# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.87012012
_cell_length_b   13.12668660
_cell_length_c   46.27049923
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.80700407
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe
_chemical_formula_sum   Fe432
_cell_volume   10474.5634267
_cell_formula_units_Z   432
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  0.139455  0.411658  0.312064  1
  Fe  Fe2  1  0.639455  0.411658  0.312064  1
  Fe  Fe3  1  0.861205  0.437288  0.286420  1
  Fe  Fe4  1  0.972788  0.078324  0.312064  1
  Fe  Fe5  1  0.000057  0.425071  0.299250  1
  Fe  Fe6  1  0.194538  0.103954  0.286420  1
  Fe  Fe7  1  0.361205  0.437288  0.286420  1
  Fe  Fe8  1  0.472788  0.078324  0.312064  1
  Fe  Fe9  1  0.500057  0.425071  0.299250  1
  Fe  Fe10  1  0.694538  0.103954  0.286420  1
  Fe  Fe11  1  0.806122  0.744991  0.312064  1
  Fe  Fe12  1  0.833390  0.091738  0.299250  1
  Fe  Fe13  1  0.027872  0.770621  0.286420  1
  Fe  Fe14  1  0.166724  0.758404  0.299250  1
  Fe  Fe15  1  0.306122  0.744991  0.312064  1
  Fe  Fe16  1  0.333390  0.091738  0.299250  1
  Fe  Fe17  1  0.527872  0.770621  0.286420  1
  Fe  Fe18  1  0.666724  0.758404  0.299250  1
  Fe  Fe19  1  0.272364  0.614451  0.277639  1
  Fe  Fe20  1  0.772364  0.614451  0.277639  1
  Fe  Fe21  1  0.913293  0.605499  0.289869  1
  Fe  Fe22  1  0.105697  0.281118  0.277639  1
  Fe  Fe23  1  0.051476  0.587704  0.303514  1
  Fe  Fe24  1  0.246626  0.272166  0.289869  1
  Fe  Fe25  1  0.413293  0.605499  0.289869  1
  Fe  Fe26  1  0.605697  0.281118  0.277639  1
  Fe  Fe27  1  0.551476  0.587704  0.303514  1
  Fe  Fe28  1  0.746626  0.272166  0.289869  1
  Fe  Fe29  1  0.939030  0.947784  0.277639  1
  Fe  Fe30  1  0.884809  0.254371  0.303514  1
  Fe  Fe31  1  0.079960  0.938833  0.289869  1
  Fe  Fe32  1  0.218142  0.921037  0.303514  1
  Fe  Fe33  1  0.439030  0.947784  0.277639  1
  Fe  Fe34  1  0.384809  0.254371  0.303514  1
  Fe  Fe35  1  0.579960  0.938833  0.289869  1
  Fe  Fe36  1  0.718142  0.921037  0.303514  1
  Fe  Fe37  1  0.051941  0.372914  0.349128  1
  Fe  Fe38  1  0.551941  0.372914  0.349128  1
  Fe  Fe39  1  0.776839  0.399954  0.325019  1
  Fe  Fe40  1  0.885274  0.039581  0.349128  1
  Fe  Fe41  1  0.914120  0.386863  0.337221  1
  Fe  Fe42  1  0.110172  0.066620  0.325019  1
  Fe  Fe43  1  0.276839  0.399954  0.325019  1
  Fe  Fe44  1  0.385274  0.039581  0.349128  1
  Fe  Fe45  1  0.414120  0.386863  0.337221  1
  Fe  Fe46  1  0.610172  0.066620  0.325019  1
  Fe  Fe47  1  0.718608  0.706248  0.349128  1
  Fe  Fe48  1  0.747453  0.053530  0.337221  1
