# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.70401586
_cell_length_b   12.70283512
_cell_length_c   47.67404601
_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   7654.93129185
_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  0.171500  0.338575  0.282978  1
  Al  Al2  1  0.504833  0.005241  0.282978  1
  Al  Al3  1  0.473493  0.307227  0.305836  1
  Al  Al4  1  0.838166  0.671908  0.282978  1
  Al  Al5  1  0.806827  0.973894  0.305836  1
  Al  Al6  1  0.776916  0.277321  0.332092  1
  Al  Al7  1  0.140160  0.640560  0.305836  1
  Al  Al8  1  0.110250  0.943988  0.332092  1
  Al  Al9  1  0.443583  0.610655  0.332092  1
  Al  Al10  1  0.004833  0.505241  0.282978  1
  Al  Al11  1  0.338166  0.171908  0.282978  1
  Al  Al12  1  0.306827  0.473894  0.305836  1
  Al  Al13  1  0.671500  0.838575  0.282978  1
  Al  Al14  1  0.640160  0.140560  0.305836  1
  Al  Al15  1  0.610250  0.443988  0.332092  1
  Al  Al16  1  0.973493  0.807227  0.305836  1
  Al  Al17  1  0.943583  0.110655  0.332092  1
  Al  Al18  1  0.276916  0.777321  0.332092  1
  Al  Al19  1  0.110250  0.443988  0.332092  1
  Al  Al20  1  0.443583  0.110655  0.332092  1
  Al  Al21  1  0.504833  0.505241  0.282978  1
  Al  Al22  1  0.776916  0.777321  0.332092  1
  Al  Al23  1  0.838166  0.171908  0.282978  1
  Al  Al24  1  0.806827  0.473894  0.305836  1
  Al  Al25  1  0.171500  0.838575  0.282978  1
  Al  Al26  1  0.140160  0.140560  0.305836  1
  Al  Al27  1  0.473493  0.807227  0.305836  1
  Al  Al28  1  0.973493  0.307227  0.305836  1
  Al  Al29  1  0.306827  0.973894  0.305836  1
  Al  Al30  1  0.276916  0.277321  0.332092  1
  Al  Al31  1  0.640160  0.640560  0.305836  1
  Al  Al32  1  0.610250  0.943988  0.332092  1
  Al  Al33  1  0.671500  0.338575  0.282978  1
  Al  Al34  1  0.943583  0.610655  0.332092  1
  Al  Al35  1  0.004833  0.005241  0.282978  1
  Al  Al36  1  0.338166  0.671908  0.282978  1
  Al  Al37  1  0.079791  0.246861  0.356692  1
  Al  Al38  1  0.413125  0.913527  0.356692  1
  Al  Al39  1  0.382782  0.216518  0.382992  1
  Al  Al40  1  0.746458  0.580194  0.356692  1
  Al  Al41  1  0.716115  0.883184  0.382992  1
  Al  Al42  1  0.685437  0.185839  0.408570  1
  Al  Al43  1  0.049448  0.549851  0.382992  1
  Al  Al44  1  0.018771  0.852505  0.408570  1
  Al  Al45  1  0.352104  0.519172  0.408570  1
  Al  Al46  1  0.913125  0.413527  0.356692  1
  Al  Al47  1  0.246458  0.080194  0.356692  1
  Al  Al48  1  0.216115  0.383184  0.382992  1
  Al  Al49  1  0.579791  0.746861  0.356692  1
  Al  Al50  1  0.549448  0.049851  0.382992  1
  Al  Al51  1  0.518771  0.352505  0.408570  1
  Al  Al52  1  0.882782  0.716518  0.382992  1
  Al  Al53  1  0.852104  0.019172  0.408570  1
  Al  Al54  1  0.185437  0.685839  0.408570  1
  Al  Al55  1  0.018771  0.352505  0.408570  1
  Al  Al56  1  0.352104  0.019172  0.408570  1
  Al  Al57  1  0.413125  0.413527  0.356692  1
  Al  Al58  1  0.685437  0.685839  0.408570  1
  Al  Al59  1  0.746458  0.080194  0.356692  1
  Al  Al60  1  0.716115  0.383184  0.382992  1
  Al  Al61  1  0.079791  0.746861  0.356692  1
  Al  Al62  1  0.049448  0.049851  0.382992  1
  Al  Al63  1  0.382782  0.716518  0.382992  1
  Al  Al64  1  0.882782  0.216518  0.382992  1
  Al  Al65  1  0.216115  0.883184  0.382992  1
  Al  Al66  1  0.185437  0.185839  0.408570  1
  Al  Al67  1  0.549448  0.549851  0.382992  1
  Al  Al68  1  0.518771  0.852505  0.408570  1
  Al  Al69  1  0.579791  0.246861  0.356692  1
  Al  Al70  1  0.852104  0.519172  0.408570  1
