# generated using pymatgen
data_Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.53997593
_cell_length_b   13.50936946
_cell_length_c   47.12871439
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.37780192
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe
_chemical_formula_sum   Fe432
_cell_volume   11367.9569335
_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  0.186200  0.388688  0.310499  1
  Fe  Fe2  1  0.686200  0.388688  0.310499  1
  Fe  Fe3  1  0.914405  0.402894  0.288499  1
  Fe  Fe4  1  0.019533  0.055355  0.310499  1
  Fe  Fe5  1  0.049045  0.396933  0.299335  1
  Fe  Fe6  1  0.247738  0.069561  0.288499  1
  Fe  Fe7  1  0.414405  0.402894  0.288499  1
  Fe  Fe8  1  0.519533  0.055355  0.310499  1
  Fe  Fe9  1  0.549045  0.396933  0.299335  1
  Fe  Fe10  1  0.747738  0.069561  0.288499  1
  Fe  Fe11  1  0.852867  0.722022  0.310499  1
  Fe  Fe12  1  0.882379  0.063600  0.299335  1
  Fe  Fe13  1  0.081072  0.736228  0.288499  1
  Fe  Fe14  1  0.215712  0.730266  0.299335  1
  Fe  Fe15  1  0.352867  0.722022  0.310499  1
  Fe  Fe16  1  0.382379  0.063600  0.299335  1
  Fe  Fe17  1  0.581072  0.736228  0.288499  1
  Fe  Fe18  1  0.715712  0.730266  0.299335  1
  Fe  Fe19  1  0.313935  0.566540  0.293491  1
  Fe  Fe20  1  0.813935  0.566540  0.293491  1
  Fe  Fe21  1  0.951408  0.560070  0.304777  1
  Fe  Fe22  1  0.147268  0.233206  0.293491  1
  Fe  Fe23  1  0.089024  0.553499  0.316106  1
  Fe  Fe24  1  0.284741  0.226736  0.304777  1
  Fe  Fe25  1  0.451408  0.560070  0.304777  1
  Fe  Fe26  1  0.647268  0.233206  0.293491  1
  Fe  Fe27  1  0.589024  0.553499  0.316106  1
  Fe  Fe28  1  0.784741  0.226736  0.304777  1
  Fe  Fe29  1  0.980601  0.899873  0.293491  1
  Fe  Fe30  1  0.922357  0.220166  0.316106  1
  Fe  Fe31  1  0.118074  0.893403  0.304777  1
  Fe  Fe32  1  0.255691  0.886832  0.316106  1
  Fe  Fe33  1  0.480601  0.899873  0.293491  1
  Fe  Fe34  1  0.422357  0.220166  0.316106  1
  Fe  Fe35  1  0.618074  0.893403  0.304777  1
  Fe  Fe36  1  0.755691  0.886832  0.316106  1
  Fe  Fe37  1  0.101964  0.354188  0.346663  1
  Fe  Fe38  1  0.601964  0.354188  0.346663  1
  Fe  Fe39  1  0.821703  0.380548  0.322882  1
  Fe  Fe40  1  0.935297  0.020855  0.346663  1
  Fe  Fe41  1  0.963017  0.368508  0.336325  1
  Fe  Fe42  1  0.155036  0.047215  0.322882  1
  Fe  Fe43  1  0.321703  0.380548  0.322882  1
  Fe  Fe44  1  0.435297  0.020855  0.346663  1
  Fe  Fe45  1  0.463017  0.368508  0.336325  1
  Fe  Fe46  1  0.655036  0.047215  0.322882  1
  Fe  Fe47  1  0.768631  0.687522  0.346663  1
  Fe  Fe48  1  0.796350  0.035175  0.336325  1
