.975201  0.829039  0.445961  1
  Fe  Fe196  1  0.070876  0.019727  0.404390  1
  Fe  Fe197  1  0.023084  0.174471  0.425223  1
  Fe  Fe198  1  0.356340  0.841002  0.425133  1
  Fe  Fe199  1  0.784611  0.573078  0.456364  1
  Fe  Fe200  1  0.451344  0.406500  0.456454  1
  Fe  Fe201  1  0.546963  0.597033  0.414785  1
  Fe  Fe202  1  0.784667  0.073091  0.456373  1
  Fe  Fe203  1  0.880350  0.263840  0.414867  1
  Fe  Fe204  1  0.832403  0.418470  0.435611  1
  Fe  Fe205  1  0.118004  0.239825  0.456425  1
  Fe  Fe206  1  0.213675  0.430528  0.414897  1
  Fe  Fe207  1  0.165756  0.585025  0.435559  1
  Fe  Fe208  1  0.451271  0.906390  0.456329  1
  Fe  Fe209  1  0.546977  0.097112  0.414774  1
  Fe  Fe210  1  0.499136  0.251801  0.435613  1
  Fe  Fe211  1  0.880227  0.763647  0.414784  1
  Fe  Fe212  1  0.832431  0.918399  0.435559  1
  Fe  Fe213  1  0.117946  0.739674  0.456343  1
  Fe  Fe214  1  0.213649  0.930378  0.414771  1
  Fe  Fe215  1  0.165802  0.085099  0.435569  1
  Fe  Fe216  1  0.499073  0.751651  0.435511  1
  Fe  Fe217  1  0.594077  0.567121  0.466792  1
  Fe  Fe218  1  0.117257  0.364602  0.529210  1
  Fe  Fe219  1  0.212897  0.555169  0.487609  1
  Fe  Fe220  1  0.594074  0.067103  0.466746  1
  Fe  Fe221  1  0.546250  0.221829  0.487581  1
  Fe  Fe222  1  0.498420  0.376552  0.508424  1
  Fe  Fe223  1  0.927429  0.233844  0.466824  1
  Fe  Fe224  1  0.879560  0.388544  0.487626  1
  Fe  Fe225  1  0.831724  0.543195  0.508393  1
  Fe  Fe226  1  0.260742  0.900382  0.466734  1
  Fe  Fe227  1  0.212914  0.055092  0.487531  1
  Fe  Fe228  1  0.165086  0.209830  0.508356  1
  Fe  Fe229  1  0.546214  0.721736  0.487521  1
  Fe  Fe230  1  0.498385  0.876403  0.508297  1
  Fe  Fe231  1  0.927383  0.733688  0.466732  1
  Fe  Fe232  1  0.879564  0.888384  0.487516  1
  Fe  Fe233  1  0.831760  0.043099  0.508311  1
  Fe  Fe234  1  0.165078  0.709765  0.508352  1
  Fe  Fe235  1  0.688989  0.632463  0.497958  1
  Fe  Fe236  1  0.355678  0.465886  0.498040  1
  Fe  Fe237  1  0.307822  0.620506  0.518789  1
  Fe  Fe238  1  0.689016  0.132474  0.497949  1
  Fe  Fe239  1  0.641176  0.287217  0.518795  1
  Fe  Fe240  1  0.736796  0.477828  0.477206  1
  Fe  Fe241  1  0.022340  0.299215  0.498014  1
  Fe  Fe242  1  0.974483  0.453917  0.518821  1
  Fe  Fe243  1  0.070125  0.644404  0.477152  1
  Fe  Fe244  1  0.355667  0.965749  0.497918  1
  Fe  Fe245  1  0.307843  0.120451  0.518709  1
  Fe  Fe246  1  0.403500  0.311177  0.477222  1
  Fe  Fe247  1  0.641136  0.787076  0.518693  1
  Fe  Fe248  1  0.736805  0.977742  0.477125  1
  Fe  Fe249  1  0.022343  0.799054  0.497927  1
  Fe  Fe250  1  0.974525  0.953730  0.518691  1
  Fe  Fe251  1  0.070166  0.144459  0.477169  1
  Fe  Fe252  1  0.403457  0.811036  0.477112  1
  Fe  Fe253  1  0.498408  0.626486  0.508376  1
  Fe  Fe254  1  0.165081  0.459909  0.508437  1
  Fe  Fe255  1  0.260697  0.650395  0.466760  1
  Fe  Fe256  1  0.498440  0.126461  0.508328  1
