# generated using pymatgen
data_AlFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.63193937
_cell_length_b   14.63709805
_cell_length_c   48.13316884
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlFe2
_chemical_formula_sum   'Al128 Fe256'
_cell_volume   10100.3621541
_cell_formula_units_Z   128
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
  Al  Al1  1  0.449916  0.450158  0.292137  1
  Al  Al2  1  0.949916  0.950158  0.292137  1
  Al  Al3  1  0.863079  0.363270  0.342986  1
  Al  Al4  1  0.363079  0.863270  0.342986  1
  Al  Al5  1  0.069197  0.069398  0.291862  1
  Al  Al6  1  0.569197  0.569398  0.291862  1
  Al  Al7  1  0.486600  0.986783  0.341780  1
  Al  Al8  1  0.986600  0.486783  0.341780  1
  Al  Al9  1  0.113079  0.113270  0.342986  1
  Al  Al10  1  0.613079  0.613270  0.342986  1
  Al  Al11  1  0.699916  0.200158  0.292137  1
  Al  Al12  1  0.199916  0.700158  0.292137  1
  Al  Al13  1  0.236600  0.236783  0.341780  1
  Al  Al14  1  0.736600  0.736783  0.341780  1
  Al  Al15  1  0.819197  0.319398  0.291862  1
  Al  Al16  1  0.319197  0.819398  0.291862  1
  Al  Al17  1  0.402873  0.153036  0.315976  1
  Al  Al18  1  0.902873  0.653036  0.315976  1
  Al  Al19  1  0.820415  0.070622  0.371247  1
  Al  Al20  1  0.320415  0.570622  0.371247  1
  Al  Al21  1  0.946103  0.196295  0.370618  1
  Al  Al22  1  0.446103  0.696295  0.370618  1
  Al  Al23  1  0.531252  0.281475  0.317948  1
  Al  Al24  1  0.031252  0.781475  0.317948  1
  Al  Al25  1  0.152873  0.403036  0.315976  1
  Al  Al26  1  0.652873  0.903036  0.315976  1
  Al  Al27  1  0.570415  0.320622  0.371247  1
  Al  Al28  1  0.070415  0.820622  0.371247  1
  Al  Al29  1  0.196103  0.946295  0.370618  1
  Al  Al30  1  0.696103  0.446295  0.370618  1
  Al  Al31  1  0.781252  0.031475  0.317948  1
  Al  Al32  1  0.281252  0.531475  0.317948  1
  Al  Al33  1  0.278606  0.278807  0.397829  1
  Al  Al34  1  0.778606  0.778807  0.397829  1
  Al  Al35  1  0.695217  0.195414  0.454018  1
  Al  Al36  1  0.195217  0.695414  0.454018  1
  Al  Al37  1  0.903240  0.903442  0.398459  1
  Al  Al38  1  0.403240  0.403442  0.398459  1
  Al  Al39  1  0.320560  0.820746  0.454049  1
  Al  Al40  1  0.820560  0.320746  0.454049  1
  Al  Al41  1  0.945217  0.945414  0.454018  1
  Al  Al42  1  0.445217  0.445414  0.454018  1
  Al  Al43  1  0.528606  0.028807  0.397829  1
  Al  Al44  1  0.028606  0.528807  0.397829  1
  Al  Al45  1  0.070560  0.070746  0.454049  1
  Al  Al46  1  0.570560  0.570746  0.454049  1
  Al  Al47  1  0.653240  0.153442  0.398459  1
  Al  Al48  1  0.153240  0.653442  0.398459  1
  Al  Al49  1  0.237360  0.987554  0.426125  1