  Fe  Fe49  1  0.988370  0.713881  0.322882  1
  Fe  Fe50  1  0.129683  0.701841  0.336325  1
  Fe  Fe51  1  0.268631  0.687522  0.346663  1
  Fe  Fe52  1  0.296350  0.035175  0.336325  1
  Fe  Fe53  1  0.488370  0.713881  0.322882  1
  Fe  Fe54  1  0.629683  0.701841  0.336325  1
  Fe  Fe55  1  0.224272  0.541503  0.328725  1
  Fe  Fe56  1  0.724272  0.541503  0.328725  1
  Fe  Fe57  1  0.865868  0.526744  0.340871  1
  Fe  Fe58  1  0.057606  0.208170  0.328725  1
  Fe  Fe59  1  1.004828  0.515808  0.352453  1
  Fe  Fe60  1  0.199201  0.193411  0.340871  1
  Fe  Fe61  1  0.365868  0.526744  0.340871  1
  Fe  Fe62  1  0.557606  0.208170  0.328725  1
  Fe  Fe63  1  0.504828  0.515808  0.352453  1
  Fe  Fe64  1  0.699201  0.193411  0.340871  1
  Fe  Fe65  1  0.890939  0.874836  0.328725  1
  Fe  Fe66  1  0.838161  0.182474  0.352453  1
  Fe  Fe67  1  0.032534  0.860077  0.340871  1
  Fe  Fe68  1  0.171494  0.849141  0.352453  1
  Fe  Fe69  1  0.390939  0.874836  0.328725  1
  Fe  Fe70  1  0.338161  0.182474  0.352453  1
  Fe  Fe71  1  0.532534  0.860077  0.340871  1
  Fe  Fe72  1  0.671494  0.849141  0.352453  1
  Fe  Fe73  1  0.016948  0.318155  0.382741  1
  Fe  Fe74  1  0.516948  0.318155  0.382741  1
  Fe  Fe75  1  0.738922  0.342312  0.358479  1
  Fe  Fe76  1  0.850281  0.984821  0.382741  1
  Fe  Fe77  1  0.877073  0.330958  0.370409  1
  Fe  Fe78  1  0.072255  0.008979  0.358479  1
  Fe  Fe79  1  0.238922  0.342312  0.358479  1
  Fe  Fe80  1  0.350281  0.984821  0.382741  1
  Fe  Fe81  1  0.377073  0.330958  0.370409  1
  Fe  Fe82  1  0.572255  0.008979  0.358479  1
  Fe  Fe83  1  0.683614  0.651488  0.382741  1
  Fe  Fe84  1  0.710407  0.997625  0.370409  1
  Fe  Fe85  1  0.905589  0.675645  0.358479  1
  Fe  Fe86  1  0.043740  0.664292  0.370409  1
  Fe  Fe87  1  0.183614  0.651488  0.382741  1
  Fe  Fe88  1  0.210407  0.997625  0.370409  1
  Fe  Fe89  1  0.405589  0.675645  0.358479  1
  Fe  Fe90  1  0.543740  0.664292  0.370409  1
  Fe  Fe91  1  0.141348  0.503450  0.364393  1
  Fe  Fe92  1  0.641348  0.503450  0.364393  1
  Fe  Fe93  1  0.779771  0.491226  0.376217  1
  Fe  Fe94  1  0.974681  0.170117  0.364393  1
  Fe  Fe95  1  0.919223  0.479119  0.388449  1
  Fe  Fe96  1  0.113105  0.157893  0.376217  1
  Fe  Fe97  1  0.279771  0.491226  0.376217  1
  Fe  Fe98  1  0.474681  0.170117  0.364393  1
  Fe  Fe99  1  0.419223  0.479119  0.388449  1
  Fe  Fe100  1  0.613105  0.157893  0.376217  1
  Fe  Fe101  1  0.808014  0.836783  0.364393  1
  Fe  Fe102  1  0.752557  0.145786  0.388449  1
  Fe  Fe103  1  0.946438  0.824560  0.376217  1
  Fe  Fe104  1  0.085890  0.812453  0.388449  1