  Fe  Fe257  1  0.450599  0.281212  0.529172  1
  Fe  Fe258  1  0.546256  0.471853  0.487626  1
  Fe  Fe259  1  0.831763  0.293220  0.508410  1
  Fe  Fe260  1  0.783907  0.447914  0.529210  1
  Fe  Fe261  1  0.879559  0.638432  0.487548  1
  Fe  Fe262  1  0.165114  0.959738  0.508315  1
  Fe  Fe263  1  0.117255  0.114455  0.529108  1
  Fe  Fe264  1  0.212926  0.305199  0.487620  1
  Fe  Fe265  1  0.594011  0.817029  0.466710  1
  Fe  Fe266  1  0.546220  0.971752  0.487514  1
  Fe  Fe267  1  0.831743  0.793062  0.508306  1
  Fe  Fe268  1  0.927414  0.983727  0.466742  1
  Fe  Fe269  1  0.879600  0.138471  0.487571  1
  Fe  Fe270  1  0.212913  0.805046  0.487528  1
  Fe  Fe271  1  0.641166  0.537212  0.518803  1
  Fe  Fe272  1  0.307842  0.370580  0.518821  1
  Fe  Fe273  1  0.403500  0.561151  0.477212  1
  Fe  Fe274  1  0.641176  0.037108  0.518700  1
  Fe  Fe275  1  0.736838  0.227840  0.477212  1
  Fe  Fe276  1  0.688990  0.382540  0.498019  1
  Fe  Fe277  1  0.974518  0.203852  0.518765  1
  Fe  Fe278  1  0.070155  0.394549  0.477250  1
  Fe  Fe279  1  0.022303  0.549180  0.497999  1
  Fe  Fe280  1  0.307857  0.870412  0.518713  1
  Fe  Fe281  1  0.403495  0.061101  0.477135  1
  Fe  Fe282  1  0.355677  0.215820  0.497963  1
  Fe  Fe283  1  0.736803  0.727714  0.477117  1
  Fe  Fe284  1  0.688956  0.882391  0.497897  1
  Fe  Fe285  1  0.974515  0.703786  0.518745  1
  Fe  Fe286  1  0.070176  0.894382  0.477133  1
  Fe  Fe287  1  0.022345  0.049089  0.497927  1
  Fe  Fe288  1  0.355639  0.715750  0.497939  1
  Fe  Fe289  1  0.450595  0.531233  0.529216  1
  Fe  Fe290  1  0.973796  0.328632  0.591564  1
  Fe  Fe291  1  0.069425  0.519267  0.550023  1
  Fe  Fe292  1  0.450603  0.031110  0.529096  1
  Fe  Fe293  1  0.402796  0.185812  0.549895  1
  Fe  Fe294  1  0.354941  0.340623  0.570768  1
  Fe  Fe295  1  0.783947  0.197867  0.529155  1
  Fe  Fe296  1  0.736110  0.352594  0.550002  1
  Fe  Fe297  1  0.688258  0.507294  0.570809  1
  Fe  Fe298  1  0.117313  0.864407  0.529109  1
  Fe  Fe299  1  0.069473  0.019083  0.549878  1
  Fe  Fe300  1  0.021615  0.173846  0.570706  1
  Fe  Fe301  1  0.402752  0.685819  0.549966  1
  Fe  Fe302  1  0.354962  0.840477  0.570714  1
  Fe  Fe303  1  0.783926  0.697802  0.529132  1
  Fe  Fe304  1  0.736084  0.852401  0.549864  1
  Fe  Fe305  1  0.688257  0.007117  0.570649  1
  Fe  Fe306  1  0.021640  0.673902  0.570786  1
  Fe  Fe307  1  0.545514  0.596568  0.560403  1
  Fe  Fe308  1  0.212173  0.429981  0.560428  1
  Fe  Fe309  1  0.164396  0.584583  0.581213  1
  Fe  Fe310  1  0.545555  0.096465  0.560286  1
  Fe  Fe311  1  0.497727  0.251196  0.581100  1
  Fe  Fe312  1  0.593349  0.441919  0.539614  1
  Fe  Fe313  1  0.878884  0.263248  0.560371  1
  Fe  Fe314  1  0.831049  0.417976  0.581193  1
  Fe  Fe315  1  0.926677  0.608547  0.539582  1
  Fe  Fe316  1  0.212270  0.929773  0.560305  1
  Fe  Fe317  1  0.164347  0.084448  0.581059  1
  Fe  Fe318  1  0.260016  0.275218  0.539543  1