  Al  Al50  1  0.737360  0.487554  0.426125  1
  Al  Al51  1  0.653846  0.904056  0.481708  1
  Al  Al52  1  0.153846  0.404056  0.481708  1
  Al  Al53  1  0.778528  0.028719  0.481772  1
  Al  Al54  1  0.278528  0.528719  0.481772  1
  Al  Al55  1  0.362161  0.112361  0.425900  1
  Al  Al56  1  0.862161  0.612361  0.425900  1
  Al  Al57  1  0.987360  0.237554  0.426125  1
  Al  Al58  1  0.487360  0.737554  0.426125  1
  Al  Al59  1  0.403846  0.154056  0.481708  1
  Al  Al60  1  0.903846  0.654056  0.481708  1
  Al  Al61  1  0.028528  0.778719  0.481772  1
  Al  Al62  1  0.528528  0.278719  0.481772  1
  Al  Al63  1  0.612161  0.862361  0.425900  1
  Al  Al64  1  0.112161  0.362361  0.425900  1
  Al  Al65  1  0.112172  0.112345  0.509519  1
  Al  Al66  1  0.612172  0.612345  0.509519  1
  Al  Al67  1  0.529118  0.029348  0.565506  1
  Al  Al68  1  0.029118  0.529348  0.565506  1
  Al  Al69  1  0.737274  0.737481  0.509522  1
  Al  Al70  1  0.237274  0.237481  0.509522  1
  Al  Al71  1  0.153327  0.653447  0.565515  1
  Al  Al72  1  0.653327  0.153447  0.565515  1
  Al  Al73  1  0.779118  0.779348  0.565506  1
  Al  Al74  1  0.279118  0.279348  0.565506  1
  Al  Al75  1  0.362172  0.862345  0.509519  1
  Al  Al76  1  0.862172  0.362345  0.509519  1
  Al  Al77  1  0.903327  0.903447  0.565515  1
  Al  Al78  1  0.403327  0.403447  0.565515  1
  Al  Al79  1  0.487274  0.987481  0.509522  1
  Al  Al80  1  0.987274  0.487481  0.509522  1
  Al  Al81  1  0.070104  0.820245  0.537437  1
  Al  Al82  1  0.570104  0.320245  0.537437  1
  Al  Al83  1  0.487457  0.737463  0.592291  1
  Al  Al84  1  0.987457  0.237463  0.592291  1
  Al  Al85  1  0.612912  0.863134  0.593144  1
  Al  Al86  1  0.112912  0.363134  0.593144  1
  Al  Al87  1  0.195380  0.945503  0.537291  1
  Al  Al88  1  0.695380  0.445503  0.537291  1
  Al  Al89  1  0.820104  0.070245  0.537437  1
  Al  Al90  1  0.320104  0.570245  0.537437  1
  Al  Al91  1  0.237457  0.987463  0.592291  1
  Al  Al92  1  0.737457  0.487463  0.592291  1
  Al  Al93  1  0.862912  0.613134  0.593144  1
  Al  Al94  1  0.362912  0.113134  0.593144  1
  Al  Al95  1  0.445380  0.695503  0.537291  1
  Al  Al96  1  0.945380  0.195503  0.537291  1
  Al  Al97  1  0.944518  0.944300  0.621445  1
  Al  Al98  1  0.444518  0.444300  0.621445  1
  Al  Al99  1  0.363505  0.861434  0.671869  1
  Al  Al100  1  0.863505  0.361434  0.671869  1
  Al  Al101  1  0.570097  0.569684  0.619700  1
  Al  Al102  1  0.070097  0.069684  0.619700  1
  Al  Al103  1  0.982449  0.484625  0.677268  1
  Al  Al104  1  0.482449  0.984625  0.677268  1
  Al  Al105  1  0.613505  0.611434  0.671869  1
  Al  Al106  1  0.113505  0.111434  0.671869  1
