# generated using pymatgen
data_Al6Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.89007766
_cell_length_b   10.78166310
_cell_length_c   46.97926467
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.14497077
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al6Fe
_chemical_formula_sum   'Al120 Fe20'
_cell_volume   4649.431852
_cell_formula_units_Z   20
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  0.766649  0.231001  0.303271  1
  Al  Al2  1  0.963190  0.634771  0.291663  1
  Al  Al3  1  0.619105  0.624060  0.343542  1
  Al  Al4  1  0.827712  0.734552  0.338828  1
  Al  Al5  1  0.508098  0.896017  0.340606  1
  Al  Al6  1  0.152041  0.769229  0.293656  1
  Al  Al7  1  0.756397  0.187936  0.359194  1
  Al  Al8  1  0.771181  0.495379  0.295484  1
  Al  Al9  1  0.040707  0.416938  0.329493  1
  Al  Al10  1  0.759077  0.972216  0.307858  1
  Al  Al11  1  0.007388  0.258630  0.284710  1
  Al  Al12  1  0.023640  0.151479  0.335872  1
  Al  Al13  1  0.266649  0.231001  0.303271  1
  Al  Al14  1  0.463190  0.634771  0.291663  1
  Al  Al15  1  0.119105  0.624060  0.343542  1
  Al  Al16  1  0.327712  0.734552  0.338828  1
  Al  Al17  1  0.008098  0.896017  0.340606  1
  Al  Al18  1  0.652041  0.769229  0.293656  1
  Al  Al19  1  0.256397  0.187936  0.359194  1
  Al  Al20  1  0.271181  0.495379  0.295484  1
  Al  Al21  1  0.540707  0.416938  0.329493  1
  Al  Al22  1  0.259077  0.972216  0.307858  1
  Al  Al23  1  0.507388  0.258630  0.284710  1
  Al  Al24  1  0.523640  0.151479  0.335872  1
  Al  Al25  1  0.460793  1.003030  0.392799  1
  Al  Al26  1  0.658779  0.425984  0.385588  1
  Al  Al27  1  0.300110  0.389439  0.437579  1
  Al  Al28  1  0.504572  0.503224  0.430850  1
  Al  Al29  1  0.192945  0.657567  0.430854  1
  Al  Al30  1  0.864809  0.536272  0.378514  1
  Al  Al31  1  0.441679  0.956336  0.450069  1
  Al  Al32  1  0.472106  0.270147  0.386763  1
  Al  Al33  1  0.729438  0.182503  0.420605  1
  Al  Al34  1  0.438709  0.741419  0.396264  1
  Al  Al35  1  0.728348  0.965909  0.367658  1
  Al  Al36  1  0.708233  0.919396  0.425017  1
  Al  Al37  1  0.960793  1.003030  0.392799  1
  Al  Al38  1  0.158779  0.425984  0.385588  1
  Al  Al39  1  0.800110  0.389439  0.437579  1
  Al  Al40  1  0.004572  0.503224  0.430850  1
  Al  Al41  1  0.692945  0.657567  0.430854  1
  Al  Al42  1  0.364809  0.536272  0.378514  1
  Al  Al43  1  0.941679  0.956336  0.450069  1
  Al  Al44  1  0.972106  0.270147  0.386763  1
  Al  Al45  1  0.229438  0.182503  0.420605  1
  Al  Al46  1  0.938709  0.741419  0.396264  1
  Al  Al47  1  0.228348  0.965909  0.367658  1
  Al  Al48  1  0.208233  0.919396  0.425017  1
  Al  Al49  1  0.144181  0.772421  0.483742  1
  Al  Al50  1  0.345348  0.190064  0.477647  1
  Al  Al51  1  0.986113  0.157365  0.529230  1
  Al  Al52  1  0.190412  0.271603  0.522627  1
  Al  Al53  1  0.877198  0.425970  0.522562  1
  Al  Al54  1  0.549647  0.304302  0.471043  1
  Al  Al55  1  0.125513  0.725583  0.541444  1
  Al  Al56  1  0.158563  0.035697  0.477712  1
  Al  Al57  1  0.414461  0.950487  0.512157  1
  Al  Al58  1  0.121299  0.511180  0.488117  1
  Al  Al59  1  0.410247  0.736084  0.458830  1
  Al  Al60  1  0.391580  0.689246  0.516531  1
  Al  Al61  1  0.644181  0.772421  0.483742  1
  Al  Al62  1  0.845348  0.190064  0.477647  1
  Al  Al63  1  0.486113  0.157365  0.529230  1
  Al  Al64  1  0.690412  0.271603  0.522627  1
  Al  Al65  1  0.377198  0.425970  0.522562  1
  Al  Al66  1  0.049647  0.304302  0.471043  1
