# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65557316
_cell_length_b   12.58769111
_cell_length_c   50.23138587
_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   3485.45648248
_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  0.603245  0.866688  0.321046  1
  Al  Al2  1  0.289730  0.239623  0.284641  1
  Al  Al3  1  0.443610  0.547269  0.300512  1
  Al  Al4  1  0.289730  0.739623  0.284641  1
  Al  Al5  1  0.443610  0.047269  0.300512  1
  Al  Al6  1  0.603245  0.366688  0.321046  1
  Al  Al7  1  0.789730  0.739623  0.284641  1
  Al  Al8  1  0.943610  0.047269  0.300512  1
  Al  Al9  1  0.103245  0.366688  0.321046  1
  Al  Al10  1  0.103245  0.866688  0.321046  1
  Al  Al11  1  0.789730  0.239623  0.284641  1
  Al  Al12  1  0.943610  0.547269  0.300512  1
  Al  Al13  1  0.076368  0.812980  0.375659  1
  Al  Al14  1  0.759622  0.179500  0.338612  1
  Al  Al15  1  0.919000  0.498210  0.357283  1
  Al  Al16  1  0.759622  0.679500  0.338612  1
  Al  Al17  1  0.919000  0.998210  0.357283  1
  Al  Al18  1  0.076368  0.312980  0.375659  1
  Al  Al19  1  0.259622  0.679500  0.338612  1
  Al  Al20  1  0.419000  0.998210  0.357283  1
  Al  Al21  1  0.576368  0.312980  0.375659  1
  Al  Al22  1  0.576368  0.812980  0.375659  1
  Al  Al23  1  0.259622  0.179500  0.338612  1
  Al  Al24  1  0.419000  0.498210  0.357283  1
  Al  Al25  1  0.550071  0.760382  0.431403  1
  Al  Al26  1  0.234407  0.129042  0.394387  1
  Al  Al27  1  0.392137  0.444515  0.412810  1
  Al  Al28  1  0.234407  0.629042  0.394387  1
  Al  Al29  1  0.392137  0.944515  0.412810  1
  Al  Al30  1  0.550071  0.260382  0.431403  1
  Al  Al31  1  0.734407  0.629042  0.394387  1
  Al  Al32  1  0.892137  0.944515  0.412810  1
  Al  Al33  1  0.050071  0.260382  0.431403  1
  Al  Al34  1  0.050071  0.760382  0.431403  1
  Al  Al35  1  0.734407  0.129042  0.394387  1
  Al  Al36  1  0.892137  0.444515  0.412810  1
  Al  Al37  1  0.023559  0.707369  0.487041  1
  Al  Al38  1  0.707856  0.075956  0.449952  1
  Al  Al39  1  0.865720  0.391688  0.468494  1
  Al  Al40  1  0.707856  0.575956  0.449952  1
  Al  Al41  1  0.865720  0.891688  0.468494  1
  Al  Al42  1  0.023559  0.207369  0.487041  1
  Al  Al43  1  0.207856  0.575956  0.449952  1
  Al  Al44  1  0.365720  0.891688  0.468494  1
  Al  Al45  1  0.523559  0.207369  0.487041  1
  Al  Al46  1  0.523559  0.707369  0.487041  1
  Al  Al47  1  0.207856  0.075956  0.449952  1
  Al  Al48  1  0.365720  0.391688  0.468494  1
  Al  Al49  1  0.497101  0.654463  0.542687  1
  Al  Al50  1  0.181398  0.023050  0.505597  1
  Al  Al51  1  0.339236  0.338731  0.524144  1
  Al  Al52  1  0.181398  0.523050  0.505597  1
  Al  Al53  1  0.339236  0.838731  0.524144  1
  Al  Al54  1  0.497101  0.154463  0.542687  1
  Al  Al55  1  0.681398  0.523050  0.505597  1
  Al  Al56  1  0.839236  0.838731  0.524144  1
  Al  Al57  1  0.997101  0.154463  0.542687  1
  Al  Al58  1  0.997101  0.654463  0.542687  1
  Al  Al59  1  0.681398  0.023050  0.505597  1
  Al  Al60  1  0.839236  0.338731  0.524144  1
  Al  Al61  1  0.970550  0.601377  0.598252  1
  Al  Al62  1  0.654886  0.970038  0.561236  1
  Al  Al63  1  0.812819  0.285905  0.579828  1
  Al  Al64  1  0.654886  0.470038  0.561236  1
  Al  Al65  1  0.812819  0.785905  0.579828  1
  Al  Al66  1  0.970550  0.101377  0.598252  1
  Al  Al67  1  0.154886  0.470038  0.561236  1
  Al  Al68  1  0.312819  0.785905  0.579828  1
  Al  Al69  1  0.470550  0.101377  0.598252  1
  Al  Al70  1  0.470550  0.601377  0.598252  1
  Al  Al71  1  0.154886  0.970038  0.561236  1
  Al  Al72  1  0.312819  0.285905  0.579828  1
  Al  Al73  1  0.445335  0.550919  0.654026  1
  Al  Al74  1  0.128588  0.917439  0.616979  1
  Al  Al75  1  0.285957  0.232209  0.635355  1
  Al  Al76  1  0.128588  0.417439  0.616979  1
  Al  Al77  1  0.285957  0.732209  0.635355  1
  Al  Al78  1  0.445335  0.050919  0.654026  1
  Al  Al79  1  0.628588  0.417439  0.616979  1
  Al  Al80  1  0.785957  0.732209  0.635355  1
  Al  Al81  1  0.945335  0.050919  0.654026  1
  Al  Al82  1  0.945335  0.550919  0.654026  1
  Al  Al83  1  0.628588  0.917439  0.616979  1
  Al  Al84  1  0.785957  0.232209  0.635355  1
  Al  Al85  1  0.915226  0.490796  0.707997  1
  Al  Al86  1  0.601712  0.863731  0.671592  1
  Al  Al87  1  0.761347  0.183150  0.692126  1
  Al  Al88  1  0.601712  0.363731  0.671592  1
  Al  Al89  1  0.761347  0.683150  0.692126  1
  Al  Al90  1  0.915226  0.990796  0.707997  1
  Al  Al91  1  0.101712  0.363731  0.671592  1
  Al  Al92  1  0.261347  0.683150  0.692126  1
  Al  Al93  1  0.415226  0.990796  0.707997  1
  Al  Al94  1  0.415226  0.490796  0.707997  1
  Al  Al95  1  0.101712  0.863731  0.671592  1
  Al  Al96  1  0.261347  0.183150  0.692126  1