  Fe  Fe319  1  0.497665  0.751141  0.581108  1
  Fe  Fe320  1  0.593323  0.941760  0.539471  1
  Fe  Fe321  1  0.878901  0.763134  0.560322  1
  Fe  Fe322  1  0.831028  0.917737  0.581014  1
  Fe  Fe323  1  0.926695  0.108476  0.539501  1
  Fe  Fe324  1  0.260039  0.775107  0.539536  1
  Fe  Fe325  1  0.354927  0.590587  0.570814  1
  Fe  Fe326  1  0.021587  0.424001  0.570809  1
  Fe  Fe327  1  0.117249  0.614526  0.529191  1
  Fe  Fe328  1  0.354937  0.090456  0.570659  1
  Fe  Fe329  1  0.307104  0.245188  0.591415  1
  Fe  Fe330  1  0.402765  0.435944  0.550022  1
  Fe  Fe331  1  0.688306  0.257244  0.570752  1
  Fe  Fe332  1  0.640465  0.411974  0.591600  1
  Fe  Fe333  1  0.736102  0.602560  0.549988  1
  Fe  Fe334  1  0.021678  0.923746  0.570651  1
  Fe  Fe335  1  0.973827  0.078466  0.591410  1
  Fe  Fe336  1  0.069433  0.269232  0.549951  1
  Fe  Fe337  1  0.450565  0.781092  0.529108  1
  Fe  Fe338  1  0.402785  0.935778  0.549901  1
  Fe  Fe339  1  0.688246  0.757142  0.570694  1
  Fe  Fe340  1  0.783909  0.947737  0.529071  1
  Fe  Fe341  1  0.736120  0.102482  0.549884  1
  Fe  Fe342  1  0.069498  0.769124  0.549946  1
  Fe  Fe343  1  0.497713  0.501293  0.581209  1
  Fe  Fe344  1  0.164361  0.334629  0.581136  1
  Fe  Fe345  1  0.260012  0.525251  0.539623  1
  Fe  Fe346  1  0.497695  1.001147  0.581066  1
  Fe  Fe347  1  0.593372  0.191848  0.539528  1
  Fe  Fe348  1  0.545525  0.346599  0.560394  1
  Fe  Fe349  1  0.831056  0.167881  0.581087  1
  Fe  Fe350  1  0.926685  0.358599  0.539604  1
  Fe  Fe351  1  0.878826  0.513284  0.560409  1
  Fe  Fe352  1  0.164493  0.834481  0.581119  1
  Fe  Fe353  1  0.260032  0.025098  0.539496  1
  Fe  Fe354  1  0.212161  0.179815  0.560273  1
  Fe  Fe355  1  0.593328  0.691808  0.539535  1
  Fe  Fe356  1  0.545475  0.846434  0.560276  1
  Fe  Fe357  1  0.831078  0.667917  0.581163  1
  Fe  Fe358  1  0.926708  0.858398  0.539485  1
  Fe  Fe359  1  0.878860  0.013091  0.560237  1
  Fe  Fe360  1  0.212195  0.679853  0.560394  1
  Fe  Fe361  1  0.307082  0.495307  0.591635  1
  Fe  Fe362  1  0.830608  0.293125  0.653883  1
  Fe  Fe363  1  0.925866  0.483328  0.612447  1
  Fe  Fe364  1  0.307152  0.995155  0.591491  1
  Fe  Fe365  1  0.259193  0.149730  0.612199  1
  Fe  Fe366  1  0.211460  0.304509  0.633067  1
  Fe  Fe367  1  0.640491  0.161825  0.591464  1
  Fe  Fe368  1  0.592646  0.316619  0.612332  1
  Fe  Fe369  1  0.545032  0.471228  0.633290  1
  Fe  Fe370  1  0.973884  0.828468  0.591494  1
  Fe  Fe371  1  0.926055  0.983030  0.612149  1
  Fe  Fe372  1  0.878422  0.137698  0.633041  1
  Fe  Fe373  1  0.259315  0.649863  0.612464  1
  Fe  Fe374  1  0.211702  0.804564  0.633254  1
  Fe  Fe375  1  0.640413  0.661910  0.591555  1
  Fe  Fe376  1  0.592532  0.816406  0.612279  1
  Fe  Fe377  1  0.544765  0.971148  0.633071  1
  Fe  Fe378  1  0.878323  0.637936  0.633265  1
  Fe  Fe379  1  0.402181  0.560421  0.622845  1
  Fe  Fe380  1  0.068722  0.393882  0.622768  1
