# generated using pymatgen
data_Al144H431
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.60049283
_cell_length_b   44.13137063
_cell_length_c   23.98150911
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al144H431
_chemical_formula_sum   'Al144 H431'
_cell_volume   5927.20803186
_cell_formula_units_Z   1
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  0.340761  -0.138923  0.195120  1
  Al  Al2  1  0.336281  -0.135247  0.529829  1
  Al  Al3  1  0.338008  -0.135726  0.862087  1
  Al  Al4  1  0.348020  0.114161  0.198552  1
  Al  Al5  1  0.339809  0.112198  0.531593  1
  Al  Al6  1  0.335564  0.109792  0.865311  1
  Al  Al7  1  0.331844  0.362016  0.199480  1
  Al  Al8  1  0.331339  0.362250  0.532847  1
  Al  Al9  1  0.334338  0.362652  0.866208  1
  Al  Al10  1  0.332889  0.612877  0.200250  1
  Al  Al11  1  0.330964  0.612571  0.533655  1
  Al  Al12  1  0.332990  0.612933  0.867154  1
  Al  Al13  1  0.841647  -0.138949  0.195167  1
  Al  Al14  1  0.835988  -0.135085  0.529832  1
  Al  Al15  1  0.835799  -0.135692  0.861951  1
  Al  Al16  1  0.846305  0.113907  0.198564  1
  Al  Al17  1  0.840007  0.112329  0.531522  1
  Al  Al18  1  0.834532  0.109944  0.865332  1
  Al  Al19  1  0.832394  0.362157  0.199447  1
  Al  Al20  1  0.833579  0.362226  0.532993  1
  Al  Al21  1  0.832082  0.362646  0.866145  1
  Al  Al22  1  0.833044  0.612859  0.200311  1
  Al  Al23  1  0.831865  0.612466  0.533650  1
  Al  Al24  1  0.830879  0.612928  0.867040  1
  Al  Al25  1  0.337132  -0.136962  0.083646  1
  Al  Al26  1  0.338423  -0.137735  0.418429  1
  Al  Al27  1  0.338934  -0.134013  0.751041  1
  Al  Al28  1  0.346404  0.112382  0.087432  1
  Al  Al29  1  0.346800  0.114015  0.420786  1
  Al  Al30  1  0.337611  0.110052  0.753897  1
  Al  Al31  1  0.334254  0.362354  0.088188  1
  Al  Al32  1  0.334248  0.362145  0.421460  1
  Al  Al33  1  0.336079  0.362745  0.754933  1
  Al  Al34  1  0.333098  0.613064  0.088927  1
  Al  Al35  1  0.333381  0.612724  0.422249  1
  Al  Al36  1  0.334974  0.612880  0.755810  1
  Al  Al37  1  0.838670  -0.137012  0.083736  1
  Al  Al38  1  0.837155  -0.137651  0.418500  1
  Al  Al39  1  0.837707  -0.134155  0.750935  1
  Al  Al40  1  0.845618  0.112192  0.087669  1
  Al  Al41  1  0.846114  0.114082  0.420602  1
  Al  Al42  1  0.837575  0.110079  0.753857  1
  Al  Al43  1  0.834817  0.362433  0.088055  1
  Al  Al44  1  0.835830  0.362275  0.421598  1
  Al  Al45  1  0.834675  0.362678  0.754832  1
  Al  Al46  1  0.833535  0.613123  0.089017  1
  Al  Al47  1  0.833607  0.612676  0.422315  1
  Al  Al48  1  0.833707  0.612788  0.755690  1
  Al  Al49  1  0.586238  -0.089666  0.361417  1
  Al  Al50  1  0.593813  -0.084799  0.695940  1
  Al  Al51  1  0.590892  -0.087014  1.028939  1
  Al  Al52  1  0.602852  0.163859  0.365639  1
  Al  Al53  1  0.594692  0.159248  0.699285  1
  Al  Al54  1  0.601866  0.160647  1.031922  1
  Al  Al55  1  0.592842  0.411091  0.365976  1
  Al  Al56  1  0.592959  0.411478  0.699716  1
  Al  Al57  1  0.594757  0.411614  1.032818  1
  Al  Al58  1  0.588331  0.661624  0.366995  1
  Al  Al59  1  0.590654  0.661613  0.700446  1
  Al  Al60  1  0.582979  0.661967  1.034136  1
  Al  Al61  1  1.086069  -0.090209  0.362113  1
  Al  Al62  1  1.093249  -0.084772  0.696439  1
  Al  Al63  1  1.090267  -0.086900  1.029648  1
  Al  Al64  1  1.101678  0.163497  0.365947  1
  Al  Al65  1  1.095716  0.159494  0.698944  1
  Al  Al66  1  1.101433  0.160476  1.031204  1