  Fe  Fe105  1  0.308014  0.836783  0.364393  1
  Fe  Fe106  1  0.252557  0.145786  0.388449  1
  Fe  Fe107  1  0.446438  0.824560  0.376217  1
  Fe  Fe108  1  0.585890  0.812453  0.388449  1
  Fe  Fe109  1  0.931163  0.282404  0.418022  1
  Fe  Fe110  1  0.431163  0.282404  0.418022  1
  Fe  Fe111  1  0.654543  0.306083  0.394323  1
  Fe  Fe112  1  0.764496  0.949071  0.418022  1
  Fe  Fe113  1  0.792785  0.294468  0.406153  1
  Fe  Fe114  1  0.987877  0.972750  0.394323  1
  Fe  Fe115  1  0.154543  0.306083  0.394323  1
  Fe  Fe116  1  0.264496  0.949071  0.418022  1
  Fe  Fe117  1  0.292785  0.294468  0.406153  1
  Fe  Fe118  1  0.487877  0.972750  0.394323  1
  Fe  Fe119  1  0.597829  0.615738  0.418022  1
  Fe  Fe120  1  0.626119  0.961135  0.406153  1
  Fe  Fe121  1  0.821210  0.639416  0.394323  1
  Fe  Fe122  1  0.959452  0.627801  0.406153  1
  Fe  Fe123  1  0.097829  0.615738  0.418022  1
  Fe  Fe124  1  0.126119  0.961135  0.406153  1
  Fe  Fe125  1  0.321210  0.639416  0.394323  1
  Fe  Fe126  1  0.459452  0.627801  0.406153  1
  Fe  Fe127  1  0.057143  0.467138  0.400286  1
  Fe  Fe128  1  0.557143  0.467138  0.400286  1
  Fe  Fe129  1  0.695234  0.454962  0.412069  1
  Fe  Fe130  1  0.890477  0.133805  0.400286  1
  Fe  Fe131  1  0.833727  0.442904  0.423932  1
  Fe  Fe132  1  0.028567  0.121628  0.412069  1
  Fe  Fe133  1  0.195234  0.454962  0.412069  1
  Fe  Fe134  1  0.390477  0.133805  0.400286  1
  Fe  Fe135  1  0.333727  0.442904  0.423932  1
  Fe  Fe136  1  0.528567  0.121628  0.412069  1
  Fe  Fe137  1  0.723810  0.800471  0.400286  1
  Fe  Fe138  1  0.667060  0.109571  0.423932  1
  Fe  Fe139  1  0.861900  0.788295  0.412069  1
  Fe  Fe140  1  1.000393  0.776238  0.423932  1
  Fe  Fe141  1  0.223810  0.800471  0.400286  1
  Fe  Fe142  1  0.167060  0.109571  0.423932  1
  Fe  Fe143  1  0.361900  0.788295  0.412069  1
  Fe  Fe144  1  0.500393  0.776238  0.423932  1
  Fe  Fe145  1  0.846387  0.246011  0.453768  1
  Fe  Fe146  1  0.346387  0.246011  0.453768  1
  Fe  Fe147  1  0.569844  0.269892  0.430119  1
  Fe  Fe148  1  0.679720  0.912678  0.453768  1
  Fe  Fe149  1  0.708076  0.257979  0.441902  1
  Fe  Fe150  1  0.903178  0.936559  0.430119  1
  Fe  Fe151  1  0.069844  0.269892  0.430119  1
  Fe  Fe152  1  0.179720  0.912678  0.453768  1
  Fe  Fe153  1  0.208076  0.257979  0.441902  1
  Fe  Fe154  1  0.403178  0.936559  0.430119  1
  Fe  Fe155  1  0.513054  0.579344  0.453768  1
  Fe  Fe156  1  0.541409  0.924645  0.441902  1
  Fe  Fe157  1  0.736511  0.603226  0.430119  1
  Fe  Fe158  1  0.874742  0.591312  0.441902  1
  Fe  Fe159  1  0.013054  0.579344  0.453768  1