  Al  Al107  1  0.194518  0.694300  0.621445  1
  Al  Al108  1  0.694518  0.194300  0.621445  1
  Al  Al109  1  0.732449  0.734625  0.677268  1
  Al  Al110  1  0.232449  0.234625  0.677268  1
  Al  Al111  1  0.320097  0.819684  0.619700  1
  Al  Al112  1  0.820097  0.319684  0.619700  1
  Al  Al113  1  0.903081  0.653621  0.650116  1
  Al  Al114  1  0.403081  0.153621  0.650116  1
  Al  Al115  1  0.322270  0.572629  0.700613  1
  Al  Al116  1  0.822270  0.072629  0.700613  1
  Al  Al117  1  0.445281  0.690091  0.697234  1
  Al  Al118  1  0.945281  0.190091  0.697234  1
  Al  Al119  1  0.027829  0.777684  0.649437  1
  Al  Al120  1  0.527829  0.277684  0.649437  1
  Al  Al121  1  0.653081  0.903621  0.650116  1
  Al  Al122  1  0.153081  0.403621  0.650116  1
  Al  Al123  1  0.072270  0.822629  0.700613  1
  Al  Al124  1  0.572270  0.322629  0.700613  1
  Al  Al125  1  0.695281  0.440091  0.697234  1
  Al  Al126  1  0.195281  0.940091  0.697234  1
  Al  Al127  1  0.277829  0.527684  0.649437  1
  Al  Al128  1  0.777829  0.027684  0.649437  1
  Fe  Fe129  1  0.345886  0.346135  0.311433  1
  Fe  Fe130  1  0.845886  0.846135  0.311433  1
  Fe  Fe131  1  0.758981  0.259177  0.371135  1
  Fe  Fe132  1  0.258981  0.759177  0.371135  1
  Fe  Fe133  1  0.236990  0.112158  0.383989  1
  Fe  Fe134  1  0.736990  0.612158  0.383989  1
  Fe  Fe135  1  0.822272  0.194973  0.330127  1
  Fe  Fe136  1  0.322272  0.694973  0.330127  1
  Fe  Fe137  1  0.424489  0.424696  0.344741  1
  Fe  Fe138  1  0.924489  0.924696  0.344741  1
  Fe  Fe139  1  0.012434  0.512522  0.286207  1
  Fe  Fe140  1  0.512434  0.012522  0.286207  1
  Fe  Fe141  1  0.361972  0.987179  0.383985  1
  Fe  Fe142  1  0.861972  0.487179  0.383985  1
  Fe  Fe143  1  0.944764  0.072477  0.330130  1
  Fe  Fe144  1  0.444764  0.572477  0.330130  1
  Fe  Fe145  1  0.008981  0.009177  0.371135  1
  Fe  Fe146  1  0.508981  0.509177  0.371135  1
  Fe  Fe147  1  0.595886  0.096135  0.311433  1
  Fe  Fe148  1  0.095886  0.596135  0.311433  1
  Fe  Fe149  1  0.986990  0.362158  0.383989  1
  Fe  Fe150  1  0.486990  0.862158  0.383989  1
  Fe  Fe151  1  0.572272  0.444973  0.330127  1
  Fe  Fe152  1  0.072272  0.944973  0.330127  1
  Fe  Fe153  1  0.262434  0.262522  0.286207  1
  Fe  Fe154  1  0.762434  0.762522  0.286207  1
  Fe  Fe155  1  0.674489  0.174696  0.344741  1
  Fe  Fe156  1  0.174489  0.674696  0.344741  1
  Fe  Fe157  1  0.111972  0.237179  0.383985  1
  Fe  Fe158  1  0.611972  0.737179  0.383985  1
  Fe  Fe159  1  0.694764  0.322477  0.330130  1
  Fe  Fe160  1  0.194764  0.822477  0.330130  1
  Fe  Fe161  1  0.299771  0.049950  0.341790  1
  Fe  Fe162  1  0.799771  0.549950  0.341790  1
