# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.17951611
_cell_length_b   9.44914302
_cell_length_c   47.25892112
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al126
_cell_volume   4967.25926507
_cell_formula_units_Z   126
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  0.900255  0.410334  0.350462  1
  Al  Al2  1  0.233589  0.077000  0.350462  1
  Al  Al3  1  0.283955  0.480166  0.308730  1
  Al  Al4  1  0.566922  0.743667  0.350462  1
  Al  Al5  1  0.617288  0.146833  0.308730  1
  Al  Al6  1  0.588307  0.438619  0.329059  1
  Al  Al7  1  0.950621  0.813500  0.308730  1
  Al  Al8  1  0.921640  0.105286  0.329059  1
  Al  Al9  1  0.254974  0.771953  0.329059  1
  Al  Al10  1  0.801962  0.334223  0.299945  1
  Al  Al11  1  0.135296  1.000889  0.299945  1
  Al  Al12  1  0.098262  0.294658  0.318372  1
  Al  Al13  1  0.468629  0.667556  0.299945  1
  Al  Al14  1  0.431595  0.961325  0.318372  1
  Al  Al15  1  0.408789  0.256393  0.338231  1
  Al  Al16  1  0.764929  0.627991  0.318372  1
  Al  Al17  1  0.742122  0.923060  0.338231  1
  Al  Al18  1  0.075455  0.589727  0.338231  1
  Al  Al19  1  0.835697  0.311556  0.408813  1
  Al  Al20  1  0.169031  0.978223  0.408813  1
  Al  Al21  1  0.211567  0.376590  0.368771  1
  Al  Al22  1  0.502364  0.644889  0.408813  1
  Al  Al23  1  0.544900  1.043257  0.368771  1
  Al  Al24  1  0.523405  0.342512  0.388312  1
  Al  Al25  1  0.878233  0.709923  0.368771  1
  Al  Al26  1  0.856738  1.009178  0.388312  1
  Al  Al27  1  0.190071  0.675845  0.388312  1
  Al  Al28  1  0.723963  0.225728  0.359279  1
  Al  Al29  1  0.057297  0.892395  0.359279  1
  Al  Al30  1  0.033458  0.192909  0.378938  1
  Al  Al31  1  0.390630  0.559061  0.359279  1
  Al  Al32  1  0.366792  0.859576  0.378938  1
  Al  Al33  1  0.347036  0.161536  0.399081  1
  Al  Al34  1  0.700125  0.526243  0.378938  1
  Al  Al35  1  0.680370  0.828203  0.399081  1
  Al  Al36  1  0.013703  0.494870  0.399081  1
  Al  Al37  1  0.770934  0.213414  0.468387  1
  Al  Al38  1  0.104267  0.880081  0.468387  1
  Al  Al39  1  0.147316  0.278308  0.428591  1
  Al  Al40  1  0.437601  0.546748  0.468387  1
  Al  Al41  1  0.480649  0.944975  0.428591  1
  Al  Al42  1  0.459602  0.245928  0.448596  1
  Al  Al43  1  0.813983  0.611642  0.428591  1
  Al  Al44  1  0.792935  0.912595  0.448596  1
  Al  Al45  1  0.126268  0.579261  0.448596  1
  Al  Al46  1  0.658386  0.128059  0.418511  1
  Al  Al47  1  -0.008281  0.794726  0.418511  1
  Al  Al48  1  -0.030485  0.095308  0.438366  1
  Al  Al49  1  0.325053  0.461392  0.418511  1
  Al  Al50  1  0.302849  0.761975  0.438366  1
  Al  Al51  1  0.281952  0.062904  0.458489  1
  Al  Al52  1  0.636182  0.428642  0.438366  1
  Al  Al53  1  0.615285  0.729570  0.458489  1
  Al  Al54  1  0.948619  0.396237  0.458489  1
  Al  Al55  1  0.706326  0.115361  0.528137  1
  Al  Al56  1  0.039660  0.782028  0.528137  1
  Al  Al57  1  0.082714  0.180353  0.488260  1
  Al  Al58  1  0.372993  0.448695  0.528137  1
  Al  Al59  1  0.416047  0.847019  0.488260  1
  Al  Al60  1  0.394718  0.147675  0.508211  1