  Fe  Fe160  1  0.041409  0.924645  0.441902  1
  Fe  Fe161  1  0.236511  0.603226  0.430119  1
  Fe  Fe162  1  0.374742  0.591312  0.441902  1
  Fe  Fe163  1  0.972326  0.430668  0.436018  1
  Fe  Fe164  1  0.472326  0.430668  0.436018  1
  Fe  Fe165  1  0.610582  0.418647  0.447858  1
  Fe  Fe166  1  0.805660  0.097335  0.436018  1
  Fe  Fe167  1  0.748895  0.406614  0.459704  1
  Fe  Fe168  1  0.943915  0.085314  0.447858  1
  Fe  Fe169  1  0.110582  0.418647  0.447858  1
  Fe  Fe170  1  0.305660  0.097335  0.436018  1
  Fe  Fe171  1  0.248895  0.406614  0.459704  1
  Fe  Fe172  1  0.443915  0.085314  0.447858  1
  Fe  Fe173  1  0.638993  0.764002  0.436018  1
  Fe  Fe174  1  0.582228  0.073281  0.459704  1
  Fe  Fe175  1  0.777248  0.751980  0.447858  1
  Fe  Fe176  1  0.915562  0.739948  0.459704  1
  Fe  Fe177  1  0.138993  0.764002  0.436018  1
  Fe  Fe178  1  0.082228  0.073281  0.459704  1
  Fe  Fe179  1  0.277248  0.751980  0.447858  1
  Fe  Fe180  1  0.415562  0.739948  0.459704  1
  Fe  Fe181  1  0.761567  0.209626  0.489498  1
  Fe  Fe182  1  0.261567  0.209626  0.489498  1
  Fe  Fe183  1  0.484667  0.233895  0.465658  1
  Fe  Fe184  1  0.594901  0.876293  0.489498  1
  Fe  Fe185  1  0.623258  0.221689  0.477636  1
  Fe  Fe186  1  0.818000  0.900561  0.465658  1
  Fe  Fe187  1  0.984667  0.233895  0.465658  1
  Fe  Fe188  1  0.094901  0.876293  0.489498  1
  Fe  Fe189  1  0.123258  0.221689  0.477636  1
  Fe  Fe190  1  0.318000  0.900561  0.465658  1
  Fe  Fe191  1  0.428234  0.542959  0.489498  1
  Fe  Fe192  1  0.456591  0.888355  0.477636  1
  Fe  Fe193  1  0.651334  0.567228  0.465658  1
  Fe  Fe194  1  0.789924  0.555022  0.477636  1
  Fe  Fe195  1  0.928234  0.542959  0.489498  1
  Fe  Fe196  1  0.956591  0.888355  0.477636  1
  Fe  Fe197  1  0.151334  0.567228  0.465658  1
  Fe  Fe198  1  0.289924  0.555022  0.477636  1
  Fe  Fe199  1  0.887214  0.394513  0.471594  1
  Fe  Fe200  1  0.387214  0.394513  0.471594  1
  Fe  Fe201  1  0.525745  0.382304  0.483577  1
  Fe  Fe202  1  0.720548  0.061180  0.471594  1
  Fe  Fe203  1  0.664093  0.370275  0.495443  1
  Fe  Fe204  1  0.859078  0.048971  0.483577  1
  Fe  Fe205  1  0.025745  0.382304  0.483577  1
  Fe  Fe206  1  0.220548  0.061180  0.471594  1
  Fe  Fe207  1  0.164093  0.370275  0.495443  1
  Fe  Fe208  1  0.359078  0.048971  0.483577  1
  Fe  Fe209  1  0.553881  0.727846  0.471594  1
  Fe  Fe210  1  0.497426  0.036941  0.495443  1
  Fe  Fe211  1  0.692411  0.715637  0.483577  1
  Fe  Fe212  1  0.830759  0.703608  0.495443  1
  Fe  Fe213  1  0.053881  0.727846  0.471594  1
