# generated using pymatgen
data_Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.58263944
_cell_length_b   14.58075070
_cell_length_c   47.15914561
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al
_chemical_formula_sum   Al252
_cell_volume   9540.78949561
_cell_formula_units_Z   252
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  0.898894  0.233186  0.318911  1
  Al  Al2  1  0.232780  0.899300  0.318911  1
  Al  Al3  1  0.273480  0.273905  0.298523  1
  Al  Al4  1  0.526458  0.193497  0.340821  1
  Al  Al5  1  0.859840  0.860250  0.340841  1
  Al  Al6  1  0.193088  0.526868  0.340822  1
  Al  Al7  1  0.567145  0.567551  0.320281  1
  Al  Al8  1  0.606495  0.940300  0.298587  1
  Al  Al9  1  0.939876  0.606918  0.298587  1
  Al  Al10  1  0.693077  0.026985  0.340810  1
  Al  Al11  1  0.026575  0.693487  0.340810  1
  Al  Al12  1  0.065886  0.066293  0.318939  1
  Al  Al13  1  0.439877  0.106618  0.298623  1
  Al  Al14  1  0.773174  0.773598  0.298601  1
  Al  Al15  1  0.106197  0.440302  0.298623  1
  Al  Al16  1  0.480333  0.480787  0.279938  1
  Al  Al17  1  0.399503  0.730993  0.318343  1
  Al  Al18  1  0.730590  0.399909  0.318344  1
  Al  Al19  1  0.879753  0.046916  0.329784  1
  Al  Al20  1  0.213317  0.713226  0.329739  1
  Al  Al21  1  0.253014  0.086744  0.308815  1
  Al  Al22  1  0.626912  0.127875  0.288869  1
  Al  Al23  1  0.960263  0.793954  0.289013  1
  Al  Al24  1  0.293115  0.461129  0.288900  1
  Al  Al25  1  0.546692  0.379369  0.330677  1
  Al  Al26  1  0.586265  0.753102  0.308662  1
  Al  Al27  1  0.919198  0.420023  0.308789  1
  Al  Al28  1  0.712826  0.213718  0.329739  1
  Al  Al29  1  0.046516  0.880153  0.329784  1
  Al  Al30  1  0.086332  0.253427  0.308815  1
  Al  Al31  1  0.460682  0.293551  0.288899  1
  Al  Al32  1  0.793509  0.960708  0.289013  1
  Al  Al33  1  0.127431  0.627357  0.288870  1
  Al  Al34  1  0.378964  0.547096  0.330681  1
  Al  Al35  1  0.419610  0.919609  0.308789  1
  Al  Al36  1  0.752690  0.586677  0.308663  1
  Al  Al37  1  0.781938  0.115598  0.381882  1
  Al  Al38  1  0.115210  0.782326  0.381882  1
  Al  Al39  1  0.154353  0.154749  0.360883  1
  Al  Al40  1  0.409166  0.076244  0.402656  1
  Al  Al41  1  0.742743  0.743127  0.402753  1
  Al  Al42  1  0.075859  0.409550  0.402656  1
  Al  Al43  1  0.448569  0.448956  0.382179  1
  Al  Al44  1  0.487546  0.820981  0.360730  1
  Al  Al45  1  0.820586  0.487942  0.360730  1
  Al  Al46  1  0.575800  0.909410  0.402618  1
  Al  Al47  1  0.909026  0.576184  0.402618  1
  Al  Al48  1  0.948608  0.948996  0.381883  1
  Al  Al49  1  0.321010  0.988064  0.360861  1
  Al  Al50  1  0.654908  0.655304  0.361188  1
  Al  Al51  1  0.987667  0.321407  0.360861  1
  Al  Al52  1  0.360181  0.360589  0.340639  1
  Al  Al53  1  0.281387  0.615894  0.382187  1
  Al  Al54  1  0.615504  0.281777  0.382185  1
  Al  Al55  1  0.762159  0.929247  0.392531  1
  Al  Al56  1  0.095316  0.595848  0.392557  1
  Al  Al57  1  0.135010  0.968641  0.371327  1
  Al  Al58  1  0.507181  0.007488  0.350630  1
  Al  Al59  1  0.840653  0.674299  0.350596  1
