# generated using pymatgen
data_AlH3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.98274495
_cell_length_b   24.76216416
_cell_length_c   48.27448137
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlH3
_chemical_formula_sum   'Al108 H324'
_cell_volume   8347.03807178
_cell_formula_units_Z   108
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  0.595015  0.482647  0.358295  1
  Al  Al2  1  0.521044  0.227051  0.324481  1
  Al  Al3  1  0.572913  0.899398  0.327500  1
  Al  Al4  1  0.973453  0.477124  0.358209  1
  Al  Al5  1  0.898055  0.220488  0.319767  1
  Al  Al6  1  0.970176  0.883728  0.330656  1
  Al  Al7  1  0.108083  0.306923  0.343588  1
  Al  Al8  1  0.246654  0.114466  0.320711  1
  Al  Al9  1  0.229447  0.754121  0.335812  1
  Al  Al10  1  0.716811  0.306931  0.348467  1
  Al  Al11  1  0.637604  0.125596  0.314823  1
  Al  Al12  1  0.607841  0.786077  0.340989  1
  Al  Al13  1  0.742070  0.178226  0.364164  1
  Al  Al14  1  0.980372  0.987998  0.325794  1
  Al  Al15  1  0.906141  0.630524  0.348822  1
  Al  Al16  1  0.197116  0.203065  0.351652  1
  Al  Al17  1  0.391087  1.000253  0.319417  1
  Al  Al18  1  0.285484  0.646502  0.347061  1
  Al  Al19  1  0.485648  0.299065  0.403585  1
  Al  Al20  1  0.478533  0.075918  0.360430  1
  Al  Al21  1  0.467594  0.714014  0.378448  1
  Al  Al22  1  0.959795  0.300229  0.399998  1
  Al  Al23  1  0.903559  0.084346  0.343402  1
  Al  Al24  1  0.039483  0.710703  0.378137  1
  Al  Al25  1  0.168865  0.158588  0.423286  1
  Al  Al26  1  0.224924  0.951104  0.362287  1
  Al  Al27  1  0.130945  0.567254  0.378933  1
  Al  Al28  1  0.662035  0.162146  0.418405  1
  Al  Al29  1  0.654790  0.981930  0.358565  1
  Al  Al30  1  0.719091  0.567971  0.383998  1
  Al  Al31  1  0.820640  0.032541  0.434922  1
  Al  Al32  1  0.763604  0.858128  0.373198  1
  Al  Al33  1  0.784582  0.424585  0.395916  1
  Al  Al34  1  0.330304  0.030241  0.435581  1
  Al  Al35  1  0.299535  0.849338  0.356481  1
  Al  Al36  1  0.349214  0.428503  0.390236  1
  Al  Al37  1  0.486054  0.113769  0.486158  1
  Al  Al38  1  0.486805  0.906434  0.441532  1
  Al  Al39  1  0.480894  0.509649  0.447382  1
  Al  Al40  1  0.985510  0.114654  0.485833  1
  Al  Al41  1  -0.003857  0.902541  0.438419  1
  Al  Al42  1  -0.006047  0.506995  0.446810  1
  Al  Al43  1  0.155082  0.981533  0.495849  1
  Al  Al44  1  0.144120  0.774967  0.443988  1
  Al  Al45  1  0.148176  0.376292  0.458774  1
  Al  Al46  1  0.657039  0.980988  0.496352  1
  Al  Al47  1  0.667766  0.774150  0.443465  1
  Al  Al48  1  0.648353  0.373762  0.459735  1
  Al  Al49  1  0.823893  0.849038  0.501307  1
  Al  Al50  1  0.817622  0.644718  0.443130  1
  Al  Al51  1  0.810384  0.245687  0.472677  1
  Al  Al52  1  0.323050  0.848357  0.501159  1
  Al  Al53  1  0.343064  0.643691  0.441757  1
  Al  Al54  1  0.314309  0.246121  0.472660  1
  Al  Al55  1  0.496715  0.923685  0.558569  1
  Al  Al56  1  0.494489  0.718064  0.502767  1
  Al  Al57  1  0.471831  0.327447  0.526079  1
  Al  Al58  1  0.983818  0.927052  0.557744  1
  Al  Al59  1  0.988671  0.716683  0.503154  1
  Al  Al60  1  0.977249  0.322943  0.523455  1
  Al  Al61  1  0.163995  0.791466  0.562639  1
  Al  Al62  1  0.153929  0.586435  0.504093  1