  Fe  Fe214  1  0.997426  0.036941  0.495443  1
  Fe  Fe215  1  0.192411  0.715637  0.483577  1
  Fe  Fe216  1  0.330759  0.703608  0.495443  1
  Fe  Fe217  1  0.676728  0.173335  0.525227  1
  Fe  Fe218  1  0.176728  0.173335  0.525227  1
  Fe  Fe219  1  0.399850  0.197574  0.501378  1
  Fe  Fe220  1  0.510061  0.840002  0.525227  1
  Fe  Fe221  1  0.538198  0.185544  0.513244  1
  Fe  Fe222  1  0.733183  0.864240  0.501378  1
  Fe  Fe223  1  0.899850  0.197574  0.501378  1
  Fe  Fe224  1  0.010061  0.840002  0.525227  1
  Fe  Fe225  1  0.038198  0.185544  0.513244  1
  Fe  Fe226  1  0.233183  0.864240  0.501378  1
  Fe  Fe227  1  0.343395  0.506668  0.525227  1
  Fe  Fe228  1  0.371531  0.852211  0.513244  1
  Fe  Fe229  1  0.566516  0.530907  0.501378  1
  Fe  Fe230  1  0.704864  0.518878  0.513244  1
  Fe  Fe231  1  0.843395  0.506668  0.525227  1
  Fe  Fe232  1  0.871531  0.852211  0.513244  1
  Fe  Fe233  1  0.066516  0.530907  0.501378  1
  Fe  Fe234  1  0.204864  0.518878  0.513244  1
  Fe  Fe235  1  0.802375  0.358222  0.507323  1
  Fe  Fe236  1  0.302375  0.358222  0.507323  1
  Fe  Fe237  1  0.440684  0.346159  0.519185  1
  Fe  Fe238  1  0.635708  0.024889  0.507323  1
  Fe  Fe239  1  0.579275  0.333954  0.531163  1
  Fe  Fe240  1  0.774018  0.012826  0.519185  1
  Fe  Fe241  1  0.940684  0.346159  0.519185  1
  Fe  Fe242  1  0.135708  0.024889  0.507323  1
  Fe  Fe243  1  0.079275  0.333954  0.531163  1
  Fe  Fe244  1  0.274018  0.012826  0.519185  1
  Fe  Fe245  1  0.469042  0.691555  0.507323  1
  Fe  Fe246  1  0.412609  0.000620  0.531163  1
  Fe  Fe247  1  0.607351  0.679493  0.519185  1
  Fe  Fe248  1  0.745942  0.667287  0.531163  1
  Fe  Fe249  1  0.969042  0.691555  0.507323  1
  Fe  Fe250  1  0.912609  0.000620  0.531163  1
  Fe  Fe251  1  0.107351  0.679493  0.519185  1
  Fe  Fe252  1  0.245942  0.667287  0.531163  1
  Fe  Fe253  1  0.591616  0.137180  0.560803  1
  Fe  Fe254  1  0.091616  0.137180  0.560803  1
  Fe  Fe255  1  0.315047  0.161234  0.537117  1
  Fe  Fe256  1  0.424949  0.803847  0.560803  1
  Fe  Fe257  1  0.453361  0.149201  0.548963  1
  Fe  Fe258  1  0.648381  0.827901  0.537117  1
  Fe  Fe259  1  0.815047  0.161234  0.537117  1
  Fe  Fe260  1  0.924949  0.803847  0.560803  1
  Fe  Fe261  1  0.953361  0.149201  0.548963  1
  Fe  Fe262  1  0.148381  0.827901  0.537117  1
  Fe  Fe263  1  0.258283  0.470513  0.560803  1
  Fe  Fe264  1  0.286694  0.815868  0.548963  1
  Fe  Fe265  1  0.481714  0.494567  0.537117  1
  Fe  Fe266  1  0.620027  0.482535  0.548963  1
  Fe  Fe267  1  0.758283  0.470513  0.560803  1
  Fe  Fe268  1  0.786694  0.815868  0.548963  1
