# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68657123
_cell_length_b   12.70154960
_cell_length_c   47.67024211
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al96
_cell_volume   3355.95672411
_cell_formula_units_Z   96
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  0.051218  0.761850  0.272435  1
  Al  Al2  1  0.206304  0.071988  0.290217  1
  Al  Al3  1  0.365573  0.390558  0.311089  1
  Al  Al4  1  0.365573  0.890558  0.311089  1
  Al  Al5  1  0.051218  0.261850  0.272435  1
  Al  Al6  1  0.206304  0.571988  0.290217  1
  Al  Al7  1  0.865573  0.890558  0.311089  1
  Al  Al8  1  0.551218  0.261850  0.272435  1
  Al  Al9  1  0.706304  0.571988  0.290217  1
  Al  Al10  1  0.551218  0.761850  0.272435  1
  Al  Al11  1  0.706304  0.071988  0.290217  1
  Al  Al12  1  0.865573  0.390558  0.311089  1
  Al  Al13  1  0.522337  0.704099  0.330444  1
  Al  Al14  1  0.681412  0.022246  0.349889  1
  Al  Al15  1  0.839095  0.337624  0.369206  1
  Al  Al16  1  0.839095  0.837624  0.369206  1
  Al  Al17  1  0.522337  0.204099  0.330444  1
  Al  Al18  1  0.681412  0.522246  0.349889  1
  Al  Al19  1  0.339095  0.837624  0.369206  1
  Al  Al20  1  0.022337  0.204099  0.330444  1
  Al  Al21  1  0.181412  0.522246  0.349889  1
  Al  Al22  1  0.022337  0.704099  0.330444  1
  Al  Al23  1  0.181412  0.022246  0.349889  1
  Al  Al24  1  0.339095  0.337624  0.369206  1
  Al  Al25  1  0.997046  0.653527  0.389134  1
  Al  Al26  1  0.154790  0.969020  0.408617  1
  Al  Al27  1  0.312794  0.285034  0.428264  1
  Al  Al28  1  0.312794  0.785034  0.428264  1
  Al  Al29  1  0.997046  0.153527  0.389134  1
  Al  Al30  1  0.154790  0.469020  0.408617  1
  Al  Al31  1  0.812794  0.785034  0.428264  1
  Al  Al32  1  0.497046  0.153527  0.389134  1
  Al  Al33  1  0.654790  0.469020  0.408617  1
  Al  Al34  1  0.497046  0.653527  0.389134  1
  Al  Al35  1  0.654790  0.969020  0.408617  1
  Al  Al36  1  0.812794  0.285034  0.428264  1
  Al  Al37  1  0.470612  0.600676  0.447935  1
  Al  Al38  1  0.628507  0.916469  0.467558  1
  Al  Al39  1  0.786395  0.232250  0.487189  1
  Al  Al40  1  0.786395  0.732250  0.487189  1
  Al  Al41  1  0.470612  0.100676  0.447935  1
  Al  Al42  1  0.628507  0.416469  0.467558  1
  Al  Al43  1  0.286395  0.732250  0.487189  1
  Al  Al44  1  0.970612  0.100676  0.447935  1
  Al  Al45  1  0.128507  0.416469  0.467558  1
  Al  Al46  1  0.970612  0.600676  0.447935  1
  Al  Al47  1  0.128507  0.916469  0.467558  1
  Al  Al48  1  0.286395  0.232250  0.487189  1
  Al  Al49  1  0.944267  0.547999  0.506844  1
  Al  Al50  1  0.102156  0.863781  0.526476  1
  Al  Al51  1  0.260050  0.179574  0.546099  1
  Al  Al52  1  0.260050  0.679574  0.546099  1
  Al  Al53  1  0.944267  0.047999  0.506844  1
  Al  Al54  1  0.102156  0.363781  0.526476  1
  Al  Al55  1  0.760050  0.679574  0.546099  1
  Al  Al56  1  0.444267  0.047999  0.506844  1
  Al  Al57  1  0.602156  0.363781  0.526476  1
  Al  Al58  1  0.444267  0.547999  0.506844  1
  Al  Al59  1  0.602156  0.863781  0.526476  1
  Al  Al60  1  0.760050  0.179574  0.546099  1
  Al  Al61  1  0.417868  0.495216  0.565769  1
  Al  Al62  1  0.575873  0.811229  0.585417  1
  Al  Al63  1  0.733617  0.126723  0.604900  1
  Al  Al64  1  0.733617  0.626723  0.604900  1
  Al  Al65  1  0.417868  0.995216  0.565769  1
  Al  Al66  1  0.575873  0.311229  0.585417  1
  Al  Al67  1  0.233617  0.626723  0.604900  1
  Al  Al68  1  0.917868  0.995216  0.565769  1
  Al  Al69  1  0.075873  0.311229  0.585417  1
  Al  Al70  1  0.917868  0.495216  0.565769  1
  Al  Al71  1  0.075873  0.811229  0.585417  1
  Al  Al72  1  0.233617  0.126723  0.604900  1
  Al  Al73  1  0.891568  0.442626  0.624827  1
  Al  Al74  1  0.049251  0.758003  0.644144  1
  Al  Al75  1  0.208325  0.076151  0.663589  1
  Al  Al76  1  0.208325  0.576151  0.663589  1
  Al  Al77  1  0.891568  0.942626  0.624827  1
  Al  Al78  1  0.049251  0.258003  0.644144  1
  Al  Al79  1  0.708325  0.576151  0.663589  1
  Al  Al80  1  0.391568  0.942626  0.624827  1
  Al  Al81  1  0.549251  0.258003  0.644144  1
  Al  Al82  1  0.391568  0.442626  0.624827  1
  Al  Al83  1  0.549251  0.758003  0.644144  1
  Al  Al84  1  0.708325  0.076151  0.663589  1
  Al  Al85  1  0.365089  0.389691  0.682945  1
  Al  Al86  1  0.524358  0.708262  0.703816  1
  Al  Al87  1  0.679444  0.018400  0.721599  1
  Al  Al88  1  0.679444  0.518400  0.721599  1
  Al  Al89  1  0.365089  0.889691  0.682945  1
  Al  Al90  1  0.524358  0.208262  0.703816  1
  Al  Al91  1  0.179444  0.518400  0.721599  1
  Al  Al92  1  0.865089  0.889691  0.682945  1
  Al  Al93  1  0.024358  0.208262  0.703816  1
  Al  Al94  1  0.865089  0.389691  0.682945  1
  Al  Al95  1  0.024358  0.708262  0.703816  1
  Al  Al96  1  0.179444  0.018400  0.721599  1