  Fe  Fe381  1  0.020971  0.548972  0.643635  1
  Fe  Fe382  1  0.402049  0.060429  0.622697  1
  Fe  Fe383  1  0.354272  0.215089  0.643264  1
  Fe  Fe384  1  0.449825  0.406028  0.601993  1
  Fe  Fe385  1  0.735464  0.227162  0.622708  1
  Fe  Fe386  1  0.687878  0.382166  0.643703  1
  Fe  Fe387  1  0.783134  0.572642  0.602010  1
  Fe  Fe388  1  0.069092  0.893682  0.622689  1
  Fe  Fe389  1  0.021254  0.048517  0.643347  1
  Fe  Fe390  1  0.116478  0.239240  0.601848  1
  Fe  Fe391  1  0.354298  0.715633  0.643612  1
  Fe  Fe392  1  0.449821  0.905834  0.601895  1
  Fe  Fe393  1  0.735617  0.727122  0.622749  1
  Fe  Fe394  1  0.687777  0.881841  0.643290  1
  Fe  Fe395  1  0.783196  0.072481  0.601785  1
  Fe  Fe396  1  0.116577  0.739242  0.602008  1
  Fe  Fe397  1  0.211663  0.554462  0.633347  1
  Fe  Fe398  1  0.878317  0.387928  0.633264  1
  Fe  Fe399  1  0.973751  0.578624  0.591591  1
  Fe  Fe400  1  0.211716  0.054343  0.633159  1
  Fe  Fe401  1  0.163435  0.209541  0.653659  1
  Fe  Fe402  1  0.259144  0.400048  0.612400  1
  Fe  Fe403  1  0.545010  0.220889  0.633051  1
  Fe  Fe404  1  0.497293  0.376445  0.653890  1
  Fe  Fe405  1  0.592591  0.566590  0.612453  1
  Fe  Fe406  1  0.878530  0.887581  0.633074  1
  Fe  Fe407  1  0.830596  0.042724  0.653599  1
  Fe  Fe408  1  0.926003  0.233255  0.612317  1
  Fe  Fe409  1  0.307105  0.745179  0.591555  1
  Fe  Fe410  1  0.259440  0.899833  0.612365  1
  Fe  Fe411  1  0.544887  0.721183  0.633234  1
  Fe  Fe412  1  0.640390  0.911771  0.591402  1
  Fe  Fe413  1  0.592533  0.066481  0.612277  1
  Fe  Fe414  1  0.926077  0.733249  0.612413  1
  Fe  Fe415  1  0.354410  0.465482  0.643754  1
  Fe  Fe416  1  0.020955  0.298775  0.643647  1
  Fe  Fe417  1  0.116451  0.489334  0.602068  1
  Fe  Fe418  1  0.354176  0.965630  0.643604  1
  Fe  Fe419  1  0.449864  0.155735  0.601850  1
  Fe  Fe420  1  0.402140  0.310521  0.622666  1
  Fe  Fe421  1  0.687699  0.131766  0.643502  1
  Fe  Fe422  1  0.783219  0.322657  0.601969  1
  Fe  Fe423  1  0.735523  0.477154  0.622826  1
  Fe  Fe424  1  0.021050  0.799071  0.643659  1
  Fe  Fe425  1  0.116655  0.989073  0.601862  1
  Fe  Fe426  1  0.068828  0.143749  0.622707  1
  Fe  Fe427  1  0.449809  0.655891  0.602008  1
  Fe  Fe428  1  0.402235  0.810371  0.622740  1
  Fe  Fe429  1  0.687600  0.632327  0.643581  1
  Fe  Fe430  1  0.783227  0.822410  0.601858  1
  Fe  Fe431  1  0.735556  0.977022  0.622593  1
  Fe  Fe432  1  0.069001  0.643775  0.622812  1
  Fe  Fe433  1  0.163507  0.459669  0.654137  1
  Fe  Fe434  1  0.688878  0.256815  0.715710  1
  Fe  Fe435  1  0.783564  0.447884  0.675881  1
  Fe  Fe436  1  0.163984  0.959501  0.653890  1
  Fe  Fe437  1  0.117335  0.113256  0.675105  1
  Fe  Fe438  1  0.071388  0.270631  0.697066  1
  Fe  Fe439  1  0.496757  0.125867  0.653977  1
  Fe  Fe440  1  0.450214  0.280009  0.674781  1
  Fe  Fe441  1  0.403999  0.437093  0.696873  1
  Fe  Fe442  1  0.830567  0.792971  0.653915  1