  Fe  Fe163  1  0.877255  0.127463  0.284836  1
  Fe  Fe164  1  0.377255  0.627463  0.284836  1
  Fe  Fe165  1  0.277828  0.401490  0.355603  1
  Fe  Fe166  1  0.777828  0.901490  0.355603  1
  Fe  Fe167  1  0.864324  0.486324  0.299575  1
  Fe  Fe168  1  0.364324  0.986324  0.299575  1
  Fe  Fe169  1  0.382489  0.132686  0.370594  1
  Fe  Fe170  1  0.882489  0.632686  0.370594  1
  Fe  Fe171  1  0.965496  0.215675  0.314998  1
  Fe  Fe172  1  0.465496  0.715675  0.314998  1
  Fe  Fe173  1  0.401292  0.278019  0.355595  1
  Fe  Fe174  1  0.901292  0.778019  0.355595  1
  Fe  Fe175  1  0.986113  0.364505  0.299586  1
  Fe  Fe176  1  0.486113  0.864505  0.299586  1
  Fe  Fe177  1  0.049771  0.299950  0.341790  1
  Fe  Fe178  1  0.549771  0.799950  0.341790  1
  Fe  Fe179  1  0.627255  0.377463  0.284836  1
  Fe  Fe180  1  0.127255  0.877463  0.284836  1
  Fe  Fe181  1  0.114324  0.236324  0.299575  1
  Fe  Fe182  1  0.614324  0.736324  0.299575  1
  Fe  Fe183  1  0.527828  0.151490  0.355603  1
  Fe  Fe184  1  0.027828  0.651490  0.355603  1
  Fe  Fe185  1  0.132489  0.382686  0.370594  1
  Fe  Fe186  1  0.632489  0.882686  0.370594  1
  Fe  Fe187  1  0.715496  0.465675  0.314998  1
  Fe  Fe188  1  0.215496  0.965675  0.314998  1
  Fe  Fe189  1  0.236113  0.114505  0.299586  1
  Fe  Fe190  1  0.736113  0.614505  0.299586  1
  Fe  Fe191  1  0.651292  0.028019  0.355595  1
  Fe  Fe192  1  0.151292  0.528019  0.355595  1
  Fe  Fe193  1  0.175304  0.175532  0.425888  1
  Fe  Fe194  1  0.675304  0.675532  0.425888  1
  Fe  Fe195  1  0.591251  0.091531  0.481728  1
  Fe  Fe196  1  0.091251  0.591531  0.481728  1
  Fe  Fe197  1  0.070333  0.945508  0.495712  1
  Fe  Fe198  1  0.570333  0.445508  0.495712  1
  Fe  Fe199  1  0.653452  0.028539  0.439810  1
  Fe  Fe200  1  0.153452  0.528539  0.439810  1
  Fe  Fe201  1  0.257985  0.258183  0.453933  1
  Fe  Fe202  1  0.757985  0.758183  0.453933  1
  Fe  Fe203  1  0.841689  0.341881  0.398719  1
  Fe  Fe204  1  0.341689  0.841881  0.398719  1
  Fe  Fe205  1  0.195335  0.820506  0.495717  1
  Fe  Fe206  1  0.695335  0.320506  0.495717  1
  Fe  Fe207  1  0.778338  0.903642  0.439799  1
  Fe  Fe208  1  0.278338  0.403642  0.439799  1
  Fe  Fe209  1  0.841251  0.841531  0.481728  1
  Fe  Fe210  1  0.341251  0.341531  0.481728  1
  Fe  Fe211  1  0.425304  0.925532  0.425888  1
  Fe  Fe212  1  0.925304  0.425532  0.425888  1
  Fe  Fe213  1  0.820333  0.195508  0.495712  1
  Fe  Fe214  1  0.320333  0.695508  0.495712  1
  Fe  Fe215  1  0.403452  0.278539  0.439810  1
  Fe  Fe216  1  0.903452  0.778539  0.439810  1
  Fe  Fe217  1  0.091689  0.091881  0.398719  1