  Al  Al63  1  0.142005  0.194896  0.538930  1
  Al  Al64  1  0.660670  0.792921  0.564010  1
  Al  Al65  1  0.652614  0.586690  0.504184  1
  Al  Al66  1  0.637625  0.196120  0.537410  1
  Al  Al67  1  0.823954  0.658605  0.564885  1
  Al  Al68  1  0.817717  0.455036  0.512016  1
  Al  Al69  1  0.819436  0.064538  0.551597  1
  Al  Al70  1  0.323225  0.663436  0.558526  1
  Al  Al71  1  0.312113  0.456549  0.511395  1
  Al  Al72  1  0.308707  0.063660  0.550347  1
  Al  Al73  1  0.536488  0.714358  0.633269  1
  Al  Al74  1  0.471370  0.525267  0.566883  1
  Al  Al75  1  0.476624  0.143221  0.606077  1
  Al  Al76  1  0.943938  0.738126  0.630889  1
  Al  Al77  1  0.985965  0.536965  0.565635  1
  Al  Al78  1  0.964350  0.147345  0.603823  1
  Al  Al79  1  0.086271  0.589928  0.638141  1
  Al  Al80  1  0.140602  0.404945  0.580397  1
  Al  Al81  1  0.168075  1.001196  0.614543  1
  Al  Al82  1  0.669360  0.595442  0.640561  1
  Al  Al83  1  0.639896  0.409939  0.575248  1
  Al  Al84  1  0.623516  1.011398  0.613839  1
  Al  Al85  1  0.894278  0.495014  0.633593  1
  Al  Al86  1  0.784618  0.261180  0.599982  1
  Al  Al87  1  0.853547  0.855333  0.623996  1
  Al  Al88  1  0.309337  0.490476  0.635689  1
  Al  Al89  1  0.290893  0.273914  0.593193  1
  Al  Al90  1  0.280405  0.874397  0.624249  1
  Al  Al91  1  0.592510  0.577025  0.692212  1
  Al  Al92  1  0.475019  0.386699  0.623422  1
  Al  Al93  1  0.413258  0.960523  0.651348  1
  Al  Al94  1  0.155226  0.567064  0.688216  1
  Al  Al95  1  0.962459  0.355191  0.643498  1
  Al  Al96  1  0.032837  0.932799  0.652700  1
  Al  Al97  1  0.391093  0.488832  0.688786  1
  Al  Al98  1  0.295172  0.300292  0.648094  1
  Al  Al99  1  0.091504  0.817036  0.662020  1
  Al  Al100  1  0.795766  0.486804  0.684401  1
  Al  Al101  1  0.644632  0.243833  0.652837  1
  Al  Al102  1  0.701560  0.791893  0.662359  1
  Al  Al103  1  0.607269  0.351141  0.670457  1
  Al  Al104  1  0.730915  0.097629  0.642162  1
  Al  Al105  1  0.775736  0.678918  0.671443  1
  Al  Al106  1  0.244875  0.400517  0.669857  1
  Al  Al107  1  0.362085  0.071040  0.643632  1
  Al  Al108  1  0.371706  0.650413  0.669603  1
  H  H109  1  0.574932  0.476577  0.310857  1
  H  H110  1  0.695689  0.030009  0.316223  1
  H  H111  1  0.589052  0.619242  0.347625  1
  H  H112  1  0.936223  0.248501  0.363639  1
  H  H113  1  0.915390  0.937122  0.367597  1
  H  H114  1  0.706847  0.764167  0.293548  1
  H  H115  1  0.762702  0.411195  0.342813  1
  H  H116  1  0.700727  0.194309  0.286048  1
  H  H117  1  0.748184  0.836515  0.306013  1
  H  H118  1  0.696075  0.286236  0.301674  1
  H  H119  1  0.821463  0.933115  0.297695  1
  H  H120  1  0.784932  0.543537  0.337516  1
  H  H121  1  0.689987  0.448857  0.315895  1
  H  H122  1  0.852146  0.054155  0.295408  1
  H  H123  1  0.706082  0.698939  0.335967  1
  H  H124  1  0.922384  0.349250  0.315420  1
  H  H125  1  0.970470  0.015188  0.372095  1
  H  H126  1  0.832278  0.758207  0.284885  1
  H  H127  1  0.213148  0.248192  0.308342  1
  H  H128  1  0.086931  0.859674  0.290431  1
  H  H129  1  0.167392  0.719170  0.291711  1
  H  H130  1  0.452451  0.157750  0.348540  1
  H  H131  1  0.513560  0.976777  0.278718  1