  Al  Al67  1  1.093621  0.411186  0.366492  1
  Al  Al68  1  1.093942  0.411698  0.699408  1
  Al  Al69  1  1.093617  0.411312  1.033120  1
  Al  Al70  1  1.088649  0.661782  0.367312  1
  Al  Al71  1  1.091136  0.661753  0.700218  1
  Al  Al72  1  1.082205  0.662107  1.033355  1
  Al  Al73  1  0.579250  -0.089072  0.139735  1
  Al  Al74  1  0.594808  -0.086784  0.472168  1
  Al  Al75  1  0.588817  -0.085576  0.807447  1
  Al  Al76  1  0.594609  0.162638  0.142804  1
  Al  Al77  1  0.591859  0.162253  0.476529  1
  Al  Al78  1  0.585667  0.159274  0.810011  1
  Al  Al79  1  0.582259  0.411253  0.143488  1
  Al  Al80  1  0.583079  0.411135  0.476691  1
  Al  Al81  1  0.583514  0.412117  0.810783  1
  Al  Al82  1  0.583934  0.662373  0.145099  1
  Al  Al83  1  0.583002  0.661605  0.477651  1
  Al  Al84  1  0.582989  0.662204  0.811521  1
  Al  Al85  1  1.078049  -0.088462  0.140255  1
  Al  Al86  1  1.096331  -0.087889  0.473105  1
  Al  Al87  1  1.088695  -0.085630  0.807645  1
  Al  Al88  1  1.094266  0.162135  0.141881  1
  Al  Al89  1  1.092079  0.162535  0.477101  1
  Al  Al90  1  1.085839  0.158955  0.809317  1
  Al  Al91  1  1.082632  0.411562  0.144140  1
  Al  Al92  1  1.082997  0.411597  0.477444  1
  Al  Al93  1  1.083314  0.411645  0.810100  1
  Al  Al94  1  1.084235  0.662010  0.144179  1
  Al  Al95  1  1.082646  0.661936  0.478271  1
  Al  Al96  1  1.082812  0.661875  0.810845  1
  Al  Al97  1  0.598564  -0.090925  0.250590  1
  Al  Al98  1  0.580136  -0.085254  0.583821  1
  Al  Al99  1  0.587355  -0.087262  0.918299  1
  Al  Al100  1  0.591011  0.163929  0.253860  1
  Al  Al101  1  0.585686  0.160408  0.587724  1
  Al  Al102  1  0.581777  0.159386  0.920654  1
  Al  Al103  1  0.580683  0.410937  0.254556  1
  Al  Al104  1  0.580057  0.411088  0.587923  1
  Al  Al105  1  0.580331  0.411803  0.921660  1
  Al  Al106  1  0.585642  0.662050  0.255845  1
  Al  Al107  1  0.579666  0.661382  0.588723  1
  Al  Al108  1  0.581677  0.662178  0.922647  1
  Al  Al109  1  1.100448  -0.090284  0.250640  1
  Al  Al110  1  1.080050  -0.085135  0.584568  1
  Al  Al111  1  1.087763  -0.087887  0.918524  1
  Al  Al112  1  1.090846  0.163221  0.253449  1
  Al  Al113  1  1.085678  0.160674  0.587909  1
  Al  Al114  1  1.083017  0.159144  0.919980  1
  Al  Al115  1  1.080342  0.411167  0.255095  1
  Al  Al116  1  1.079591  0.411551  0.588310  1
  Al  Al117  1  1.080432  0.411371  0.921359  1
  Al  Al118  1  1.085157  0.661405  0.255556  1
  Al  Al119  1  1.078993  0.661707  0.589100  1
  Al  Al120  1  1.081874  0.661841  0.921902  1
  Al  Al121  1  0.341293  -0.139429  0.306937  1
  Al  Al122  1  0.337439  -0.133859  0.640367  1
  Al  Al123  1  0.337068  -0.136680  0.973206  1
  Al  Al124  1  0.350078  0.115248  0.309876  1
  Al  Al125  1  0.338895  0.110773  0.642525  1
  Al  Al126  1  0.339806  0.110670  0.976501  1
  Al  Al127  1  0.335952  0.361882  0.310482  1
  Al  Al128  1  0.335539  0.362367  0.643850  1
  Al  Al129  1  0.336916  0.362437  0.977168  1
  Al  Al130  1  0.335913  0.612614  0.311253  1
  Al  Al131  1  0.334860  0.612555  0.644694  1
  Al  Al132  1  0.334367  0.612870  0.978045  1
  Al  Al133  1  0.841202  -0.139473  0.306854  1
  Al  Al134  1  0.837575  -0.134011  0.640437  1
  Al  Al135  1  0.836583  -0.136619  0.973164  1
  Al  Al136  1  0.847529  0.115055  0.309620  1
  Al  Al137  1  0.839424  0.110884  0.642596  1
  Al  Al138  1  0.839087  0.110798  0.976775  1