  Al  Al60  1  0.174048  0.340974  0.350625  1
  Al  Al61  1  0.428797  0.262600  0.392528  1
  Al  Al62  1  0.468057  0.635544  0.371625  1
  Al  Al63  1  0.801366  0.302151  0.371216  1
  Al  Al64  1  0.595458  0.095705  0.392557  1
  Al  Al65  1  0.928858  0.762549  0.392531  1
  Al  Al66  1  0.968250  0.135401  0.371327  1
  Al  Al67  1  0.340572  0.174450  0.350625  1
  Al  Al68  1  0.673897  0.841056  0.350596  1
  Al  Al69  1  0.007086  0.507584  0.350630  1
  Al  Al70  1  0.262211  0.429186  0.392528  1
  Al  Al71  1  0.301761  0.801756  0.371216  1
  Al  Al72  1  0.635152  0.468448  0.371624  1
  Al  Al73  1  0.664021  0.997639  0.444555  1
  Al  Al74  1  0.997268  0.664392  0.444555  1
  Al  Al75  1  0.036713  0.037088  0.423493  1
  Al  Al76  1  0.291516  0.958461  0.465199  1
  Al  Al77  1  0.624856  0.625219  0.465287  1
  Al  Al78  1  0.958097  0.291879  0.465199  1
  Al  Al79  1  0.330717  0.331087  0.444585  1
  Al  Al80  1  0.369905  0.703842  0.423638  1
  Al  Al81  1  0.703466  0.370281  0.423637  1
  Al  Al82  1  0.458146  0.791882  0.465259  1
  Al  Al83  1  0.791518  0.458509  0.465259  1
  Al  Al84  1  0.830779  0.831150  0.444589  1
  Al  Al85  1  0.203406  0.870336  0.423473  1
  Al  Al86  1  0.536731  0.537106  0.423678  1
  Al  Al87  1  0.869960  0.203781  0.423473  1
  Al  Al88  1  0.242529  0.242914  0.402680  1
  Al  Al89  1  0.164037  0.497727  0.444566  1
  Al  Al90  1  0.497356  0.164408  0.444566  1
  Al  Al91  1  0.644464  0.811501  0.454839  1
  Al  Al92  1  0.977728  0.478116  0.454783  1
  Al  Al93  1  0.017050  0.850797  0.434056  1
  Al  Al94  1  0.389634  0.889904  0.412977  1
  Al  Al95  1  0.723058  0.556699  0.413134  1
  Al  Al96  1  0.056281  0.223365  0.413028  1
  Al  Al97  1  0.311119  0.144801  0.454825  1
  Al  Al98  1  0.350327  0.517471  0.434200  1
  Al  Al99  1  0.683829  0.183867  0.434164  1
  Al  Al100  1  0.477749  0.978095  0.454782  1
  Al  Al101  1  0.811134  0.644831  0.454839  1
  Al  Al102  1  0.850424  0.017423  0.434056  1
  Al  Al103  1  0.222985  0.056661  0.413028  1
  Al  Al104  1  0.556319  0.723438  0.413134  1
  Al  Al105  1  0.889524  0.390014  0.412977  1
  Al  Al106  1  0.144434  0.311486  0.454825  1
  Al  Al107  1  0.183494  0.684202  0.434165  1
  Al  Al108  1  0.517099  0.350699  0.434200  1
  Al  Al109  1  0.546314  0.880040  0.506927  1
  Al  Al110  1  0.879690  0.546663  0.506927  1
  Al  Al111  1  0.918937  0.919294  0.486228  1
  Al  Al112  1  0.173683  0.840749  0.527888  1
  Al  Al113  1  0.507076  0.507419  0.527985  1
  Al  Al114  1  0.840406  0.174027  0.527888  1
  Al  Al115  1  0.213039  0.213389  0.506954  1
  Al  Al116  1  0.252215  0.585947  0.486284  1
  Al  Al117  1  0.585590  0.252571  0.486284  1
  Al  Al118  1  0.340427  0.674043  0.527958  1
  Al  Al119  1  0.673699  0.340771  0.527959  1
  Al  Al120  1  0.713016  0.713366  0.506938  1
  Al  Al121  1  0.085477  0.752632  0.486242  1
  Al  Al122  1  0.418919  0.419275  0.486310  1
  Al  Al123  1  0.752275  0.085833  0.486242  1
  Al  Al124  1  0.124844  0.125207  0.465208  1
