# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.70449346
_cell_length_b   12.70233738
_cell_length_c   47.67547284
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al216
_cell_volume   7655.14821625
_cell_formula_units_Z   216
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  0.171475  0.338598  0.282971  1
  Al  Al2  1  0.504809  0.005264  0.282971  1
  Al  Al3  1  0.473472  0.307247  0.305828  1
  Al  Al4  1  0.838142  0.671931  0.282971  1
  Al  Al5  1  0.806805  0.973913  0.305828  1
  Al  Al6  1  0.776892  0.277342  0.332083  1
  Al  Al7  1  0.140138  0.640580  0.305828  1
  Al  Al8  1  0.110226  0.944009  0.332083  1
  Al  Al9  1  0.443559  0.610676  0.332083  1
  Al  Al10  1  0.004809  0.505264  0.282971  1
  Al  Al11  1  0.338142  0.171931  0.282971  1
  Al  Al12  1  0.306805  0.473913  0.305828  1
  Al  Al13  1  0.671475  0.838598  0.282971  1
  Al  Al14  1  0.640138  0.140580  0.305828  1
  Al  Al15  1  0.610226  0.444009  0.332083  1
  Al  Al16  1  0.973472  0.807247  0.305828  1
  Al  Al17  1  0.943559  0.110676  0.332083  1
  Al  Al18  1  0.276892  0.777342  0.332083  1
  Al  Al19  1  0.110226  0.444009  0.332083  1
  Al  Al20  1  0.443559  0.110676  0.332083  1
  Al  Al21  1  0.504809  0.505264  0.282971  1
  Al  Al22  1  0.776892  0.777342  0.332083  1
  Al  Al23  1  0.838142  0.171931  0.282971  1
  Al  Al24  1  0.806805  0.473913  0.305828  1
  Al  Al25  1  0.171475  0.838598  0.282971  1
  Al  Al26  1  0.140138  0.140580  0.305828  1
  Al  Al27  1  0.473472  0.807247  0.305828  1
  Al  Al28  1  0.973472  0.307247  0.305828  1
  Al  Al29  1  0.306805  0.973913  0.305828  1
  Al  Al30  1  0.276892  0.277342  0.332083  1
  Al  Al31  1  0.640138  0.640580  0.305828  1
  Al  Al32  1  0.610226  0.944009  0.332083  1
  Al  Al33  1  0.671475  0.338598  0.282971  1
  Al  Al34  1  0.943559  0.610676  0.332083  1
  Al  Al35  1  0.004809  0.005264  0.282971  1
  Al  Al36  1  0.338142  0.671931  0.282971  1
  Al  Al37  1  0.079769  0.246881  0.356682  1
  Al  Al38  1  0.413102  0.913548  0.356682  1
  Al  Al39  1  0.382759  0.216539  0.382982  1
  Al  Al40  1  0.746435  0.580214  0.356682  1
  Al  Al41  1  0.716092  0.883205  0.382982  1
  Al  Al42  1  0.685416  0.185860  0.408559  1
  Al  Al43  1  0.049426  0.549872  0.382982  1
  Al  Al44  1  0.018749  0.852527  0.408559  1
  Al  Al45  1  0.352082  0.519193  0.408559  1
  Al  Al46  1  0.913102  0.413548  0.356682  1
  Al  Al47  1  0.246435  0.080214  0.356682  1
  Al  Al48  1  0.216092  0.383205  0.382982  1
  Al  Al49  1  0.579769  0.746881  0.356682  1
  Al  Al50  1  0.549426  0.049872  0.382982  1
  Al  Al51  1  0.518749  0.352527  0.408559  1
  Al  Al52  1  0.882759  0.716539  0.382982  1
  Al  Al53  1  0.852082  0.019193  0.408559  1
  Al  Al54  1  0.185416  0.685860  0.408559  1
  Al  Al55  1  0.018749  0.352527  0.408559  1
  Al  Al56  1  0.352082  0.019193  0.408559  1
  Al  Al57  1  0.413102  0.413548  0.356682  1
  Al  Al58  1  0.685416  0.685860  0.408559  1
  Al  Al59  1  0.746435  0.080214  0.356682  1
  Al  Al60  1  0.716092  0.383205  0.382982  1
  Al  Al61  1  0.079769  0.746881  0.356682  1
  Al  Al62  1  0.049426  0.049872  0.382982  1
  Al  Al63  1  0.382759  0.716539  0.382982  1
  Al  Al64  1  0.882759  0.216539  0.382982  1
  Al  Al65  1  0.216092  0.883205  0.382982  1
  Al  Al66  1  0.185416  0.185860  0.408559  1
  Al  Al67  1  0.549426  0.549872  0.382982  1
  Al  Al68  1  0.518749  0.852527  0.408559  1
  Al  Al69  1  0.579769  0.246881  0.356682  1