  Fe  Fe218  1  0.591689  0.591881  0.398719  1
  Fe  Fe219  1  0.507985  0.008183  0.453933  1
  Fe  Fe220  1  0.007985  0.508183  0.453933  1
  Fe  Fe221  1  0.945335  0.070506  0.495717  1
  Fe  Fe222  1  0.445335  0.570506  0.495717  1
  Fe  Fe223  1  0.528338  0.153642  0.439799  1
  Fe  Fe224  1  0.028338  0.653642  0.439799  1
  Fe  Fe225  1  0.132839  0.883016  0.454103  1
  Fe  Fe226  1  0.632839  0.383016  0.454103  1
  Fe  Fe227  1  0.716629  0.966858  0.397729  1
  Fe  Fe228  1  0.216629  0.466858  0.397729  1
  Fe  Fe229  1  0.112136  0.237295  0.467719  1
  Fe  Fe230  1  0.612136  0.737295  0.467719  1
  Fe  Fe231  1  0.695482  0.320754  0.412534  1
  Fe  Fe232  1  0.195482  0.820754  0.412534  1
  Fe  Fe233  1  0.216312  0.966481  0.481783  1
  Fe  Fe234  1  0.716312  0.466481  0.481783  1
  Fe  Fe235  1  0.799382  0.049580  0.426294  1
  Fe  Fe236  1  0.299382  0.549580  0.426294  1
  Fe  Fe237  1  0.237098  0.112312  0.467700  1
  Fe  Fe238  1  0.737098  0.612312  0.467700  1
  Fe  Fe239  1  0.820557  0.195679  0.412536  1
  Fe  Fe240  1  0.320557  0.695679  0.412536  1
  Fe  Fe241  1  0.882839  0.133016  0.454103  1
  Fe  Fe242  1  0.382839  0.633016  0.454103  1
  Fe  Fe243  1  0.466629  0.216858  0.397729  1
  Fe  Fe244  1  0.966629  0.716858  0.397729  1
  Fe  Fe245  1  0.945482  0.070754  0.412534  1
  Fe  Fe246  1  0.445482  0.570754  0.412534  1
  Fe  Fe247  1  0.362136  0.987295  0.467719  1
  Fe  Fe248  1  0.862136  0.487295  0.467719  1
  Fe  Fe249  1  0.966312  0.216481  0.481783  1
  Fe  Fe250  1  0.466312  0.716481  0.481783  1
  Fe  Fe251  1  0.549382  0.299580  0.426294  1
  Fe  Fe252  1  0.049382  0.799580  0.426294  1
  Fe  Fe253  1  0.070557  0.945679  0.412536  1
  Fe  Fe254  1  0.570557  0.445679  0.412536  1
  Fe  Fe255  1  0.487098  0.862312  0.467700  1
  Fe  Fe256  1  0.987098  0.362312  0.467700  1
  Fe  Fe257  1  0.007854  0.007958  0.537366  1
  Fe  Fe258  1  0.507854  0.507958  0.537366  1
  Fe  Fe259  1  0.425641  0.926516  0.592680  1
  Fe  Fe260  1  0.925641  0.426516  0.592680  1
  Fe  Fe261  1  0.903844  0.778789  0.608048  1
  Fe  Fe262  1  0.403844  0.278789  0.608048  1
  Fe  Fe263  1  0.487324  0.862500  0.551134  1
  Fe  Fe264  1  0.987324  0.362500  0.551134  1
  Fe  Fe265  1  0.091443  0.091461  0.565091  1
  Fe  Fe266  1  0.591443  0.591461  0.565091  1
  Fe  Fe267  1  0.674467  0.174636  0.509645  1
  Fe  Fe268  1  0.174467  0.674636  0.509645  1
  Fe  Fe269  1  0.028776  0.653731  0.607829  1
  Fe  Fe270  1  0.528776  0.153731  0.607829  1
  Fe  Fe271  1  0.612293  0.737391  0.551045  1
  Fe  Fe272  1  0.112293  0.237391  0.551045  1
  Fe  Fe273  1  0.675641  0.676516  0.592680  1