  Fe  Fe269  1  0.981714  0.494567  0.537117  1
  Fe  Fe270  1  0.120027  0.482535  0.548963  1
  Fe  Fe271  1  0.717555  0.321837  0.543053  1
  Fe  Fe272  1  0.217555  0.321837  0.543053  1
  Fe  Fe273  1  0.355867  0.309870  0.554919  1
  Fe  Fe274  1  0.550889  0.988504  0.543053  1
  Fe  Fe275  1  0.494098  0.297956  0.566702  1
  Fe  Fe276  1  0.689200  0.976536  0.554919  1
  Fe  Fe277  1  0.855867  0.309870  0.554919  1
  Fe  Fe278  1  0.050889  0.988504  0.543053  1
  Fe  Fe279  1  0.994098  0.297956  0.566702  1
  Fe  Fe280  1  0.189200  0.976536  0.554919  1
  Fe  Fe281  1  0.384222  0.655170  0.543053  1
  Fe  Fe282  1  0.327431  0.964622  0.566702  1
  Fe  Fe283  1  0.522533  0.643203  0.554919  1
  Fe  Fe284  1  0.660765  0.631289  0.566702  1
  Fe  Fe285  1  0.884222  0.655170  0.543053  1
  Fe  Fe286  1  0.827431  0.964622  0.566702  1
  Fe  Fe287  1  0.022533  0.643203  0.554919  1
  Fe  Fe288  1  0.160765  0.631289  0.566702  1
  Fe  Fe289  1  0.506799  0.100710  0.596535  1
  Fe  Fe290  1  1.006799  0.100710  0.596535  1
  Fe  Fe291  1  0.230215  0.124944  0.572889  1
  Fe  Fe292  1  0.340132  0.767377  0.596535  1
  Fe  Fe293  1  0.368709  0.112886  0.584752  1
  Fe  Fe294  1  0.563549  0.791610  0.572889  1
  Fe  Fe295  1  0.730215  0.124944  0.572889  1
  Fe  Fe296  1  0.840132  0.767377  0.596535  1
  Fe  Fe297  1  0.868709  0.112886  0.584752  1
  Fe  Fe298  1  0.063549  0.791610  0.572889  1
  Fe  Fe299  1  0.173466  0.434043  0.596535  1
  Fe  Fe300  1  0.202042  0.779553  0.584752  1
  Fe  Fe301  1  0.396882  0.458277  0.572889  1
  Fe  Fe302  1  0.535375  0.446220  0.584752  1
  Fe  Fe303  1  0.673466  0.434043  0.596535  1
  Fe  Fe304  1  0.702042  0.779553  0.584752  1
  Fe  Fe305  1  0.896882  0.458277  0.572889  1
  Fe  Fe306  1  0.035375  0.446220  0.584752  1
  Fe  Fe307  1  0.632780  0.285444  0.578799  1
  Fe  Fe308  1  0.132780  0.285444  0.578799  1
  Fe  Fe309  1  0.271157  0.273380  0.590669  1
  Fe  Fe310  1  0.466113  0.952111  0.578799  1
  Fe  Fe311  1  0.409399  0.261765  0.602498  1
  Fe  Fe312  1  0.604490  0.940047  0.590669  1
  Fe  Fe313  1  0.771157  0.273380  0.590669  1
  Fe  Fe314  1  0.966113  0.952111  0.578799  1
  Fe  Fe315  1  0.909399  0.261765  0.602498  1
  Fe  Fe316  1  0.104490  0.940047  0.590669  1
  Fe  Fe317  1  0.299446  0.618777  0.578799  1
  Fe  Fe318  1  0.242732  0.928432  0.602498  1
  Fe  Fe319  1  0.437824  0.606713  0.590669  1
  Fe  Fe320  1  0.576066  0.595099  0.602498  1
  Fe  Fe321  1  0.799446  0.618777  0.578799  1
  Fe  Fe322  1  0.742732  0.928432  0.602498  1
  Fe  Fe323  1  0.937824  0.606713  0.590669  1