  Fe  Fe49  1  0.943505  0.733287  0.325019  1
  Fe  Fe50  1  0.080787  0.720197  0.337221  1
  Fe  Fe51  1  0.218608  0.706248  0.349128  1
  Fe  Fe52  1  0.247453  0.053530  0.337221  1
  Fe  Fe53  1  0.443505  0.733287  0.325019  1
  Fe  Fe54  1  0.580787  0.720197  0.337221  1
  Fe  Fe55  1  0.188218  0.574469  0.316012  1
  Fe  Fe56  1  0.688218  0.574469  0.316012  1
  Fe  Fe57  1  0.825444  0.562299  0.328288  1
  Fe  Fe58  1  0.021551  0.241136  0.316012  1
  Fe  Fe59  1  0.961456  0.548683  0.340579  1
  Fe  Fe60  1  0.158777  0.228965  0.328288  1
  Fe  Fe61  1  0.325444  0.562299  0.328288  1
  Fe  Fe62  1  0.521551  0.241136  0.316012  1
  Fe  Fe63  1  0.461456  0.548683  0.340579  1
  Fe  Fe64  1  0.658777  0.228965  0.328288  1
  Fe  Fe65  1  0.854885  0.907803  0.316012  1
  Fe  Fe66  1  0.794789  0.215350  0.340579  1
  Fe  Fe67  1  0.992110  0.895632  0.328288  1
  Fe  Fe68  1  0.128123  0.882016  0.340579  1
  Fe  Fe69  1  0.354885  0.907803  0.316012  1
  Fe  Fe70  1  0.294789  0.215350  0.340579  1
  Fe  Fe71  1  0.492110  0.895632  0.328288  1
  Fe  Fe72  1  0.628123  0.882016  0.340579  1
  Fe  Fe73  1  0.963978  0.333102  0.386225  1
  Fe  Fe74  1  0.463978  0.333102  0.386225  1
  Fe  Fe75  1  0.689346  0.359676  0.361650  1
  Fe  Fe76  1  0.797311  -0.000231  0.386225  1
  Fe  Fe77  1  0.826684  0.346141  0.374007  1
  Fe  Fe78  1  0.022679  0.026343  0.361650  1
  Fe  Fe79  1  0.189346  0.359676  0.361650  1
  Fe  Fe80  1  0.297311  -0.000231  0.386225  1
  Fe  Fe81  1  0.326684  0.346141  0.374007  1
  Fe  Fe82  1  0.522679  0.026343  0.361650  1
  Fe  Fe83  1  0.630645  0.666435  0.386225  1
  Fe  Fe84  1  0.660017  0.012807  0.374007  1
  Fe  Fe85  1  0.856012  0.693009  0.361650  1
  Fe  Fe86  1  0.993351  0.679474  0.374007  1
  Fe  Fe87  1  0.130645  0.666435  0.386225  1
  Fe  Fe88  1  0.160017  0.012807  0.374007  1
  Fe  Fe89  1  0.356012  0.693009  0.361650  1
  Fe  Fe90  1  0.493351  0.679474  0.374007  1
  Fe  Fe91  1  0.098657  0.535153  0.353266  1
  Fe  Fe92  1  0.598657  0.535153  0.353266  1
  Fe  Fe93  1  0.735810  0.522295  0.365681  1
  Fe  Fe94  1  0.931990  0.201820  0.353266  1
  Fe  Fe95  1  0.872657  0.508953  0.377956  1
  Fe  Fe96  1  0.069143  0.188961  0.365681  1
  Fe  Fe97  1  0.235810  0.522295  0.365681  1
  Fe  Fe98  1  0.431990  0.201820  0.353266  1
  Fe  Fe99  1  0.372657  0.508953  0.377956  1
  Fe  Fe100  1  0.569143  0.188961  0.365681  1
  Fe  Fe101  1  0.765323  0.868486  0.353266  1
  Fe  Fe102  1  0.705991  0.175620  0.377956  1
  Fe  Fe103  1  0.902476  0.855628  0.365681  1
  Fe  Fe104  1  0.039324  0.842287  0.377956  1