  Al  Al125  1  0.046285  0.380021  0.506933  1
  Al  Al126  1  0.379671  0.046635  0.506933  1
  Al  Al127  1  0.526709  0.693701  0.517428  1
  Al  Al128  1  0.859968  0.360399  0.517411  1
  Al  Al129  1  0.899278  0.732969  0.496654  1
  Al  Al130  1  0.271820  0.772256  0.475762  1
  Al  Al131  1  0.605235  0.438896  0.475806  1
  Al  Al132  1  0.938543  0.105581  0.475686  1
  Al  Al133  1  0.193375  0.027046  0.517359  1
  Al  Al134  1  0.232628  0.399639  0.496681  1
  Al  Al135  1  0.565906  0.066283  0.496631  1
  Al  Al136  1  0.360052  0.860315  0.517411  1
  Al  Al137  1  0.693354  0.527056  0.517428  1
  Al  Al138  1  0.732616  0.899631  0.496654  1
  Al  Al139  1  0.105221  0.938902  0.475686  1
  Al  Al140  1  0.438537  0.605595  0.475806  1
  Al  Al141  1  0.771896  0.272180  0.475762  1
  Al  Al142  1  0.026699  0.193722  0.517359  1
  Al  Al143  1  0.065930  0.566259  0.496631  1
  Al  Al144  1  0.399286  0.232981  0.496681  1
  Al  Al145  1  0.428665  0.762047  0.569613  1
  Al  Al146  1  0.761716  0.428997  0.569614  1
  Al  Al147  1  0.801180  0.801516  0.548739  1
  Al  Al148  1  0.056036  0.722916  0.590549  1
  Al  Al149  1  0.389558  0.389881  0.590736  1
  Al  Al150  1  0.722593  0.056359  0.590549  1
  Al  Al151  1  0.095230  0.095561  0.569517  1
  Al  Al152  1  0.134482  0.468131  0.548770  1
  Al  Al153  1  0.467795  0.134819  0.548770  1
  Al  Al154  1  0.222562  0.556236  0.590566  1
  Al  Al155  1  0.555913  0.222885  0.590566  1
  Al  Al156  1  0.595210  0.595541  0.569611  1
  Al  Al157  1  0.967904  0.634785  0.548734  1
  Al  Al158  1  0.301266  0.301602  0.548838  1
  Al  Al159  1  0.634449  0.968240  0.548734  1
  Al  Al160  1  0.007076  0.007420  0.527880  1
  Al  Al161  1  0.928558  0.262186  0.569499  1
  Al  Al162  1  0.261855  0.928889  0.569499  1
  Al  Al163  1  0.409019  0.575888  0.580222  1
  Al  Al164  1  0.742218  0.242526  0.580059  1
  Al  Al165  1  0.781619  0.615215  0.558983  1
  Al  Al166  1  0.154089  0.654426  0.538381  1
  Al  Al167  1  0.487464  0.321165  0.538464  1
  Al  Al168  1  0.820787  0.987774  0.538390  1
  Al  Al169  1  0.075574  0.909243  0.580079  1
  Al  Al170  1  0.114933  0.281918  0.559028  1
  Al  Al171  1  0.448250  0.948483  0.559039  1
  Al  Al172  1  0.242199  0.742545  0.580059  1
  Al  Al173  1  0.575561  0.409346  0.580222  1
  Al  Al174  1  0.614883  0.781951  0.558983  1
  Al  Al175  1  0.987434  0.821127  0.538390  1
  Al  Al176  1  0.320825  0.487804  0.538464  1
  Al  Al177  1  0.654086  0.154429  0.538381  1
  Al  Al178  1  0.908915  0.075901  0.580079  1
  Al  Al179  1  0.948150  0.448583  0.559040  1
  Al  Al180  1  0.281585  0.115266  0.559028  1
  Al  Al181  1  0.310391  0.644227  0.632187  1
  Al  Al182  1  0.643915  0.310703  0.632187  1
  Al  Al183  1  0.683550  0.683863  0.610889  1
  Al  Al184  1  0.938440  0.605283  0.652825  1
  Al  Al185  1  0.271653  0.271952  0.653009  1
  Al  Al186  1  0.604984  0.938740  0.652825  1
  Al  Al187  1  0.977342  0.977654  0.632237  1
  Al  Al188  1  0.016788  0.350429  0.611025  1
