# generated using pymatgen
data_Al144H431
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57516992
_cell_length_b   44.21389135
_cell_length_c   24.09748371
_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   5940.02869921
_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  0.334005  -0.138177  0.196413  1
  Al  Al2  1  0.330465  -0.137361  0.530597  1
  Al  Al3  1  0.332275  -0.135424  0.863476  1
  Al  Al4  1  0.348427  0.113191  0.195049  1
  Al  Al5  1  0.337022  0.109891  0.530538  1
  Al  Al6  1  0.333548  0.109452  0.863671  1
  Al  Al7  1  0.333321  0.361250  0.197824  1
  Al  Al8  1  0.332503  0.361416  0.531081  1
  Al  Al9  1  0.331873  0.361122  0.864418  1
  Al  Al10  1  0.336501  0.612834  0.197568  1
  Al  Al11  1  0.335480  0.613297  0.530857  1
  Al  Al12  1  0.336467  0.612822  0.864146  1
  Al  Al13  1  0.833087  -0.138189  0.196237  1
  Al  Al14  1  0.831668  -0.137439  0.530689  1
  Al  Al15  1  0.831808  -0.135466  0.863445  1
  Al  Al16  1  0.846936  0.113306  0.194950  1
  Al  Al17  1  0.836712  0.109976  0.530519  1
  Al  Al18  1  0.833700  0.109516  0.863651  1
  Al  Al19  1  0.832558  0.361348  0.197715  1
  Al  Al20  1  0.832982  0.361387  0.531154  1
  Al  Al21  1  0.832376  0.361116  0.864384  1
  Al  Al22  1  0.835420  0.612849  0.197612  1
  Al  Al23  1  0.836581  0.613219  0.530801  1
  Al  Al24  1  0.836540  0.612861  0.864182  1
  Al  Al25  1  0.335819  -0.136864  0.084914  1
  Al  Al26  1  0.330552  -0.138276  0.419048  1
  Al  Al27  1  0.334843  -0.135697  0.752211  1
  Al  Al28  1  0.344016  0.111094  0.084868  1
  Al  Al29  1  0.340013  0.109664  0.418703  1
  Al  Al30  1  0.335692  0.109314  0.752461  1
  Al  Al31  1  0.335242  0.361423  0.086436  1
  Al  Al32  1  0.334412  0.361495  0.419672  1
  Al  Al33  1  0.334001  0.361441  0.752991  1
  Al  Al34  1  0.337829  0.612930  0.086257  1
  Al  Al35  1  0.336854  0.613376  0.419452  1
  Al  Al36  1  0.337411  0.613122  0.752787  1
  Al  Al37  1  0.835271  -0.136926  0.084804  1
  Al  Al38  1  0.830972  -0.138209  0.419166  1
  Al  Al39  1  0.833857  -0.135780  0.752237  1
  Al  Al40  1  0.844189  0.111160  0.084794  1
  Al  Al41  1  0.839970  0.109725  0.418685  1
  Al  Al42  1  0.836546  0.109386  0.752451  1
  Al  Al43  1  0.834284  0.361350  0.086308  1
  Al  Al44  1  0.835273  0.361557  0.419795  1
  Al  Al45  1  0.833326  0.361389  0.753013  1
  Al  Al46  1  0.837654  0.612942  0.086226  1
  Al  Al47  1  0.837480  0.613327  0.419531  1
  Al  Al48  1  0.837660  0.613196  0.752706  1
  Al  Al49  1  0.577091  -0.089848  0.363610  1
  Al  Al50  1  0.591127  -0.086967  0.696767  1
  Al  Al51  1  0.593648  -0.087401  1.030579  1
  Al  Al52  1  0.599537  0.160002  0.364120  1
  Al  Al53  1  0.592142  0.158246  0.696960  1
  Al  Al54  1  0.597015  0.159656  1.029915  1
  Al  Al55  1  0.591686  0.410416  0.364595  1
  Al  Al56  1  0.590040  0.410255  0.697610  1
  Al  Al57  1  0.591500  0.410163  1.031251  1
  Al  Al58  1  0.594145  0.662213  0.364021  1
  Al  Al59  1  0.594462  0.662051  0.697470  1
  Al  Al60  1  0.593357  0.661663  1.031289  1
  Al  Al61  1  1.077694  -0.089871  0.363732  1
  Al  Al62  1  1.090190  -0.087091  0.696606  1
  Al  Al63  1  1.093803  -0.087452  1.030440  1
  Al  Al64  1  1.099297  0.159692  0.364535  1
  Al  Al65  1  1.092716  0.158363  0.697400  1
  Al  Al66  1  1.097995  0.159827  1.029350  1
  Al  Al67  1  1.091398  0.410332  0.364560  1