  Fe  Fe274  1  0.175641  0.176516  0.592680  1
  Fe  Fe275  1  0.257854  0.757958  0.537366  1
  Fe  Fe276  1  0.757854  0.257958  0.537366  1
  Fe  Fe277  1  0.653844  0.028789  0.608048  1
  Fe  Fe278  1  0.153844  0.528789  0.608048  1
  Fe  Fe279  1  0.237324  0.112500  0.551134  1
  Fe  Fe280  1  0.737324  0.612500  0.551134  1
  Fe  Fe281  1  0.924467  0.924636  0.509645  1
  Fe  Fe282  1  0.424467  0.424636  0.509645  1
  Fe  Fe283  1  0.341443  0.841461  0.565091  1
  Fe  Fe284  1  0.841443  0.341461  0.565091  1
  Fe  Fe285  1  0.778776  0.903731  0.607829  1
  Fe  Fe286  1  0.278776  0.403731  0.607829  1
  Fe  Fe287  1  0.362293  0.987391  0.551045  1
  Fe  Fe288  1  0.862293  0.487391  0.551045  1
  Fe  Fe289  1  0.965456  0.715982  0.565676  1
  Fe  Fe290  1  0.465456  0.215982  0.565676  1
  Fe  Fe291  1  0.549769  0.800115  0.509422  1
  Fe  Fe292  1  0.049769  0.300115  0.509422  1
  Fe  Fe293  1  0.944983  0.069980  0.578962  1
  Fe  Fe294  1  0.444983  0.569980  0.578962  1
  Fe  Fe295  1  0.528813  0.153994  0.523675  1
  Fe  Fe296  1  0.028813  0.653994  0.523675  1
  Fe  Fe297  1  0.048810  0.798818  0.592979  1
  Fe  Fe298  1  0.548810  0.298818  0.592979  1
  Fe  Fe299  1  0.633070  0.883233  0.537377  1
  Fe  Fe300  1  0.133070  0.383233  0.537377  1
  Fe  Fe301  1  0.070000  0.944959  0.578960  1
  Fe  Fe302  1  0.570000  0.444959  0.578960  1
  Fe  Fe303  1  0.653807  0.028950  0.523628  1
  Fe  Fe304  1  0.153807  0.528950  0.523628  1
  Fe  Fe305  1  0.715456  0.965982  0.565676  1
  Fe  Fe306  1  0.215456  0.465982  0.565676  1
  Fe  Fe307  1  0.299769  0.050115  0.509422  1
  Fe  Fe308  1  0.799769  0.550115  0.509422  1
  Fe  Fe309  1  0.778813  0.903994  0.523675  1
  Fe  Fe310  1  0.278813  0.403994  0.523675  1
  Fe  Fe311  1  0.194983  0.819980  0.578962  1
  Fe  Fe312  1  0.694983  0.319980  0.578962  1
  Fe  Fe313  1  0.798810  0.048818  0.592979  1
  Fe  Fe314  1  0.298810  0.548818  0.592979  1
  Fe  Fe315  1  0.383070  0.133233  0.537377  1
  Fe  Fe316  1  0.883070  0.633233  0.537377  1
  Fe  Fe317  1  0.903807  0.778950  0.523628  1
  Fe  Fe318  1  0.403807  0.278950  0.523628  1
  Fe  Fe319  1  0.320000  0.694959  0.578960  1
  Fe  Fe320  1  0.820000  0.194959  0.578960  1
  Fe  Fe321  1  0.841637  0.843222  0.650549  1
  Fe  Fe322  1  0.341637  0.343222  0.650549  1
  Fe  Fe323  1  0.283269  0.778894  0.707608  1
  Fe  Fe324  1  0.783269  0.278894  0.707608  1
  Fe  Fe325  1  0.712236  0.586057  0.719116  1
  Fe  Fe326  1  0.212236  0.086057  0.719116  1
  Fe  Fe327  1  0.318438  0.695575  0.661882  1
  Fe  Fe328  1  0.818438  0.195575  0.661882  1