  Al  Al189  1  0.350115  0.017103  0.611025  1
  Al  Al190  1  0.104992  0.438602  0.652954  1
  Al  Al191  1  0.438302  0.105291  0.652954  1
  Al  Al192  1  0.478016  0.478327  0.632689  1
  Al  Al193  1  0.849869  0.517225  0.611085  1
  Al  Al194  1  0.183464  0.183778  0.611067  1
  Al  Al195  1  0.516909  0.850185  0.611084  1
  Al  Al196  1  0.889311  0.889634  0.590556  1
  Al  Al197  1  0.810643  0.144359  0.632234  1
  Al  Al198  1  0.144047  0.810955  0.632234  1
  Al  Al199  1  0.291357  0.458242  0.642764  1
  Al  Al200  1  0.624531  0.124834  0.642727  1
  Al  Al201  1  0.663370  0.497608  0.621942  1
  Al  Al202  1  0.036400  0.536651  0.600896  1
  Al  Al203  1  0.369749  0.203473  0.600953  1
  Al  Al204  1  0.703019  0.870242  0.600798  1
  Al  Al205  1  0.958152  0.791569  0.642663  1
  Al  Al206  1  0.997046  0.164007  0.621674  1
  Al  Al207  1  0.330257  0.830727  0.621587  1
  Al  Al208  1  0.124528  0.624837  0.642727  1
  Al  Al209  1  0.457936  0.291663  0.642764  1
  Al  Al210  1  0.497291  0.663686  0.621941  1
  Al  Al211  1  0.869924  0.703337  0.600798  1
  Al  Al212  1  0.203155  0.370068  0.600953  1
  Al  Al213  1  0.536332  0.036719  0.600896  1
  Al  Al214  1  0.791263  0.958459  0.642663  1
  Al  Al215  1  0.830411  0.330573  0.621587  1
  Al  Al216  1  0.163691  0.997361  0.621674  1
  Al  Al217  1  0.192382  0.526187  0.694804  1
  Al  Al218  1  0.525897  0.192671  0.694804  1
  Al  Al219  1  0.567821  0.568125  0.675616  1
  Al  Al220  1  0.816092  0.487614  0.714032  1
  Al  Al221  1  0.151953  0.152209  0.714561  1
  Al  Al222  1  0.487357  0.816346  0.714031  1
  Al  Al223  1  0.859304  0.859594  0.694644  1
  Al  Al224  1  0.899219  0.232576  0.673764  1
  Al  Al225  1  0.232272  0.899523  0.673764  1
  Al  Al226  1  0.984260  0.319904  0.714522  1
  Al  Al227  1  0.319648  0.984515  0.714522  1
  Al  Al228  1  0.359217  0.359506  0.694838  1
  Al  Al229  1  0.732772  0.398240  0.673428  1
  Al  Al230  1  0.065750  0.066054  0.673774  1
  Al  Al231  1  0.397936  0.733075  0.673428  1
  Al  Al232  1  0.772216  0.772515  0.652538  1
  Al  Al233  1  0.692482  0.025581  0.694779  1
  Al  Al234  1  0.025295  0.692772  0.694779  1
  Al  Al235  1  0.172110  0.339358  0.705008  1
  Al  Al236  1  0.505839  0.005547  0.704866  1
  Al  Al237  1  0.546447  0.379930  0.684613  1
  Al  Al238  1  0.919017  0.419379  0.662628  1
  Al  Al239  1  0.252473  0.085945  0.662771  1
  Al  Al240  1  0.586534  0.752231  0.662792  1
  Al  Al241  1  0.837748  0.672846  0.704643  1
  Al  Al242  1  0.879623  0.046600  0.684650  1
  Al  Al243  1  0.212661  0.713255  0.684674  1
  Al  Al244  1  0.005273  0.506116  0.704866  1
  Al  Al245  1  0.339081  0.172387  0.705008  1
  Al  Al246  1  0.379633  0.546744  0.684613  1
  Al  Al247  1  0.751932  0.586832  0.662796  1
  Al  Al248  1  0.085652  0.252766  0.662771  1
  Al  Al249  1  0.419085  0.919311  0.662627  1
  Al  Al250  1  0.672568  0.838015  0.704642  1
  Al  Al251  1  0.712958  0.212957  0.684675  1
  Al  Al252  1  0.046303  0.879920  0.684650  1