  Fe  Fe324  1  0.076066  0.595099  0.602498  1
  Fe  Fe325  1  0.422594  0.064398  0.632428  1
  Fe  Fe326  1  0.922594  0.064398  0.632428  1
  Fe  Fe327  1  0.144719  0.088729  0.608372  1
  Fe  Fe328  1  0.255928  0.731065  0.632428  1
  Fe  Fe329  1  0.284171  0.076622  0.620604  1
  Fe  Fe330  1  0.478052  0.755395  0.608372  1
  Fe  Fe331  1  0.644719  0.088729  0.608372  1
  Fe  Fe332  1  0.755928  0.731065  0.632428  1
  Fe  Fe333  1  0.784171  0.076622  0.620604  1
  Fe  Fe334  1  0.978052  0.755395  0.608372  1
  Fe  Fe335  1  0.089261  0.397731  0.632428  1
  Fe  Fe336  1  0.117504  0.743289  0.620604  1
  Fe  Fe337  1  0.311386  0.422062  0.608372  1
  Fe  Fe338  1  0.450838  0.409955  0.620604  1
  Fe  Fe339  1  0.589261  0.397731  0.632428  1
  Fe  Fe340  1  0.617504  0.743289  0.620604  1
  Fe  Fe341  1  0.811386  0.422062  0.608372  1
  Fe  Fe342  1  0.950838  0.409955  0.620604  1
  Fe  Fe343  1  0.546995  0.249694  0.614080  1
  Fe  Fe344  1  0.046995  0.249694  0.614080  1
  Fe  Fe345  1  0.186869  0.236890  0.626412  1
  Fe  Fe346  1  0.380328  0.916360  0.614080  1
  Fe  Fe347  1  0.325020  0.225536  0.638342  1
  Fe  Fe348  1  0.520202  0.903556  0.626412  1
  Fe  Fe349  1  0.686869  0.236890  0.626412  1
  Fe  Fe350  1  0.880328  0.916360  0.614080  1
  Fe  Fe351  1  0.825020  0.225536  0.638342  1
  Fe  Fe352  1  0.020202  0.903556  0.626412  1
  Fe  Fe353  1  0.213661  0.583027  0.614080  1
  Fe  Fe354  1  0.158354  0.892203  0.638342  1
  Fe  Fe355  1  0.353536  0.570223  0.626412  1
  Fe  Fe356  1  0.491687  0.558870  0.638342  1
  Fe  Fe357  1  0.713661  0.583027  0.614080  1
  Fe  Fe358  1  0.658354  0.892203  0.638342  1
  Fe  Fe359  1  0.853536  0.570223  0.626412  1
  Fe  Fe360  1  0.991687  0.558870  0.638342  1
  Fe  Fe361  1  0.339670  0.026345  0.668096  1
  Fe  Fe362  1  0.839670  0.026345  0.668096  1
  Fe  Fe363  1  0.059115  0.052041  0.644368  1
  Fe  Fe364  1  0.173003  0.693012  0.668096  1
  Fe  Fe365  1  0.198074  0.041104  0.655950  1
  Fe  Fe366  1  0.392448  0.718707  0.644368  1
  Fe  Fe367  1  0.559115  0.052041  0.644368  1
  Fe  Fe368  1  0.673003  0.693012  0.668096  1
  Fe  Fe369  1  0.698074  0.041104  0.655950  1
  Fe  Fe370  1  0.892448  0.718707  0.644368  1
  Fe  Fe371  1  1.006337  0.359678  0.668096  1
  Fe  Fe372  1  0.031408  0.707771  0.655950  1
  Fe  Fe373  1  0.225781  0.385374  0.644368  1
  Fe  Fe374  1  0.364741  0.374438  0.655950  1
  Fe  Fe375  1  0.506337  0.359678  0.668096  1
  Fe  Fe376  1  0.531408  0.707771  0.655950  1
  Fe  Fe377  1  0.725781  0.385374  0.644368  1