  Al  Al67  1  0.625513  0.725583  0.541444  1
  Al  Al68  1  0.658563  0.035697  0.477712  1
  Al  Al69  1  0.914461  0.950487  0.512157  1
  Al  Al70  1  0.621299  0.511180  0.488117  1
  Al  Al71  1  0.910247  0.736084  0.458830  1
  Al  Al72  1  0.891580  0.689246  0.516531  1
  Al  Al73  1  0.827528  0.542271  0.575256  1
  Al  Al74  1  0.031188  0.958443  0.569423  1
  Al  Al75  1  0.670952  0.925395  0.621760  1
  Al  Al76  1  0.876981  0.035683  0.614686  1
  Al  Al77  1  0.563655  0.191520  0.613511  1
  Al  Al78  1  0.235650  0.072228  0.562694  1
  Al  Al79  1  0.807413  0.495758  0.632616  1
  Al  Al80  1  0.842816  0.804100  0.569420  1
  Al  Al81  1  0.097052  0.720248  0.604010  1
  Al  Al82  1  0.806323  0.279164  0.579669  1
  Al  Al83  1  0.094081  0.505331  0.550205  1
  Al  Al84  1  0.074968  0.458637  0.607475  1
  Al  Al85  1  0.327528  0.542271  0.575256  1
  Al  Al86  1  0.531188  0.958443  0.569423  1
  Al  Al87  1  0.170952  0.925395  0.621760  1
  Al  Al88  1  0.376981  0.035683  0.614686  1
  Al  Al89  1  0.063655  0.191520  0.613511  1
  Al  Al90  1  0.735650  0.072228  0.562694  1
  Al  Al91  1  0.307413  0.495758  0.632616  1
  Al  Al92  1  0.342816  0.804100  0.569420  1
  Al  Al93  1  0.597052  0.720248  0.604010  1
  Al  Al94  1  0.306323  0.279164  0.579669  1
  Al  Al95  1  0.594081  0.505331  0.550205  1
  Al  Al96  1  0.574968  0.458637  0.607475  1
  Al  Al97  1  0.512121  0.310188  0.664402  1
  Al  Al98  1  0.708048  0.727115  0.661445  1
  Al  Al99  1  0.383719  0.692438  0.706618  1
  Al  Al100  1  0.572571  0.826896  0.708610  1
  Al  Al101  1  0.264580  0.966288  0.704790  1
  Al  Al102  1  0.916656  0.837607  0.656732  1
  Al  Al103  1  0.528373  0.203038  0.715564  1
  Al  Al104  1  0.527662  0.565650  0.659668  1
  Al  Al105  1  0.776684  0.489451  0.692416  1
  Al  Al106  1  0.495053  0.044729  0.670781  1
  Al  Al107  1  0.779363  0.273731  0.641080  1
  Al  Al108  1  0.769112  0.230666  0.697003  1
  Al  Al109  1  0.012121  0.310188  0.664402  1
  Al  Al110  1  0.208048  0.727115  0.661445  1
  Al  Al111  1  0.883719  0.692438  0.706618  1
  Al  Al112  1  0.072571  0.826896  0.708610  1
  Al  Al113  1  0.764580  0.966288  0.704790  1
  Al  Al114  1  0.416656  0.837607  0.656732  1
  Al  Al115  1  0.028373  0.203038  0.715564  1
  Al  Al116  1  0.027662  0.565650  0.659668  1
  Al  Al117  1  0.276684  0.489451  0.692416  1
  Al  Al118  1  0.995053  0.044729  0.670781  1
  Al  Al119  1  0.279363  0.273731  0.641080  1
  Al  Al120  1  0.269112  0.230666  0.697003  1
  Fe  Fe121  1  0.813881  0.379634  0.341847  1
  Fe  Fe122  1  0.989594  0.021371  0.293741  1
  Fe  Fe123  1  0.313881  0.379634  0.341847  1
  Fe  Fe124  1  0.489594  0.021371  0.293741  1
  Fe  Fe125  1  0.498698  0.150856  0.433465  1
  Fe  Fe126  1  0.670338  0.771503  0.383333  1
  Fe  Fe127  1  0.998698  0.150856  0.433465  1
  Fe  Fe128  1  0.170338  0.771503  0.383333  1
  Fe  Fe129  1  0.183221  0.919653  0.524932  1
  Fe  Fe130  1  0.352539  0.542014  0.475342  1
  Fe  Fe131  1  0.683221  0.919653  0.524932  1
  Fe  Fe132  1  0.852539  0.542014  0.475342  1
  Fe  Fe133  1  0.865422  0.690164  0.616941  1
  Fe  Fe134  1  0.037062  0.310811  0.566809  1
  Fe  Fe135  1  0.365422  0.690164  0.616941  1
  Fe  Fe136  1  0.537062  0.310811  0.566809  1
  Fe  Fe137  1  0.546166  0.440296  0.706533  1
  Fe  Fe138  1  0.721880  0.082033  0.658427  1
  Fe  Fe139  1  0.046166  0.440296  0.706533  1
  Fe  Fe140  1  0.221880  0.082033  0.658427  1