  Al  Al139  1  0.836128  0.362038  0.310542  1
  Al  Al140  1  0.836174  0.362278  0.643934  1
  Al  Al141  1  0.835990  0.362386  0.977082  1
  Al  Al142  1  0.835743  0.612588  0.311305  1
  Al  Al143  1  0.835439  0.612456  0.644708  1
  Al  Al144  1  0.833840  0.612936  0.977963  1
  H  H145  1  0.226798  0.782363  0.087938  1
  H  H146  1  0.434278  0.784927  0.429520  1
  H  H147  1  0.443717  0.782874  0.757613  1
  H  H148  1  0.250836  0.029563  0.106140  1
  H  H149  1  0.366094  0.041494  0.416259  1
  H  H150  1  0.419948  0.026009  0.771371  1
  H  H151  1  0.423793  0.282283  0.095496  1
  H  H152  1  0.431372  0.284342  0.430373  1
  H  H153  1  0.448753  0.279957  0.759559  1
  H  H154  1  0.445250  0.534941  0.095057  1
  H  H155  1  0.457580  0.532037  0.423835  1
  H  H156  1  0.446955  0.529794  0.759912  1
  H  H157  1  0.763345  0.780980  0.097766  1
  H  H158  1  0.941849  0.781248  0.428859  1
  H  H159  1  0.912597  0.790008  0.758438  1
  H  H160  1  0.785474  0.032387  0.104904  1
  H  H161  1  0.877517  0.041110  0.415643  1
  H  H162  1  0.941512  0.026712  0.763195  1
  H  H163  1  0.959136  0.281516  0.088336  1
  H  H164  1  0.949851  0.278729  0.427578  1
  H  H165  1  0.926725  0.285730  0.761509  1
  H  H166  1  0.941045  0.530382  0.094797  1
  H  H167  1  0.922464  0.532081  0.432179  1
  H  H168  1  0.931598  0.535331  0.762684  1
  H  H169  1  0.330830  -0.047579  0.143061  1
  H  H170  1  0.334450  -0.048719  0.436350  1
  H  H171  1  0.338827  -0.045213  0.784390  1
  H  H172  1  0.341789  0.202784  0.117138  1
  H  H173  1  0.341384  0.202041  0.446013  1
  H  H174  1  0.333911  0.199960  0.787867  1
  H  H175  1  0.332258  0.450837  0.112693  1
  H  H176  1  0.333355  0.450951  0.447902  1
  H  H177  1  0.331194  0.452584  0.787991  1
  H  H178  1  0.334582  0.701643  0.113468  1
  H  H179  1  0.333204  0.701335  0.448479  1
  H  H180  1  0.331862  0.702737  0.788654  1
  H  H181  1  0.807506  -0.046231  0.144117  1
  H  H182  1  0.866964  -0.046472  0.477905  1
  H  H183  1  0.841408  -0.045761  0.779947  1
  H  H184  1  0.844355  0.201715  0.112655  1
  H  H185  1  0.839188  0.203286  0.454939  1
  H  H186  1  0.835628  0.198577  0.778785  1
  H  H187  1  0.830658  0.452152  0.121450  1
  H  H188  1  0.830906  0.452062  0.452775  1
  H  H189  1  0.833398  0.451240  0.779070  1
  H  H190  1  0.835581  0.702807  0.121291  1
  H  H191  1  0.831169  0.702557  0.454299  1
  H  H192  1  0.833200  0.701304  0.779094  1
  H  H193  1  0.591094  -0.168876  0.137466  1
  H  H194  1  0.584073  -0.167122  0.476168  1
  H  H195  1  0.585528  -0.166390  0.805057  1
  H  H196  1  0.595585  0.081709  0.144108  1
  H  H197  1  0.594171  0.081660  0.474764  1
  H  H198  1  0.584391  0.078647  0.808745  1
  H  H199  1  0.581422  0.331240  0.143294  1
  H  H200  1  0.581348  0.331653  0.477394  1
  H  H201  1  0.581442  0.331225  0.810005  1
  H  H202  1  0.580401  0.582282  0.144641  1
  H  H203  1  0.577444  0.581543  0.477607  1
  H  H204  1  0.579701  0.581464  0.810959  1
  H  H205  1  1.092145  -0.168954  0.137958  1
  H  H206  1  1.083670  -0.167582  0.475569  1
  H  H207  1  1.086652  -0.165472  0.805496  1
  H  H208  1  1.100750  0.081966  0.143659  1
  H  H209  1  1.091881  0.081977  0.474716  1
  H  H210  1  1.082500  0.078699  0.809064  1
  H  H211  1  1.077351  0.331109  0.143174  1
  H  H212  1  1.080156  0.330819  0.476697  1