  Fe  Fe105  1  0.265323  0.868486  0.353266  1
  Fe  Fe106  1  0.205991  0.175620  0.377956  1
  Fe  Fe107  1  0.402476  0.855628  0.365681  1
  Fe  Fe108  1  0.539324  0.842287  0.377956  1
  Fe  Fe109  1  0.875580  0.293119  0.423125  1
  Fe  Fe110  1  0.375580  0.293119  0.423125  1
  Fe  Fe111  1  0.601121  0.320011  0.398504  1
  Fe  Fe112  1  0.708913  0.959785  0.423125  1
  Fe  Fe113  1  0.738363  0.306517  0.410853  1
  Fe  Fe114  1  0.934455  0.986678  0.398504  1
  Fe  Fe115  1  0.101121  0.320011  0.398504  1
  Fe  Fe116  1  0.208913  0.959785  0.423125  1
  Fe  Fe117  1  0.238363  0.306517  0.410853  1
  Fe  Fe118  1  0.434455  0.986678  0.398504  1
  Fe  Fe119  1  0.542246  0.626452  0.423125  1
  Fe  Fe120  1  0.571696  0.973183  0.410853  1
  Fe  Fe121  1  0.767788  0.653345  0.398504  1
  Fe  Fe122  1  0.905029  0.639850  0.410853  1
  Fe  Fe123  1  0.042246  0.626452  0.423125  1
  Fe  Fe124  1  0.071696  0.973183  0.410853  1
  Fe  Fe125  1  0.267788  0.653345  0.398504  1
  Fe  Fe126  1  0.405029  0.639850  0.410853  1
  Fe  Fe127  1  0.009720  0.495350  0.390162  1
  Fe  Fe128  1  0.509720  0.495350  0.390162  1
  Fe  Fe129  1  0.646925  0.482124  0.402597  1
  Fe  Fe130  1  0.843054  0.162016  0.390162  1
  Fe  Fe131  1  0.784081  0.468775  0.414927  1
  Fe  Fe132  1  0.980258  0.148791  0.402597  1
  Fe  Fe133  1  0.146925  0.482124  0.402597  1
  Fe  Fe134  1  0.343054  0.162016  0.390162  1
  Fe  Fe135  1  0.284081  0.468775  0.414927  1
  Fe  Fe136  1  0.480258  0.148791  0.402597  1
  Fe  Fe137  1  0.676387  0.828683  0.390162  1
  Fe  Fe138  1  0.617414  0.135441  0.414927  1
  Fe  Fe139  1  0.813592  0.815458  0.402597  1
  Fe  Fe140  1  0.950747  0.802108  0.414927  1
  Fe  Fe141  1  0.176387  0.828683  0.390162  1
  Fe  Fe142  1  0.117414  0.135441  0.414927  1
  Fe  Fe143  1  0.313592  0.815458  0.402597  1
  Fe  Fe144  1  0.450747  0.802108  0.414927  1
  Fe  Fe145  1  0.787095  0.253239  0.460024  1
  Fe  Fe146  1  0.287095  0.253239  0.460024  1
  Fe  Fe147  1  0.512766  0.279885  0.435410  1
  Fe  Fe148  1  0.620429  0.919906  0.460024  1
  Fe  Fe149  1  0.649916  0.266581  0.447706  1
  Fe  Fe150  1  0.846099  0.946552  0.435410  1
  Fe  Fe151  1  0.012766  0.279885  0.435410  1
  Fe  Fe152  1  0.120429  0.919906  0.460024  1
  Fe  Fe153  1  0.149916  0.266581  0.447706  1
  Fe  Fe154  1  0.346099  0.946552  0.435410  1
  Fe  Fe155  1  0.453762  0.586572  0.460024  1
  Fe  Fe156  1  0.483250  0.933248  0.447706  1
  Fe  Fe157  1  0.679432  0.613218  0.435410  1
  Fe  Fe158  1  0.816583  0.599915  0.447706  1
  Fe  Fe159  1  0.953762  0.586572  0.460024  1