  Al  Al68  1  1.090157  0.410316  0.698054  1
  Al  Al69  1  1.091260  0.410148  1.030869  1
  Al  Al70  1  1.093192  0.661984  0.364453  1
  Al  Al71  1  1.094967  0.662138  0.697821  1
  Al  Al72  1  1.094296  0.661851  1.030789  1
  Al  Al73  1  0.582788  -0.088533  0.141071  1
  Al  Al74  1  0.582451  -0.088808  0.474686  1
  Al  Al75  1  0.584135  -0.086636  0.808027  1
  Al  Al76  1  0.594942  0.161744  0.140600  1
  Al  Al77  1  0.587512  0.158544  0.474363  1
  Al  Al78  1  0.584721  0.158362  0.807451  1
  Al  Al79  1  0.583227  0.410462  0.142133  1
  Al  Al80  1  0.582231  0.410465  0.475327  1
  Al  Al81  1  0.581910  0.410305  0.808717  1
  Al  Al82  1  0.586955  0.662157  0.142233  1
  Al  Al83  1  0.586091  0.662188  0.474696  1
  Al  Al84  1  0.586658  0.661866  0.808288  1
  Al  Al85  1  1.082674  -0.088452  0.141469  1
  Al  Al86  1  1.082089  -0.088860  0.474349  1
  Al  Al87  1  1.084152  -0.086768  0.807456  1
  Al  Al88  1  1.095007  0.161314  0.139689  1
  Al  Al89  1  1.087750  0.158831  0.475086  1
  Al  Al90  1  1.084718  0.158714  0.808044  1
  Al  Al91  1  1.083350  0.410265  0.141843  1
  Al  Al92  1  1.082318  0.410520  0.475505  1
  Al  Al93  1  1.081829  0.410309  0.808747  1
  Al  Al94  1  1.086863  0.661746  0.141457  1
  Al  Al95  1  1.086133  0.662553  0.475505  1
  Al  Al96  1  1.086581  0.662135  0.808719  1
  Al  Al97  1  0.588190  -0.089666  0.251562  1
  Al  Al98  1  0.582548  -0.087968  0.585405  1
  Al  Al99  1  0.576868  -0.086179  0.919494  1
  Al  Al100  1  0.594748  0.162069  0.252008  1
  Al  Al101  1  0.584584  0.158483  0.585644  1
  Al  Al102  1  0.583604  0.158712  0.918373  1
  Al  Al103  1  0.581811  0.410120  0.253127  1
  Al  Al104  1  0.582940  0.410897  0.585885  1
  Al  Al105  1  0.581549  0.409827  0.919769  1
  Al  Al106  1  0.584584  0.662032  0.252928  1
  Al  Al107  1  0.584984  0.661976  0.585860  1
  Al  Al108  1  0.585966  0.661643  0.919515  1
  Al  Al109  1  1.087071  -0.089854  0.252509  1
  Al  Al110  1  1.082250  -0.087844  0.585375  1
  Al  Al111  1  1.076779  -0.086559  0.918843  1
  Al  Al112  1  1.095397  0.161536  0.251655  1
  Al  Al113  1  1.084077  0.158669  0.586157  1
  Al  Al114  1  1.083366  0.158909  0.918525  1
  Al  Al115  1  1.082616  0.410340  0.252992  1
  Al  Al116  1  1.082229  0.410090  0.586586  1
  Al  Al117  1  1.082203  0.410548  0.919253  1
  Al  Al118  1  1.084780  0.661648  0.252666  1
  Al  Al119  1  1.084329  0.662300  0.586413  1
  Al  Al120  1  1.085684  0.661725  0.919577  1
  Al  Al121  1  0.333743  -0.138833  0.307675  1
  Al  Al122  1  0.335594  -0.136469  0.641465  1
  Al  Al123  1  0.335987  -0.135903  0.973996  1
  Al  Al124  1  0.351750  0.112813  0.306992  1
  Al  Al125  1  0.337515  0.109302  0.641424  1
  Al  Al126  1  0.338316  0.110000  0.974532  1
  Al  Al127  1  0.336247  0.361236  0.308744  1
  Al  Al128  1  0.335906  0.361409  0.641942  1
  Al  Al129  1  0.335734  0.361149  0.975315  1
  Al  Al130  1  0.339637  0.612973  0.308510  1
  Al  Al131  1  0.339634  0.613152  0.641818  1
  Al  Al132  1  0.340318  0.612757  0.975172  1
  Al  Al133  1  0.833243  -0.138712  0.307639  1
  Al  Al134  1  0.835613  -0.136559  0.641462  1
  Al  Al135  1  0.835832  -0.135966  0.974042  1
  Al  Al136  1  0.849975  0.113049  0.306949  1
  Al  Al137  1  0.838099  0.109383  0.641476  1
  Al  Al138  1  0.838153  0.110106  0.974569  1
  Al  Al139  1  0.836417  0.361389  0.308717  1