  Fe  Fe443  1  0.784540  0.946431  0.674877  1
  Fe  Fe444  1  0.738679  0.103297  0.696947  1
  Fe  Fe445  1  0.117090  0.614367  0.675921  1
  Fe  Fe446  1  0.070662  0.769564  0.696594  1
  Fe  Fe447  1  0.496792  0.626406  0.653939  1
  Fe  Fe448  1  0.450520  0.781078  0.675933  1
  Fe  Fe449  1  0.404534  0.936493  0.696778  1
  Fe  Fe450  1  0.737084  0.602716  0.696609  1
  Fe  Fe451  1  0.261511  0.526191  0.687014  1
  Fe  Fe452  1  0.928071  0.359577  0.686950  1
  Fe  Fe453  1  0.879527  0.512948  0.705610  1
  Fe  Fe454  1  0.261285  0.026737  0.687243  1
  Fe  Fe455  1  0.214291  0.178021  0.706212  1
  Fe  Fe456  1  0.306413  0.370168  0.663996  1
  Fe  Fe457  1  0.593260  0.191412  0.686127  1
  Fe  Fe458  1  0.546111  0.346350  0.706478  1
  Fe  Fe459  1  0.640625  0.536550  0.664657  1
  Fe  Fe460  1  0.928208  0.860261  0.687275  1
  Fe  Fe461  1  0.882027  0.010605  0.706090  1
  Fe  Fe462  1  0.973083  0.203600  0.664101  1
  Fe  Fe463  1  0.213017  0.679652  0.705568  1
  Fe  Fe464  1  0.307760  0.869886  0.664563  1
  Fe  Fe465  1  0.595084  0.693045  0.686883  1
  Fe  Fe466  1  0.546848  0.846242  0.705697  1
  Fe  Fe467  1  0.640154  0.036690  0.663971  1
  Fe  Fe468  1  0.974318  0.703236  0.664555  1
  Fe  Fe469  1  0.070133  0.519455  0.696685  1
  Fe  Fe470  1  0.737370  0.353826  0.696882  1
  Fe  Fe471  1  0.830108  0.543184  0.653943  1
  Fe  Fe472  1  0.071135  0.017612  0.696472  1
  Fe  Fe473  1  0.021552  0.174267  0.715594  1
  Fe  Fe474  1  0.116107  0.364461  0.675605  1
  Fe  Fe475  1  0.403987  0.185224  0.696772  1
  Fe  Fe476  1  0.355912  0.340262  0.715473  1
  Fe  Fe477  1  0.450281  0.531148  0.675892  1
  Fe  Fe478  1  0.737695  0.851270  0.696475  1
  Fe  Fe479  1  0.689915  0.007289  0.715475  1
  Fe  Fe480  1  0.783723  0.196921  0.674836  1
  Fe  Fe481  1  0.163639  0.709788  0.653938  1
  Fe  Fe482  1  0.116997  0.864498  0.675847  1
  Fe  Fe483  1  0.403770  0.686006  0.696610  1
  Fe  Fe484  1  0.496695  0.876168  0.653790  1
  Fe  Fe485  1  0.449448  0.031255  0.675715  1
  Fe  Fe486  1  0.783699  0.697773  0.675849  1
  Fe  Fe487  1  0.210777  0.429543  0.706241  1
  Fe  Fe488  1  0.879182  0.263392  0.706489  1
  Fe  Fe489  1  0.973714  0.453339  0.664641  1
  Fe  Fe490  1  0.214554  0.928671  0.705623  1
  Fe  Fe491  1  0.306740  0.119879  0.664530  1
  Fe  Fe492  1  0.260397  0.274226  0.685877  1
  Fe  Fe493  1  0.545397  0.096189  0.706442  1
  Fe  Fe494  1  0.639614  0.286943  0.664062  1
  Fe  Fe495  1  0.594801  0.442889  0.686955  1
  Fe  Fe496  1  0.880756  0.762245  0.705602  1
  Fe  Fe497  1  0.974021  0.952905  0.664312  1
  Fe  Fe498  1  0.927169  0.107627  0.686152  1
  Fe  Fe499  1  0.307302  0.619850  0.664677  1
  Fe  Fe500  1  0.261857  0.776648  0.686920  1
  Fe  Fe501  1  0.546379  0.596163  0.705600  1
  Fe  Fe502  1  0.640622  0.786354  0.664502  1
  Fe  Fe503  1  0.594314  0.941492  0.685810  1
  Fe  Fe504  1  0.928353  0.609962  0.686924  1