  Al  Al71  1  0.913125  0.913527  0.356692  1
  Al  Al72  1  0.246458  0.580194  0.356692  1
  Al  Al73  1  0.988336  0.155404  0.434478  1
  Al  Al74  1  0.321669  0.822070  0.434478  1
  Al  Al75  1  0.291199  0.124932  0.460201  1
  Al  Al76  1  0.655002  0.488737  0.434478  1
  Al  Al77  1  0.624532  0.791599  0.460201  1
  Al  Al78  1  0.594103  0.094503  0.486011  1
  Al  Al79  1  0.957865  0.458265  0.460201  1
  Al  Al80  1  0.927437  0.761169  0.486011  1
  Al  Al81  1  0.260770  0.427836  0.486011  1
  Al  Al82  1  0.821669  0.322070  0.434478  1
  Al  Al83  1  0.155002  0.988737  0.434478  1
  Al  Al84  1  0.124532  0.291599  0.460201  1
  Al  Al85  1  0.488336  0.655404  0.434478  1
  Al  Al86  1  0.457865  0.958265  0.460201  1
  Al  Al87  1  0.427437  0.261169  0.486011  1
  Al  Al88  1  0.791199  0.624932  0.460201  1
  Al  Al89  1  0.760770  0.927836  0.486011  1
  Al  Al90  1  0.094103  0.594503  0.486011  1
  Al  Al91  1  0.927437  0.261169  0.486011  1
  Al  Al92  1  0.260770  0.927836  0.486011  1
  Al  Al93  1  0.321669  0.322070  0.434478  1
  Al  Al94  1  0.594103  0.594503  0.486011  1
  Al  Al95  1  0.655002  0.988737  0.434478  1
  Al  Al96  1  0.624532  0.291599  0.460201  1
  Al  Al97  1  0.988336  0.655404  0.434478  1
  Al  Al98  1  0.957865  0.958265  0.460201  1
  Al  Al99  1  0.291199  0.624932  0.460201  1
  Al  Al100  1  0.791199  0.124932  0.460201  1
  Al  Al101  1  0.124532  0.791599  0.460201  1
  Al  Al102  1  0.094103  0.094503  0.486011  1
  Al  Al103  1  0.457865  0.458265  0.460201  1
  Al  Al104  1  0.427437  0.761169  0.486011  1
  Al  Al105  1  0.488336  0.155404  0.434478  1
  Al  Al106  1  0.760770  0.427836  0.486011  1
  Al  Al107  1  0.821669  0.822070  0.434478  1
  Al  Al108  1  0.155002  0.488737  0.434478  1
  Al  Al109  1  0.896986  0.064050  0.511764  1
  Al  Al110  1  0.230319  0.730717  0.511764  1
  Al  Al111  1  0.199890  0.033621  0.537575  1
  Al  Al112  1  0.563652  0.397384  0.511764  1
  Al  Al113  1  0.533224  0.700288  0.537575  1
  Al  Al114  1  0.502753  1.003149  0.563297  1
  Al  Al115  1  0.866557  0.366954  0.537575  1
  Al  Al116  1  0.836087  0.669816  0.563297  1
  Al  Al117  1  0.169420  0.336483  0.563297  1
  Al  Al118  1  0.730319  0.230717  0.511764  1
  Al  Al119  1  0.063652  0.897384  0.511764  1
  Al  Al120  1  0.033224  0.200288  0.537575  1
  Al  Al121  1  0.396986  0.564050  0.511764  1
  Al  Al122  1  0.366557  0.866954  0.537575  1
  Al  Al123  1  0.336087  0.169816  0.563297  1
  Al  Al124  1  0.699890  0.533621  0.537575  1
  Al  Al125  1  0.669420  0.836483  0.563297  1
  Al  Al126  1  1.002753  0.503149  0.563297  1
  Al  Al127  1  0.836087  0.169816  0.563297  1
  Al  Al128  1  0.169420  0.836483  0.563297  1
  Al  Al129  1  0.230319  0.230717  0.511764  1
  Al  Al130  1  0.502753  0.503149  0.563297  1
  Al  Al131  1  0.563652  0.897384  0.511764  1
  Al  Al132  1  0.533224  0.200288  0.537575  1
  Al  Al133  1  0.896986  0.564050  0.511764  1
  Al  Al134  1  0.866557  0.866954  0.537575  1
  Al  Al135  1  0.199890  0.533621  0.537575  1
  Al  Al136  1  0.699890  0.033621  0.537575  1
  Al  Al137  1  0.033224  0.700288  0.537575  1
  Al  Al138  1  1.002753  1.003149  0.563297  1
  Al  Al139  1  0.366557  0.366954  0.537575  1
  Al  Al140  1  0.336087  0.669816  0.563297  1
  Al  Al141  1  0.396986  0.064050  0.511764  1
  Al  Al142  1  0.669420  0.336483  0.563297  1
  Al  Al143  1  0.730319  0.730717  0.511764  1