  Fe  Fe160  1  0.983250  0.933248  0.447706  1
  Fe  Fe161  1  0.179432  0.613218  0.435410  1
  Fe  Fe162  1  0.316583  0.599915  0.447706  1
  Fe  Fe163  1  0.921223  0.455411  0.427209  1
  Fe  Fe164  1  0.421223  0.455411  0.427209  1
  Fe  Fe165  1  0.558320  0.442133  0.439504  1
  Fe  Fe166  1  0.754556  0.122078  0.427209  1
  Fe  Fe167  1  0.695496  0.428789  0.451839  1
  Fe  Fe168  1  0.891654  0.108800  0.439504  1
  Fe  Fe169  1  0.058320  0.442133  0.439504  1
  Fe  Fe170  1  0.254556  0.122078  0.427209  1
  Fe  Fe171  1  0.195496  0.428789  0.451839  1
  Fe  Fe172  1  0.391654  0.108800  0.439504  1
  Fe  Fe173  1  0.587889  0.788745  0.427209  1
  Fe  Fe174  1  0.528829  0.095455  0.451839  1
  Fe  Fe175  1  0.724987  0.775466  0.439504  1
  Fe  Fe176  1  0.862163  0.762122  0.451839  1
  Fe  Fe177  1  0.087889  0.788745  0.427209  1
  Fe  Fe178  1  0.028829  0.095455  0.451839  1
  Fe  Fe179  1  0.224987  0.775466  0.439504  1
  Fe  Fe180  1  0.362163  0.762122  0.451839  1
  Fe  Fe181  1  0.698611  0.213262  0.496905  1
  Fe  Fe182  1  0.198611  0.213262  0.496905  1
  Fe  Fe183  1  0.424274  0.239914  0.472310  1
  Fe  Fe184  1  0.531944  0.879929  0.496905  1
  Fe  Fe185  1  0.561447  0.226591  0.484606  1
  Fe  Fe186  1  0.757608  0.906580  0.472310  1
  Fe  Fe187  1  0.924274  0.239914  0.472310  1
  Fe  Fe188  1  0.031944  0.879929  0.496905  1
  Fe  Fe189  1  0.061447  0.226591  0.484606  1
  Fe  Fe190  1  0.257608  0.906580  0.472310  1
  Fe  Fe191  1  0.365277  0.546595  0.496905  1
  Fe  Fe192  1  0.394780  0.893257  0.484606  1
  Fe  Fe193  1  0.590941  0.573247  0.472310  1
  Fe  Fe194  1  0.728113  0.559924  0.484606  1
  Fe  Fe195  1  0.865277  0.546595  0.496905  1
  Fe  Fe196  1  0.894780  0.893257  0.484606  1
  Fe  Fe197  1  0.090941  0.573247  0.472310  1
  Fe  Fe198  1  0.228113  0.559924  0.484606  1
  Fe  Fe199  1  0.832682  0.415432  0.464137  1
  Fe  Fe200  1  0.332682  0.415432  0.464137  1
  Fe  Fe201  1  0.469843  0.402109  0.476438  1
  Fe  Fe202  1  0.666015  0.082099  0.464137  1
  Fe  Fe203  1  0.606996  0.388790  0.488732  1
  Fe  Fe204  1  0.803176  0.068776  0.476438  1
  Fe  Fe205  1  0.969843  0.402109  0.476438  1
  Fe  Fe206  1  0.166015  0.082099  0.464137  1
  Fe  Fe207  1  0.106996  0.388790  0.488732  1
  Fe  Fe208  1  0.303176  0.068776  0.476438  1
  Fe  Fe209  1  0.499348  0.748765  0.464137  1
  Fe  Fe210  1  0.440330  0.055457  0.488732  1
  Fe  Fe211  1  0.636509  0.735442  0.476438  1
  Fe  Fe212  1  0.773663  0.722123  0.488732  1
  Fe  Fe213  1  0.999348  0.748765  0.464137  1