  Al  Al70  1  0.852082  0.519193  0.408559  1
  Al  Al71  1  0.913102  0.913548  0.356682  1
  Al  Al72  1  0.246435  0.580214  0.356682  1
  Al  Al73  1  0.988314  0.155424  0.434467  1
  Al  Al74  1  0.321648  0.822091  0.434467  1
  Al  Al75  1  0.291178  0.124953  0.460188  1
  Al  Al76  1  0.654981  0.488757  0.434467  1
  Al  Al77  1  0.624511  0.791620  0.460188  1
  Al  Al78  1  0.594084  0.094524  0.485998  1
  Al  Al79  1  0.957845  0.458286  0.460188  1
  Al  Al80  1  0.927417  0.761190  0.485998  1
  Al  Al81  1  0.260750  0.427857  0.485998  1
  Al  Al82  1  0.821648  0.322091  0.434467  1
  Al  Al83  1  0.154981  0.988757  0.434467  1
  Al  Al84  1  0.124511  0.291620  0.460188  1
  Al  Al85  1  0.488314  0.655424  0.434467  1
  Al  Al86  1  0.457845  0.958286  0.460188  1
  Al  Al87  1  0.427417  0.261190  0.485998  1
  Al  Al88  1  0.791178  0.624953  0.460188  1
  Al  Al89  1  0.760750  0.927857  0.485998  1
  Al  Al90  1  0.094084  0.594524  0.485998  1
  Al  Al91  1  0.927417  0.261190  0.485998  1
  Al  Al92  1  0.260750  0.927857  0.485998  1
  Al  Al93  1  0.321648  0.322091  0.434467  1
  Al  Al94  1  0.594084  0.594524  0.485998  1
  Al  Al95  1  0.654981  0.988757  0.434467  1
  Al  Al96  1  0.624511  0.291620  0.460188  1
  Al  Al97  1  0.988314  0.655424  0.434467  1
  Al  Al98  1  0.957845  0.958286  0.460188  1
  Al  Al99  1  0.291178  0.624953  0.460188  1
  Al  Al100  1  0.791178  0.124953  0.460188  1
  Al  Al101  1  0.124511  0.791620  0.460188  1
  Al  Al102  1  0.094084  0.094524  0.485998  1
  Al  Al103  1  0.457845  0.458286  0.460188  1
  Al  Al104  1  0.427417  0.761190  0.485998  1
  Al  Al105  1  0.488314  0.155424  0.434467  1
  Al  Al106  1  0.760750  0.427857  0.485998  1
  Al  Al107  1  0.821648  0.822091  0.434467  1
  Al  Al108  1  0.154981  0.488757  0.434467  1
  Al  Al109  1  0.896966  0.064071  0.511750  1
  Al  Al110  1  0.230299  0.730738  0.511750  1
  Al  Al111  1  0.199872  0.033642  0.537560  1
  Al  Al112  1  0.563633  0.397405  0.511750  1
  Al  Al113  1  0.533205  0.700309  0.537560  1
  Al  Al114  1  0.502735  1.003171  0.563281  1
  Al  Al115  1  0.866538  0.366976  0.537560  1
  Al  Al116  1  0.836068  0.669838  0.563281  1
  Al  Al117  1  0.169402  0.336504  0.563281  1
  Al  Al118  1  0.730299  0.230738  0.511750  1
  Al  Al119  1  0.063633  0.897405  0.511750  1
  Al  Al120  1  0.033205  0.200309  0.537560  1
  Al  Al121  1  0.396966  0.564071  0.511750  1
  Al  Al122  1  0.366538  0.866976  0.537560  1
  Al  Al123  1  0.336068  0.169838  0.563281  1
  Al  Al124  1  0.699872  0.533642  0.537560  1
  Al  Al125  1  0.669402  0.836504  0.563281  1
  Al  Al126  1  1.002735  0.503171  0.563281  1
  Al  Al127  1  0.836068  0.169838  0.563281  1
  Al  Al128  1  0.169402  0.836504  0.563281  1
  Al  Al129  1  0.230299  0.230738  0.511750  1
  Al  Al130  1  0.502735  0.503171  0.563281  1
  Al  Al131  1  0.563633  0.897405  0.511750  1
  Al  Al132  1  0.533205  0.200309  0.537560  1
  Al  Al133  1  0.896966  0.564071  0.511750  1
  Al  Al134  1  0.866538  0.866976  0.537560  1
  Al  Al135  1  0.199872  0.533642  0.537560  1
  Al  Al136  1  0.699872  0.033642  0.537560  1
  Al  Al137  1  0.033205  0.700309  0.537560  1
  Al  Al138  1  1.002735  1.003171  0.563281  1
  Al  Al139  1  0.366538  0.366976  0.537560  1
  Al  Al140  1  0.336068  0.669838  0.563281  1
  Al  Al141  1  0.396966  0.064071  0.511750  1
  Al  Al142  1  0.669402  0.336504  0.563281  1
  Al  Al143  1  0.730299  0.730738  0.511750  1