  Fe  Fe378  1  0.864741  0.374438  0.655950  1
  Fe  Fe379  1  0.461978  0.213660  0.650158  1
  Fe  Fe380  1  0.961978  0.213660  0.650158  1
  Fe  Fe381  1  0.100926  0.199340  0.660496  1
  Fe  Fe382  1  0.295312  0.880326  0.650158  1
  Fe  Fe383  1  0.242239  0.187300  0.673939  1
  Fe  Fe384  1  0.434259  0.866007  0.660496  1
  Fe  Fe385  1  0.600926  0.199340  0.660496  1
  Fe  Fe386  1  0.795312  0.880326  0.650158  1
  Fe  Fe387  1  0.742239  0.187300  0.673939  1
  Fe  Fe388  1  0.934259  0.866007  0.660496  1
  Fe  Fe389  1  0.128645  0.546993  0.650158  1
  Fe  Fe390  1  0.075573  0.853967  0.673939  1
  Fe  Fe391  1  0.267592  0.532673  0.660496  1
  Fe  Fe392  1  0.408906  0.520634  0.673939  1
  Fe  Fe393  1  0.628645  0.546993  0.650158  1
  Fe  Fe394  1  0.575573  0.853967  0.673939  1
  Fe  Fe395  1  0.767592  0.532673  0.660496  1
  Fe  Fe396  1  0.908906  0.520634  0.673939  1
  Fe  Fe397  1  0.250008  0.001308  0.703330  1
  Fe  Fe398  1  0.750008  0.001308  0.703330  1
  Fe  Fe399  1  0.974918  0.014349  0.680715  1
  Fe  Fe400  1  0.083341  0.667975  0.703330  1
  Fe  Fe401  1  0.112535  0.007779  0.692044  1
  Fe  Fe402  1  0.308252  0.681016  0.680715  1
  Fe  Fe403  1  0.474918  0.014349  0.680715  1
  Fe  Fe404  1  0.583341  0.667975  0.703330  1
  Fe  Fe405  1  0.612535  0.007779  0.692044  1
  Fe  Fe406  1  0.808252  0.681016  0.680715  1
  Fe  Fe407  1  0.916674  0.334642  0.703330  1
  Fe  Fe408  1  0.945868  0.674445  0.692044  1
  Fe  Fe409  1  0.141585  0.347683  0.680715  1
  Fe  Fe410  1  0.279201  0.341112  0.692044  1
  Fe  Fe411  1  0.416674  0.334642  0.703330  1
  Fe  Fe412  1  0.445868  0.674445  0.692044  1
  Fe  Fe413  1  0.641585  0.347683  0.680715  1
  Fe  Fe414  1  0.779201  0.341112  0.692044  1
  Fe  Fe415  1  0.377742  0.179160  0.686322  1
  Fe  Fe416  1  0.877742  0.179160  0.686322  1
  Fe  Fe417  1  0.014897  0.170915  0.697486  1
  Fe  Fe418  1  0.211076  0.845827  0.686322  1
  Fe  Fe419  1  0.149537  0.164954  0.708322  1
  Fe  Fe420  1  0.348230  0.837582  0.697486  1
  Fe  Fe421  1  0.514897  0.170915  0.697486  1
  Fe  Fe422  1  0.711076  0.845827  0.686322  1
  Fe  Fe423  1  0.649537  0.164954  0.708322  1
  Fe  Fe424  1  0.848230  0.837582  0.697486  1
  Fe  Fe425  1  0.044409  0.512493  0.686322  1
  Fe  Fe426  1  0.982870  0.831620  0.708322  1
  Fe  Fe427  1  0.181563  0.504249  0.697486  1
  Fe  Fe428  1  0.316204  0.498287  0.708322  1
  Fe  Fe429  1  0.544409  0.512493  0.686322  1
  Fe  Fe430  1  0.482870  0.831620  0.708322  1
  Fe  Fe431  1  0.681563  0.504249  0.697486  1
  Fe  Fe432  1  0.816204  0.498287  0.708322  1