  Fe  Fe214  1  0.940330  0.055457  0.488732  1
  Fe  Fe215  1  0.136509  0.735442  0.476438  1
  Fe  Fe216  1  0.273663  0.722123  0.488732  1
  Fe  Fe217  1  0.610106  0.173289  0.533812  1
  Fe  Fe218  1  0.110106  0.173289  0.533812  1
  Fe  Fe219  1  0.335791  0.199931  0.509217  1
  Fe  Fe220  1  0.443439  0.839956  0.533812  1
  Fe  Fe221  1  0.472945  0.186612  0.521512  1
  Fe  Fe222  1  0.669124  0.866598  0.509217  1
  Fe  Fe223  1  0.835791  0.199931  0.509217  1
  Fe  Fe224  1  0.943439  0.839956  0.533812  1
  Fe  Fe225  1  0.972945  0.186612  0.521512  1
  Fe  Fe226  1  0.169124  0.866598  0.509217  1
  Fe  Fe227  1  0.276772  0.506622  0.533812  1
  Fe  Fe228  1  0.306278  0.853279  0.521512  1
  Fe  Fe229  1  0.502458  0.533264  0.509217  1
  Fe  Fe230  1  0.639611  0.519945  0.521512  1
  Fe  Fe231  1  0.776772  0.506622  0.533812  1
  Fe  Fe232  1  0.806278  0.853279  0.521512  1
  Fe  Fe233  1  0.002458  0.533264  0.509217  1
  Fe  Fe234  1  0.139611  0.519945  0.521512  1
  Fe  Fe235  1  0.744177  0.375459  0.501044  1
  Fe  Fe236  1  0.244177  0.375459  0.501044  1
  Fe  Fe237  1  0.381341  0.362130  0.513343  1
  Fe  Fe238  1  0.577510  0.042126  0.501044  1
  Fe  Fe239  1  0.518513  0.348807  0.525640  1
  Fe  Fe240  1  0.714674  0.028797  0.513343  1
  Fe  Fe241  1  0.881341  0.362130  0.513343  1
  Fe  Fe242  1  0.077510  0.042126  0.501044  1
  Fe  Fe243  1  0.018513  0.348807  0.525640  1
  Fe  Fe244  1  0.214674  0.028797  0.513343  1
  Fe  Fe245  1  0.410843  0.708792  0.501044  1
  Fe  Fe246  1  0.351846  0.015474  0.525640  1
  Fe  Fe247  1  0.548007  0.695464  0.513343  1
  Fe  Fe248  1  0.685180  0.682141  0.525640  1
  Fe  Fe249  1  0.910843  0.708792  0.501044  1
  Fe  Fe250  1  0.851846  0.015474  0.525640  1
  Fe  Fe251  1  0.048007  0.695464  0.513343  1
  Fe  Fe252  1  0.185180  0.682141  0.525640  1
  Fe  Fe253  1  0.521565  0.133310  0.570740  1
  Fe  Fe254  1  0.021565  0.133310  0.570740  1
  Fe  Fe255  1  0.247292  0.159932  0.546111  1
  Fe  Fe256  1  0.354898  0.799976  0.570740  1
  Fe  Fe257  1  0.384467  0.146588  0.558446  1
  Fe  Fe258  1  0.580625  0.826599  0.546111  1
  Fe  Fe259  1  0.747292  0.159932  0.546111  1
  Fe  Fe260  1  0.854898  0.799976  0.570740  1
  Fe  Fe261  1  0.884467  0.146588  0.558446  1
  Fe  Fe262  1  0.080625  0.826599  0.546111  1
  Fe  Fe263  1  0.188231  0.466643  0.570740  1
  Fe  Fe264  1  0.217801  0.813255  0.558446  1
  Fe  Fe265  1  0.413958  0.493266  0.546111  1
  Fe  Fe266  1  0.551134  0.479921  0.558446  1
  Fe  Fe267  1  0.688231  0.466643  0.570740  1
  Fe  Fe268  1  0.717801  0.813255  0.558446  1