  Al  Al61  1  0.749380  0.513686  0.488260  1
  Al  Al62  1  0.728051  0.814342  0.508211  1
  Al  Al63  1  0.061385  0.481008  0.508211  1
  Al  Al64  1  0.593688  1.030010  0.478362  1
  Al  Al65  1  0.927021  0.696677  0.478362  1
  Al  Al66  1  0.905296  0.997697  0.498288  1
  Al  Al67  1  0.260354  0.363344  0.478362  1
  Al  Al68  1  0.238629  0.664363  0.498288  1
  Al  Al69  1  0.217300  0.965019  0.518239  1
  Al  Al70  1  0.571962  0.331030  0.498288  1
  Al  Al71  1  0.550634  0.631686  0.518239  1
  Al  Al72  1  0.883967  0.298352  0.518239  1
  Al  Al73  1  0.641628  1.017313  0.587989  1
  Al  Al74  1  -0.025039  0.683980  0.587989  1
  Al  Al75  1  0.018062  0.082468  0.548011  1
  Al  Al76  1  0.308295  0.350646  0.587989  1
  Al  Al77  1  0.351395  0.749135  0.548011  1
  Al  Al78  1  0.330499  0.050063  0.568134  1
  Al  Al79  1  0.684728  0.415801  0.548011  1
  Al  Al80  1  0.663832  0.716730  0.568134  1
  Al  Al81  1  -0.002835  0.383397  0.568134  1
  Al  Al82  1  0.529080  0.931957  0.538112  1
  Al  Al83  1  0.862413  0.598624  0.538112  1
  Al  Al84  1  0.840412  0.899444  0.557904  1
  Al  Al85  1  0.195746  0.265291  0.538112  1
  Al  Al86  1  0.173746  0.566110  0.557904  1
  Al  Al87  1  0.152698  0.867063  0.577908  1
  Al  Al88  1  0.507079  0.232777  0.557904  1
  Al  Al89  1  0.486031  0.533730  0.577908  1
  Al  Al90  1  0.819365  0.200397  0.577908  1
  Al  Al91  1  0.576051  0.919644  0.647220  1
  Al  Al92  1  0.909384  0.586310  0.647220  1
  Al  Al93  1  0.952978  0.983835  0.607419  1
  Al  Al94  1  0.242717  0.252977  0.647220  1
  Al  Al95  1  0.286311  0.650502  0.607419  1
  Al  Al96  1  0.266556  0.952462  0.627561  1
  Al  Al97  1  0.619644  0.317169  0.607419  1
  Al  Al98  1  0.599889  0.619129  0.627561  1
  Al  Al99  1  0.933222  0.285796  0.627561  1
  Al  Al100  1  0.464316  0.833816  0.597687  1
  Al  Al101  1  0.797650  0.500482  0.597687  1
  Al  Al102  1  0.776609  0.802860  0.618188  1
  Al  Al103  1  0.130983  0.167149  0.597687  1
  Al  Al104  1  0.109943  0.469527  0.618188  1
  Al  Al105  1  0.088447  0.768782  0.637728  1
  Al  Al106  1  0.443276  0.136193  0.618188  1
  Al  Al107  1  0.421780  0.435448  0.637728  1
  Al  Al108  1  0.755114  0.102115  0.637728  1
  Al  Al109  1  0.498052  0.811149  0.706554  1
  Al  Al110  1  0.831385  0.477816  0.706554  1
  Al  Al111  1  0.891225  0.888978  0.668268  1
  Al  Al112  1  0.164718  0.144482  0.706554  1
  Al  Al113  1  0.224559  0.555645  0.668268  1
  Al  Al114  1  0.201752  0.850714  0.688128  1
  Al  Al115  1  0.557892  0.222312  0.668268  1
  Al  Al116  1  0.535085  0.517380  0.688128  1
  Al  Al117  1  0.868419  0.184047  0.688128  1
  Al  Al118  1  0.399759  0.735038  0.656037  1
  Al  Al119  1  0.733092  0.401705  0.656037  1
  Al  Al120  1  0.711707  0.706752  0.677441  1
  Al  Al121  1  0.066425  0.068371  0.656037  1
  Al  Al122  1  0.045040  0.373419  0.677441  1
  Al  Al123  1  0.016059  0.665205  0.697769  1
  Al  Al124  1  0.378374  1.040086  0.677441  1
  Al  Al125  1  0.349393  0.331872  0.697769  1
  Al  Al126  1  0.682726  0.998539  0.697769  1