  Al  Al140  1  0.835248  0.361347  0.641993  1
  Al  Al141  1  0.836527  0.361120  0.975328  1
  Al  Al142  1  0.839000  0.612943  0.308536  1
  Al  Al143  1  0.840138  0.613139  0.641748  1
  Al  Al144  1  0.840297  0.612765  0.975237  1
  H  H145  1  0.442095  0.780691  0.089184  1
  H  H146  1  0.424859  0.784559  0.426467  1
  H  H147  1  0.456194  0.783832  0.754763  1
  H  H148  1  0.275571  0.026061  0.109675  1
  H  H149  1  0.347553  0.057000  0.399169  1
  H  H150  1  0.423366  0.027062  0.764385  1
  H  H151  1  0.445391  0.279462  0.089380  1
  H  H152  1  0.425504  0.284142  0.426203  1
  H  H153  1  0.452420  0.281137  0.753496  1
  H  H154  1  0.433726  0.532657  0.091242  1
  H  H155  1  0.429665  0.534951  0.422945  1
  H  H156  1  0.441041  0.533373  0.755100  1
  H  H157  1  0.921794  0.785732  0.091422  1
  H  H158  1  0.942997  0.779312  0.424683  1
  H  H159  1  0.923600  0.784024  0.762399  1
  H  H160  1  0.791189  0.027942  0.116009  1
  H  H161  1  0.866102  0.056876  0.401599  1
  H  H162  1  0.943060  0.028604  0.756260  1
  H  H163  1  0.924271  0.283827  0.091061  1
  H  H164  1  0.946937  0.279046  0.424868  1
  H  H165  1  0.920230  0.281676  0.760419  1
  H  H166  1  0.942290  0.534263  0.087392  1
  H  H167  1  0.948297  0.532881  0.421464  1
  H  H168  1  0.934394  0.534338  0.755232  1
  H  H169  1  0.333800  -0.049268  0.109198  1
  H  H170  1  0.330811  -0.048065  0.454245  1
  H  H171  1  0.333623  -0.046541  0.781390  1
  H  H172  1  0.343216  0.202074  0.117583  1
  H  H173  1  0.337230  0.198396  0.443994  1
  H  H174  1  0.334893  0.198227  0.778793  1
  H  H175  1  0.331924  0.450996  0.117235  1
  H  H176  1  0.331538  0.450282  0.446091  1
  H  H177  1  0.330680  0.450842  0.784778  1
  H  H178  1  0.335249  0.702691  0.119366  1
  H  H179  1  0.335740  0.701784  0.443769  1
  H  H180  1  0.336615  0.701662  0.779203  1
  H  H181  1  0.830297  -0.047697  0.119761  1
  H  H182  1  0.832677  -0.049662  0.441986  1
  H  H183  1  0.835085  -0.046818  0.780023  1
  H  H184  1  0.844412  0.200695  0.108645  1
  H  H185  1  0.835677  0.199612  0.452743  1
  H  H186  1  0.833257  0.199227  0.783091  1
  H  H187  1  0.833436  0.450095  0.113226  1
  H  H188  1  0.830889  0.451071  0.451817  1
  H  H189  1  0.831193  0.450176  0.779605  1
  H  H190  1  0.836970  0.701379  0.110573  1
  H  H191  1  0.834367  0.703053  0.452295  1
  H  H192  1  0.835223  0.702721  0.784073  1
  H  H193  1  0.581525  -0.168754  0.138999  1
  H  H194  1  0.577581  -0.168397  0.475679  1
  H  H195  1  0.578549  -0.166745  0.807809  1
  H  H196  1  0.596523  0.080311  0.140758  1
  H  H197  1  0.587895  0.078961  0.476726  1
  H  H198  1  0.582403  0.078198  0.807691  1
  H  H199  1  0.580535  0.330107  0.141517  1
  H  H200  1  0.580860  0.330815  0.475318  1
  H  H201  1  0.578004  0.330168  0.808127  1
  H  H202  1  0.583422  0.581860  0.141366  1
  H  H203  1  0.581293  0.582462  0.474885  1
  H  H204  1  0.583713  0.582038  0.807779  1
  H  H205  1  1.082560  -0.168064  0.139561  1
  H  H206  1  1.077559  -0.169036  0.474889  1
  H  H207  1  1.080821  -0.166513  0.807641  1
  H  H208  1  1.094115  0.080155  0.140992  1
  H  H209  1  1.086315  0.079327  0.477039  1
  H  H210  1  1.080800  0.078236  0.807928  1
  H  H211  1  1.080038  0.330640  0.141963  1
  H  H212  1  1.080626  0.330174  0.474756  1
  H  H213  1  1.080124  0.330385  0.808017  1