  Fe  Fe269  1  0.913958  0.493266  0.546111  1
  Fe  Fe270  1  0.051134  0.479921  0.558446  1
  Fe  Fe271  1  0.655692  0.335482  0.537926  1
  Fe  Fe272  1  0.155692  0.335482  0.537926  1
  Fe  Fe273  1  0.292871  0.322140  0.550243  1
  Fe  Fe274  1  0.489026  0.002149  0.537926  1
  Fe  Fe275  1  0.430022  0.308836  0.562540  1
  Fe  Fe276  1  0.626204  0.988806  0.550243  1
  Fe  Fe277  1  0.792871  0.322140  0.550243  1
  Fe  Fe278  1  0.989026  0.002149  0.537926  1
  Fe  Fe279  1  0.930022  0.308836  0.562540  1
  Fe  Fe280  1  0.126204  0.988806  0.550243  1
  Fe  Fe281  1  0.322359  0.668815  0.537926  1
  Fe  Fe282  1  0.263355  0.975503  0.562540  1
  Fe  Fe283  1  0.459538  0.655473  0.550243  1
  Fe  Fe284  1  0.596689  0.642169  0.562540  1
  Fe  Fe285  1  0.822359  0.668815  0.537926  1
  Fe  Fe286  1  0.763355  0.975503  0.562540  1
  Fe  Fe287  1  0.959538  0.655473  0.550243  1
  Fe  Fe288  1  0.096689  0.642169  0.562540  1
  Fe  Fe289  1  0.433067  0.093371  0.607787  1
  Fe  Fe290  1  0.933067  0.093371  0.607787  1
  Fe  Fe291  1  0.158707  0.119946  0.583022  1
  Fe  Fe292  1  0.266400  0.760038  0.607787  1
  Fe  Fe293  1  0.295862  0.106597  0.595352  1
  Fe  Fe294  1  0.492040  0.786613  0.583022  1
  Fe  Fe295  1  0.658707  0.119946  0.583022  1
  Fe  Fe296  1  0.766400  0.760038  0.607787  1
  Fe  Fe297  1  0.795862  0.106597  0.595352  1
  Fe  Fe298  1  0.992040  0.786613  0.583022  1
  Fe  Fe299  1  0.099734  0.426705  0.607787  1
  Fe  Fe300  1  0.129196  0.773263  0.595352  1
  Fe  Fe301  1  0.325373  0.453280  0.583022  1
  Fe  Fe302  1  0.462529  0.439930  0.595352  1
  Fe  Fe303  1  0.599734  0.426705  0.607787  1
  Fe  Fe304  1  0.629196  0.773263  0.595352  1
  Fe  Fe305  1  0.825373  0.453280  0.583022  1
  Fe  Fe306  1  0.962529  0.439930  0.595352  1
  Fe  Fe307  1  0.567208  0.295602  0.574825  1
  Fe  Fe308  1  0.067208  0.295602  0.574825  1
  Fe  Fe309  1  0.204425  0.282204  0.587097  1
  Fe  Fe310  1  0.400541  0.962269  0.574825  1
  Fe  Fe311  1  0.341666  0.268709  0.599446  1
  Fe  Fe312  1  0.537758  0.948871  0.587097  1
  Fe  Fe313  1  0.704425  0.282204  0.587097  1
  Fe  Fe314  1  0.900541  0.962269  0.574825  1
  Fe  Fe315  1  0.841666  0.268709  0.599446  1
  Fe  Fe316  1  0.037758  0.948871  0.587097  1
  Fe  Fe317  1  0.233874  0.628936  0.574825  1
  Fe  Fe318  1  0.174999  0.935376  0.599446  1
  Fe  Fe319  1  0.371091  0.615538  0.587097  1
  Fe  Fe320  1  0.508333  0.602043  0.599446  1
  Fe  Fe321  1  0.733874  0.628936  0.574825  1
  Fe  Fe322  1  0.674999  0.935376  0.599446  1
  Fe  Fe323  1  0.871091  0.615538  0.587097  1