  Al  Al144  1  0.063652  0.397384  0.511764  1
  Al  Al145  1  0.805652  0.972714  0.589205  1
  Al  Al146  1  0.138985  0.639381  0.589205  1
  Al  Al147  1  0.108307  0.942035  0.614783  1
  Al  Al148  1  0.472318  0.306047  0.589205  1
  Al  Al149  1  0.441641  0.608702  0.614783  1
  Al  Al150  1  0.411297  0.911692  0.641084  1
  Al  Al151  1  0.774974  0.275368  0.614783  1
  Al  Al152  1  0.744631  0.578359  0.641084  1
  Al  Al153  1  0.077964  0.245026  0.641084  1
  Al  Al154  1  0.638985  0.139381  0.589205  1
  Al  Al155  1  0.972318  0.806047  0.589205  1
  Al  Al156  1  0.941641  0.108702  0.614783  1
  Al  Al157  1  0.305652  0.472714  0.589205  1
  Al  Al158  1  0.274974  0.775368  0.614783  1
  Al  Al159  1  0.244631  0.078359  0.641084  1
  Al  Al160  1  0.608307  0.442035  0.614783  1
  Al  Al161  1  0.577964  0.745026  0.641084  1
  Al  Al162  1  0.911297  0.411692  0.641084  1
  Al  Al163  1  0.744631  0.078359  0.641084  1
  Al  Al164  1  0.077964  0.745026  0.641084  1
  Al  Al165  1  0.138985  0.139381  0.589205  1
  Al  Al166  1  0.411297  0.411692  0.641084  1
  Al  Al167  1  0.472318  0.806047  0.589205  1
  Al  Al168  1  0.441641  0.108702  0.614783  1
  Al  Al169  1  0.805652  0.472714  0.589205  1
  Al  Al170  1  0.774974  0.775368  0.614783  1
  Al  Al171  1  0.108307  0.442035  0.614783  1
  Al  Al172  1  0.608307  0.942035  0.614783  1
  Al  Al173  1  0.941641  0.608702  0.614783  1
  Al  Al174  1  0.911297  0.911692  0.641084  1
  Al  Al175  1  0.274974  0.275368  0.614783  1
  Al  Al176  1  0.244631  0.578359  0.641084  1
  Al  Al177  1  0.305652  0.972714  0.589205  1
  Al  Al178  1  0.577964  0.245026  0.641084  1
  Al  Al179  1  0.638985  0.639381  0.589205  1
  Al  Al180  1  0.972318  0.306047  0.589205  1
  Al  Al181  1  0.714173  0.881232  0.665683  1
  Al  Al182  1  0.047506  0.547898  0.665683  1
  Al  Al183  1  0.017596  0.851326  0.691939  1
  Al  Al184  1  0.380839  0.214565  0.665683  1
  Al  Al185  1  0.350929  0.517992  0.691939  1
  Al  Al186  1  0.319589  0.819978  0.714797  1
  Al  Al187  1  0.684262  0.184659  0.691939  1
  Al  Al188  1  0.652923  0.486645  0.714797  1
  Al  Al189  1  0.986256  0.153312  0.714797  1
  Al  Al190  1  0.547506  0.047898  0.665683  1
  Al  Al191  1  0.880839  0.714565  0.665683  1
  Al  Al192  1  0.850929  0.017992  0.691939  1
  Al  Al193  1  0.214173  0.381232  0.665683  1
  Al  Al194  1  0.184262  0.684659  0.691939  1
  Al  Al195  1  0.152923  0.986645  0.714797  1
  Al  Al196  1  0.517596  0.351326  0.691939  1
  Al  Al197  1  0.486256  0.653312  0.714797  1
  Al  Al198  1  0.819589  0.319978  0.714797  1
  Al  Al199  1  0.652923  0.986645  0.714797  1
  Al  Al200  1  0.986256  0.653312  0.714797  1
  Al  Al201  1  0.047506  0.047898  0.665683  1
  Al  Al202  1  0.319589  0.319978  0.714797  1
  Al  Al203  1  0.380839  0.714565  0.665683  1
  Al  Al204  1  0.350929  0.017992  0.691939  1
  Al  Al205  1  0.714173  0.381232  0.665683  1
  Al  Al206  1  0.684262  0.684659  0.691939  1
  Al  Al207  1  0.017596  0.351326  0.691939  1
  Al  Al208  1  0.517596  0.851326  0.691939  1
  Al  Al209  1  0.850929  0.517992  0.691939  1
  Al  Al210  1  0.819589  0.819978  0.714797  1
  Al  Al211  1  0.184262  0.184659  0.691939  1
  Al  Al212  1  0.152923  0.486645  0.714797  1
  Al  Al213  1  0.214173  0.881232  0.665683  1
  Al  Al214  1  0.486256  0.153312  0.714797  1
  Al  Al215  1  0.547506  0.547898  0.665683  1
  Al  Al216  1  0.880839  0.214565  0.665683  1