  Fe  Fe329  1  0.925453  0.926938  0.679695  1
  Fe  Fe330  1  0.425453  0.426938  0.679695  1
  Fe  Fe331  1  0.508889  0.009052  0.621970  1
  Fe  Fe332  1  0.008889  0.509052  0.621970  1
  Fe  Fe333  1  0.848153  0.462586  0.716402  1
  Fe  Fe334  1  0.348153  0.962586  0.716402  1
  Fe  Fe335  1  0.447021  0.567208  0.661658  1
  Fe  Fe336  1  0.947021  0.067208  0.661658  1
  Fe  Fe337  1  0.533269  0.528894  0.707608  1
  Fe  Fe338  1  0.033269  0.028894  0.707608  1
  Fe  Fe339  1  0.091637  0.593222  0.650549  1
  Fe  Fe340  1  0.591637  0.093222  0.650549  1
  Fe  Fe341  1  0.462236  0.836057  0.719116  1
  Fe  Fe342  1  0.962236  0.336057  0.719116  1
  Fe  Fe343  1  0.068438  0.945575  0.661882  1
  Fe  Fe344  1  0.568438  0.445575  0.661882  1
  Fe  Fe345  1  0.758889  0.759052  0.621970  1
  Fe  Fe346  1  0.258889  0.259052  0.621970  1
  Fe  Fe347  1  0.175453  0.676938  0.679695  1
  Fe  Fe348  1  0.675453  0.176938  0.679695  1
  Fe  Fe349  1  0.598153  0.712586  0.716402  1
  Fe  Fe350  1  0.098153  0.212586  0.716402  1
  Fe  Fe351  1  0.197021  0.817208  0.661658  1
  Fe  Fe352  1  0.697021  0.317208  0.661658  1
  Fe  Fe353  1  0.797500  0.550902  0.676275  1
  Fe  Fe354  1  0.297500  0.050902  0.676275  1
  Fe  Fe355  1  0.380884  0.630739  0.620603  1
  Fe  Fe356  1  0.880884  0.130739  0.620603  1
  Fe  Fe357  1  0.773474  0.898157  0.693216  1
  Fe  Fe358  1  0.273474  0.398157  0.693216  1
  Fe  Fe359  1  0.362895  0.988881  0.634221  1
  Fe  Fe360  1  0.862895  0.488881  0.634221  1
  Fe  Fe361  1  0.869917  0.628669  0.707966  1
  Fe  Fe362  1  0.369917  0.128669  0.707966  1
  Fe  Fe363  1  0.466541  0.715551  0.645803  1
  Fe  Fe364  1  0.966541  0.215551  0.645803  1
  Fe  Fe365  1  0.905410  0.773165  0.691744  1
  Fe  Fe366  1  0.405410  0.273165  0.691744  1
  Fe  Fe367  1  0.488721  0.862563  0.633780  1
  Fe  Fe368  1  0.988721  0.362563  0.633780  1
  Fe  Fe369  1  0.547500  0.800902  0.676275  1
  Fe  Fe370  1  0.047500  0.300902  0.676275  1
  Fe  Fe371  1  0.130884  0.880739  0.620603  1
  Fe  Fe372  1  0.630884  0.380739  0.620603  1
  Fe  Fe373  1  0.612895  0.738881  0.634221  1
  Fe  Fe374  1  0.112895  0.238881  0.634221  1
  Fe  Fe375  1  0.023474  0.648157  0.693216  1
  Fe  Fe376  1  0.523474  0.148157  0.693216  1
  Fe  Fe377  1  0.619917  0.878669  0.707966  1
  Fe  Fe378  1  0.119917  0.378669  0.707966  1
  Fe  Fe379  1  0.216541  0.965551  0.645803  1
  Fe  Fe380  1  0.716541  0.465551  0.645803  1
  Fe  Fe381  1  0.738721  0.612563  0.633780  1
  Fe  Fe382  1  0.238721  0.112563  0.633780  1
  Fe  Fe383  1  0.155410  0.523165  0.691744  1
  Fe  Fe384  1  0.655410  0.023165  0.691744  1