  Fe  Fe324  1  0.008333  0.602043  0.599446  1
  Fe  Fe325  1  0.344131  0.053568  0.644683  1
  Fe  Fe326  1  0.844131  0.053568  0.644683  1
  Fe  Fe327  1  0.070130  0.079768  0.619994  1
  Fe  Fe328  1  0.177464  0.720235  0.644683  1
  Fe  Fe329  1  0.206978  0.066426  0.632268  1
  Fe  Fe330  1  0.403463  0.746434  0.619994  1
  Fe  Fe331  1  0.570130  0.079768  0.619994  1
  Fe  Fe332  1  0.677464  0.720235  0.644683  1
  Fe  Fe333  1  0.706978  0.066426  0.632268  1
  Fe  Fe334  1  0.903463  0.746434  0.619994  1
  Fe  Fe335  1  0.010797  0.386901  0.644683  1
  Fe  Fe336  1  0.040311  0.733093  0.632268  1
  Fe  Fe337  1  0.236797  0.413101  0.619994  1
  Fe  Fe338  1  0.373645  0.399760  0.632268  1
  Fe  Fe339  1  0.510797  0.386901  0.644683  1
  Fe  Fe340  1  0.540311  0.733093  0.632268  1
  Fe  Fe341  1  0.736797  0.413101  0.619994  1
  Fe  Fe342  1  0.873645  0.399760  0.632268  1
  Fe  Fe343  1  0.478810  0.255619  0.611725  1
  Fe  Fe344  1  0.978810  0.255619  0.611725  1
  Fe  Fe345  1  0.116103  0.242580  0.623942  1
  Fe  Fe346  1  0.312143  0.922286  0.611725  1
  Fe  Fe347  1  0.253442  0.229045  0.636300  1
  Fe  Fe348  1  0.449437  0.909247  0.623942  1
  Fe  Fe349  1  0.616103  0.242580  0.623942  1
  Fe  Fe350  1  0.812143  0.922286  0.611725  1
  Fe  Fe351  1  0.753442  0.229045  0.636300  1
  Fe  Fe352  1  0.949437  0.909247  0.623942  1
  Fe  Fe353  1  0.145476  0.588952  0.611725  1
  Fe  Fe354  1  0.086775  0.895712  0.636300  1
  Fe  Fe355  1  0.282770  0.575914  0.623942  1
  Fe  Fe356  1  0.420108  0.562378  0.636300  1
  Fe  Fe357  1  0.645476  0.588952  0.611725  1
  Fe  Fe358  1  0.586775  0.895712  0.636300  1
  Fe  Fe359  1  0.782770  0.575914  0.623942  1
  Fe  Fe360  1  0.920108  0.562378  0.636300  1
  Fe  Fe361  1  0.254569  0.014252  0.681937  1
  Fe  Fe362  1  0.754569  0.014252  0.681937  1
  Fe  Fe363  1  0.981331  0.040038  0.657370  1
  Fe  Fe364  1  0.087903  0.680918  0.681937  1
  Fe  Fe365  1  0.117344  0.026422  0.669661  1
  Fe  Fe366  1  0.314665  0.706705  0.657370  1
  Fe  Fe367  1  0.481331  0.040038  0.657370  1
  Fe  Fe368  1  0.587903  0.680918  0.681937  1
  Fe  Fe369  1  0.617344  0.026422  0.669661  1
  Fe  Fe370  1  0.814665  0.706705  0.657370  1
  Fe  Fe371  1  0.921236  0.347585  0.681937  1
  Fe  Fe372  1  0.950677  0.693089  0.669661  1
  Fe  Fe373  1  0.147998  0.373371  0.657370  1
  Fe  Fe374  1  0.284010  0.359756  0.669661  1
  Fe  Fe375  1  0.421236  0.347585  0.681937  1
  Fe  Fe376  1  0.450677  0.693089  0.669661  1
  Fe  Fe377  1  0.647998  0.373371  0.657370  1