  H  H213  1  1.081591  0.332077  0.810683  1
  H  H214  1  1.080093  0.581647  0.143969  1
  H  H215  1  1.080449  0.581604  0.477466  1
  H  H216  1  1.080592  0.582273  0.811703  1
  H  H217  1  0.339121  0.019064  0.209746  1
  H  H218  1  0.271818  0.012351  0.522935  1
  H  H219  1  0.286955  0.012223  0.871286  1
  H  H220  1  0.302238  0.265107  0.194513  1
  H  H221  1  0.346839  0.263808  0.527165  1
  H  H222  1  0.300717  0.265280  0.860464  1
  H  H223  1  0.352759  0.514949  0.192462  1
  H  H224  1  0.351677  0.515413  0.524462  1
  H  H225  1  0.298322  0.515251  0.861709  1
  H  H226  1  0.329963  0.764131  0.188289  1
  H  H227  1  0.352211  0.766488  0.527668  1
  H  H228  1  0.297912  0.767202  0.858424  1
  H  H229  1  0.801151  0.022819  0.208924  1
  H  H230  1  0.808164  0.011953  0.519706  1
  H  H231  1  0.829296  0.010875  0.865636  1
  H  H232  1  0.854335  0.264717  0.188969  1
  H  H233  1  0.796797  0.264577  0.528837  1
  H  H234  1  0.860281  0.264898  0.858919  1
  H  H235  1  0.795778  0.515106  0.195295  1
  H  H236  1  0.798358  0.514726  0.530516  1
  H  H237  1  0.851066  0.514805  0.860182  1
  H  H238  1  0.871365  0.763111  0.195139  1
  H  H239  1  0.796225  0.766739  0.529979  1
  H  H240  1  0.854677  0.766190  0.854924  1
  H  H241  1  0.355565  0.782473  0.388695  1
  H  H242  1  0.329748  0.785426  0.721867  1
  H  H243  1  0.349099  0.783887  1.053398  1
  H  H244  1  0.343429  0.034539  0.372459  1
  H  H245  1  0.363626  0.032573  0.729845  1
  H  H246  1  0.354631  0.033010  0.068981  1
  H  H247  1  0.365430  0.282742  0.388187  1
  H  H248  1  0.336138  0.282163  0.723449  1
  H  H249  1  0.374141  0.281428  1.052005  1
  H  H250  1  0.334441  0.532548  0.389413  1
  H  H251  1  0.337699  0.532142  0.723320  1
  H  H252  1  0.358132  0.533384  0.055046  1
  H  H253  1  0.838833  0.782254  0.390958  1
  H  H254  1  0.859858  0.786578  0.715401  1
  H  H255  1  0.809450  0.782861  1.054152  1
  H  H256  1  0.870609  0.034460  0.371653  1
  H  H257  1  0.838271  0.032126  0.726707  1
  H  H258  1  0.833121  0.032407  0.061440  1
  H  H259  1  0.838485  0.281772  0.391598  1
  H  H260  1  0.862956  0.283026  0.719241  1
  H  H261  1  0.836602  0.282234  1.053797  1
  H  H262  1  0.872475  0.532050  0.388676  1
  H  H263  1  0.863737  0.533263  0.720674  1
  H  H264  1  0.845269  0.532239  0.056058  1
  H  H265  1  0.591508  -0.169817  0.363625  1
  H  H266  1  0.586455  -0.165978  0.695553  1
  H  H267  1  0.587527  -0.168219  1.027347  1
  H  H268  1  0.601445  0.083108  0.364147  1
  H  H269  1  0.590155  0.079216  0.696749  1
  H  H270  1  0.591680  0.079944  1.032993  1
  H  H271  1  0.589709  0.330741  0.365891  1
  H  H272  1  0.586014  0.330723  0.699476  1
  H  H273  1  0.587566  0.331034  1.032246  1
  H  H274  1  0.586771  0.580906  0.366707  1
  H  H275  1  0.585460  0.580901  0.700317  1
  H  H276  1  0.588213  0.581534  1.033279  1
  H  H277  1  1.089886  -0.170034  0.363994  1
  H  H278  1  1.091731  -0.165445  0.695295  1
  H  H279  1  1.085742  -0.168764  1.027736  1
  H  H280  1  1.100993  0.083736  0.363996  1
  H  H281  1  1.090153  0.078933  0.697523  1
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  H  H571  1  1.077827  0.454327  0.424014  1
  H  H572  1  1.099457  0.454743  0.757018  1
  H  H573  1  1.074132  0.705084  0.090810  1
  H  H574  1  1.077187  0.704804  0.425131  1
  H  H575  1  1.100081  0.704894  0.757495  1