  H  H214  1  1.082118  0.581956  0.141691  1
  H  H215  1  1.083645  0.582249  0.474575  1
  H  H216  1  1.081634  0.582098  0.807916  1
  H  H217  1  0.440380  0.021640  0.213812  1
  H  H218  1  0.295655  0.011925  0.520512  1
  H  H219  1  0.307833  0.011964  0.865033  1
  H  H220  1  0.308700  0.264382  0.191423  1
  H  H221  1  0.356390  0.263594  0.523835  1
  H  H222  1  0.352980  0.264682  0.854085  1
  H  H223  1  0.318325  0.515286  0.191643  1
  H  H224  1  0.366588  0.516508  0.522279  1
  H  H225  1  0.335358  0.516373  0.855971  1
  H  H226  1  0.298510  0.764771  0.190214  1
  H  H227  1  0.352147  0.764652  0.524418  1
  H  H228  1  0.349270  0.767288  0.854630  1
  H  H229  1  0.787213  0.019405  0.224730  1
  H  H230  1  0.833705  0.009458  0.512413  1
  H  H231  1  0.839521  0.010964  0.862139  1
  H  H232  1  0.854978  0.263296  0.189257  1
  H  H233  1  0.803033  0.264026  0.525673  1
  H  H234  1  0.807326  0.262979  0.859398  1
  H  H235  1  0.863333  0.516267  0.187686  1
  H  H236  1  0.831803  0.516751  0.522801  1
  H  H237  1  0.865938  0.516201  0.855461  1
  H  H238  1  0.846406  0.763709  0.188310  1
  H  H239  1  0.800780  0.765576  0.525997  1
  H  H240  1  0.802977  0.765880  0.860321  1
  H  H241  1  0.360433  0.782548  0.384300  1
  H  H242  1  0.336618  0.783790  0.719718  1
  H  H243  1  0.335717  0.783077  0.052212  1
  H  H244  1  0.353152  0.035466  0.367851  1
  H  H245  1  0.369671  0.030392  0.721674  1
  H  H246  1  0.363016  0.031908  0.071338  1
  H  H247  1  0.364448  0.281953  0.383828  1
  H  H248  1  0.334252  0.281028  0.718172  1
  H  H249  1  0.337863  0.280655  0.052380  1
  H  H250  1  0.364130  0.532802  0.380968  1
  H  H251  1  0.348249  0.532774  0.715758  1
  H  H252  1  0.359813  0.532383  1.049795  1
  H  H253  1  0.835743  0.781543  0.387822  1
  H  H254  1  0.872176  0.783495  0.719184  1
  H  H255  1  0.861806  0.784080  1.048832  1
  H  H256  1  0.881445  0.035977  0.369620  1
  H  H257  1  0.839129  0.029567  0.718594  1
  H  H258  1  0.841420  0.032937  0.073742  1
  H  H259  1  0.838363  0.281182  0.388195  1
  H  H260  1  0.869643  0.280952  0.717045  1
  H  H261  1  0.864170  0.281515  1.048619  1
  H  H262  1  0.842591  0.532835  0.383950  1
  H  H263  1  0.856365  0.532673  0.714356  1
  H  H264  1  0.847224  0.532491  1.048499  1
  H  H265  1  0.586432  -0.169651  0.363312  1
  H  H266  1  0.587268  -0.167860  0.697288  1
  H  H267  1  0.586082  -0.168199  1.028540  1
  H  H268  1  0.607033  0.073591  0.318841  1
  H  H269  1  0.589792  0.078152  0.696405  1
  H  H270  1  0.592167  0.078780  1.030560  1
  H  H271  1  0.589687  0.330153  0.363994  1
  H  H272  1  0.586680  0.329687  0.697350  1
  H  H273  1  0.586302  0.329538  1.030974  1
  H  H274  1  0.590794  0.581829  0.363984  1
  H  H275  1  0.590919  0.581596  0.697054  1
  H  H276  1  0.590961  0.581412  1.030560  1
  H  H277  1  1.082881  -0.170043  0.363547  1
  H  H278  1  1.087714  -0.167465  0.697118  1
  H  H279  1  1.089453  -0.167766  1.028254  1
  H  H280  1  1.101628  0.073485  0.315467  1
  H  H281  1  1.088962  0.077664  0.696780  1
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  H  H571  1  1.080034  0.453317  0.422289  1
  H  H572  1  1.091482  0.453297  0.756016  1
  H  H573  1  1.101442  0.704745  0.088389  1
  H  H574  1  1.079665  0.705122  0.421724  1
  H  H575  1  1.080513  0.705014  0.755709  1