  Fe  Fe378  1  0.784010  0.359756  0.669661  1
  Fe  Fe379  1  0.390846  0.215807  0.648821  1
  Fe  Fe380  1  0.890846  0.215807  0.648821  1
  Fe  Fe381  1  0.028668  0.201858  0.660728  1
  Fe  Fe382  1  0.224180  0.882473  0.648821  1
  Fe  Fe383  1  0.165949  0.188767  0.672931  1
  Fe  Fe384  1  0.362001  0.868524  0.660728  1
  Fe  Fe385  1  0.528668  0.201858  0.660728  1
  Fe  Fe386  1  0.724180  0.882473  0.648821  1
  Fe  Fe387  1  0.665949  0.188767  0.672931  1
  Fe  Fe388  1  0.862001  0.868524  0.660728  1
  Fe  Fe389  1  0.057513  0.549140  0.648821  1
  Fe  Fe390  1  0.999282  0.855434  0.672931  1
  Fe  Fe391  1  0.195334  0.535191  0.660728  1
  Fe  Fe392  1  0.332616  0.522101  0.672931  1
  Fe  Fe393  1  0.557513  0.549140  0.648821  1
  Fe  Fe394  1  0.499282  0.855434  0.672931  1
  Fe  Fe395  1  0.695334  0.535191  0.660728  1
  Fe  Fe396  1  0.832616  0.522101  0.672931  1
  Fe  Fe397  1  0.170424  0.974270  0.720311  1
  Fe  Fe398  1  0.670424  0.974270  0.720311  1
  Fe  Fe399  1  0.891312  0.001017  0.694435  1
  Fe  Fe400  1  0.003757  0.640937  0.720311  1
  Fe  Fe401  1  0.029494  0.983222  0.708080  1
  Fe  Fe402  1  0.224645  0.667684  0.694435  1
  Fe  Fe403  1  0.391312  0.001017  0.694435  1
  Fe  Fe404  1  0.503757  0.640937  0.720311  1
  Fe  Fe405  1  0.529494  0.983222  0.708080  1
  Fe  Fe406  1  0.724645  0.667684  0.694435  1
  Fe  Fe407  1  0.837090  0.307603  0.720311  1
  Fe  Fe408  1  0.862828  0.649888  0.708080  1
  Fe  Fe409  1  0.057978  0.334350  0.694435  1
  Fe  Fe410  1  0.196161  0.316555  0.708080  1
  Fe  Fe411  1  0.337090  0.307603  0.720311  1
  Fe  Fe412  1  0.362828  0.649888  0.708080  1
  Fe  Fe413  1  0.557978  0.334350  0.694435  1
  Fe  Fe414  1  0.696161  0.316555  0.708080  1
  Fe  Fe415  1  0.303332  0.177063  0.685885  1
  Fe  Fe416  1  0.803332  0.177063  0.685885  1
  Fe  Fe417  1  0.942730  0.163650  0.698700  1
  Fe  Fe418  1  0.136666  0.843730  0.685885  1
  Fe  Fe419  1  0.081582  0.151433  0.711529  1
  Fe  Fe420  1  0.276064  0.830317  0.698700  1
  Fe  Fe421  1  0.442730  0.163650  0.698700  1
  Fe  Fe422  1  0.636666  0.843730  0.685885  1
  Fe  Fe423  1  0.581582  0.151433  0.711529  1
  Fe  Fe424  1  0.776064  0.830317  0.698700  1
  Fe  Fe425  1  0.969999  0.510397  0.685885  1
  Fe  Fe426  1  0.914916  0.818100  0.711529  1
  Fe  Fe427  1  0.109397  0.496983  0.698700  1
  Fe  Fe428  1  0.248249  0.484767  0.711529  1
  Fe  Fe429  1  0.469999  0.510397  0.685885  1
  Fe  Fe430  1  0.414916  0.818100  0.711529  1
  Fe  Fe431  1  0.609397  0.496983  0.698700  1
  Fe  Fe432  1  0.748249  0.484767  0.711529  1