  Al  Al144  1  0.063633  0.397405  0.511750  1
  Al  Al145  1  0.805634  0.972735  0.589189  1
  Al  Al146  1  0.138967  0.639402  0.589189  1
  Al  Al147  1  0.108290  0.942056  0.614766  1
  Al  Al148  1  0.472300  0.306068  0.589189  1
  Al  Al149  1  0.441624  0.608723  0.614766  1
  Al  Al150  1  0.411281  0.911714  0.641066  1
  Al  Al151  1  0.774957  0.275390  0.614766  1
  Al  Al152  1  0.744614  0.578381  0.641066  1
  Al  Al153  1  0.077948  0.245047  0.641066  1
  Al  Al154  1  0.638967  0.139402  0.589189  1
  Al  Al155  1  0.972300  0.806068  0.589189  1
  Al  Al156  1  0.941624  0.108723  0.614766  1
  Al  Al157  1  0.305634  0.472735  0.589189  1
  Al  Al158  1  0.274957  0.775390  0.614766  1
  Al  Al159  1  0.244614  0.078381  0.641066  1
  Al  Al160  1  0.608290  0.442056  0.614766  1
  Al  Al161  1  0.577948  0.745047  0.641066  1
  Al  Al162  1  0.911281  0.411714  0.641066  1
  Al  Al163  1  0.744614  0.078381  0.641066  1
  Al  Al164  1  0.077948  0.745047  0.641066  1
  Al  Al165  1  0.138967  0.139402  0.589189  1
  Al  Al166  1  0.411281  0.411714  0.641066  1
  Al  Al167  1  0.472300  0.806068  0.589189  1
  Al  Al168  1  0.441624  0.108723  0.614766  1
  Al  Al169  1  0.805634  0.472735  0.589189  1
  Al  Al170  1  0.774957  0.775390  0.614766  1
  Al  Al171  1  0.108290  0.442056  0.614766  1
  Al  Al172  1  0.608290  0.942056  0.614766  1
  Al  Al173  1  0.941624  0.608723  0.614766  1
  Al  Al174  1  0.911281  0.911714  0.641066  1
  Al  Al175  1  0.274957  0.275390  0.614766  1
  Al  Al176  1  0.244614  0.578381  0.641066  1
  Al  Al177  1  0.305634  0.972735  0.589189  1
  Al  Al178  1  0.577948  0.245047  0.641066  1
  Al  Al179  1  0.638967  0.639402  0.589189  1
  Al  Al180  1  0.972300  0.306068  0.589189  1
  Al  Al181  1  0.714157  0.881253  0.665665  1
  Al  Al182  1  0.047491  0.547919  0.665665  1
  Al  Al183  1  0.017578  0.851348  0.691920  1
  Al  Al184  1  0.380824  0.214586  0.665665  1
  Al  Al185  1  0.350911  0.518015  0.691920  1
  Al  Al186  1  0.319574  0.819997  0.714777  1
  Al  Al187  1  0.684245  0.184682  0.691920  1
  Al  Al188  1  0.652908  0.486664  0.714777  1
  Al  Al189  1  0.986241  0.153331  0.714777  1
  Al  Al190  1  0.547491  0.047919  0.665665  1
  Al  Al191  1  0.880824  0.714586  0.665665  1
  Al  Al192  1  0.850911  0.018015  0.691920  1
  Al  Al193  1  0.214157  0.381253  0.665665  1
  Al  Al194  1  0.184245  0.684682  0.691920  1
  Al  Al195  1  0.152908  0.986664  0.714777  1
  Al  Al196  1  0.517578  0.351348  0.691920  1
  Al  Al197  1  0.486241  0.653331  0.714777  1
  Al  Al198  1  0.819574  0.319997  0.714777  1
  Al  Al199  1  0.652908  0.986664  0.714777  1
  Al  Al200  1  0.986241  0.653331  0.714777  1
  Al  Al201  1  0.047491  0.047919  0.665665  1
  Al  Al202  1  0.319574  0.319997  0.714777  1
  Al  Al203  1  0.380824  0.714586  0.665665  1
  Al  Al204  1  0.350911  0.018015  0.691920  1
  Al  Al205  1  0.714157  0.381253  0.665665  1
  Al  Al206  1  0.684245  0.684682  0.691920  1
  Al  Al207  1  0.017578  0.351348  0.691920  1
  Al  Al208  1  0.517578  0.851348  0.691920  1
  Al  Al209  1  0.850911  0.518015  0.691920  1
  Al  Al210  1  0.819574  0.819997  0.714777  1
  Al  Al211  1  0.184245  0.184682  0.691920  1
  Al  Al212  1  0.152908  0.486664  0.714777  1
  Al  Al213  1  0.214157  0.881253  0.665665  1
  Al  Al214  1  0.486241  0.153331  0.714777  1
  Al  Al215  1  0.547491  0.547919  0.665665  1
  Al  Al216  1  0.880824  0.214586  0.665665  1