  H  H132  1  0.383760  0.613455  0.303916  1
  H  H133  1  0.432941  0.516052  0.306127  1
  H  H134  1  0.439082  0.073179  0.288540  1
  H  H135  1  0.482512  0.707581  0.320445  1
  H  H136  1  0.376656  0.425085  0.343666  1
  H  H137  1  0.410569  0.170857  0.290321  1
  H  H138  1  0.414340  0.823013  0.309695  1
  H  H139  1  0.341115  0.306387  0.308582  1
  H  H140  1  0.259503  0.912836  0.316691  1
  H  H141  1  0.274627  0.747160  0.288051  1
  H  H142  1  0.410344  0.281654  0.357026  1
  H  H143  1  0.506712  0.910311  0.375445  1
  H  H144  1  0.438340  0.653841  0.303531  1
  H  H145  1  0.796322  0.605212  0.306339  1
  H  H146  1  0.946840  0.115673  0.296013  1
  H  H147  1  0.906583  0.742590  0.335330  1
  H  H148  1  0.061811  0.449130  0.315370  1
  H  H149  1  0.190404  0.040309  0.349303  1
  H  H150  1  0.102823  0.819576  0.302599  1
  H  H151  1  0.970442  0.304493  0.301023  1
  H  H152  1  0.148945  0.990967  0.288031  1
  H  H153  1  0.118441  0.575475  0.330371  1
  H  H154  1  0.034042  0.489483  0.312374  1
  H  H155  1  0.217692  0.047845  0.287524  1
  H  H156  1  0.081686  0.675499  0.315107  1
  H  H157  1  0.063557  0.166671  0.290633  1
  H  H158  1  -0.005550  0.807312  0.352592  1
  H  H159  1  0.880365  0.638384  0.301837  1
  H  H160  1  0.417883  0.555836  0.302097  1
  H  H161  1  0.166170  0.111092  0.366617  1
  H  H162  1  0.473344  0.935564  0.284957  1
  H  H163  1  0.493517  0.212173  0.389591  1
  H  H164  1  0.613480  0.842131  0.414090  1
  H  H165  1  0.545419  0.428926  0.426741  1
  H  H166  1  0.921055  0.106045  0.411995  1
  H  H167  1  0.898215  0.725549  0.423170  1
  H  H168  1  0.931443  0.509556  0.400613  1
  H  H169  1  0.733235  0.250935  0.426582  1
  H  H170  1  0.711072  0.036304  0.392041  1
  H  H171  1  0.742904  0.667627  0.384769  1
  H  H172  1  0.747351  0.099802  0.384602  1
  H  H173  1  0.752335  0.762832  0.382261  1
  H  H174  1  0.729879  0.347667  0.416786  1
  H  H175  1  0.707883  0.258083  0.385682  1
  H  H176  1  0.736733  0.910333  0.410893  1
  H  H177  1  0.738569  0.504162  0.421026  1
  H  H178  1  0.921630  0.206590  0.404062  1
  H  H179  1  0.903648  0.821712  0.423341  1
  H  H180  1  0.922415  0.632321  0.397239  1
  H  H181  1  0.256573  0.080281  0.398400  1
  H  H182  1  0.256409  0.713246  0.414280  1
  H  H183  1  0.277861  0.495119  0.353900  1
  H  H184  1  0.571666  0.979394  0.419015  1
  H  H185  1  0.508676  0.806975  0.385327  1
  H  H186  1  0.559938  0.368374  0.374623  1
  H  H187  1  0.424094  0.335915  0.326820  1
  H  H188  1  0.344568  0.898480  0.398724  1
  H  H189  1  0.354398  0.523201  0.402915  1
  H  H190  1  0.411283  0.218022  0.430053  1
  H  H191  1  0.399783  1.004868  0.389216  1
  H  H192  1  0.482158  0.623029  0.398955  1
  H  H193  1  0.401680  0.144074  0.392381  1
  H  H194  1  0.413089  0.767393  0.416752  1
  H  H195  1  0.435074  0.563886  0.355927  1
  H  H196  1  0.569377  0.076111  0.416897  1
  H  H197  1  0.592548  0.693924  0.422899  1
  H  H198  1  0.555853  0.494889  0.402108  1
  H  H199  1  0.921879  0.364555  0.367722  1
  H  H200  1  0.918900  0.965012  0.408291  1
  H  H201  1  0.946000  0.577005  0.418676  1
  H  H202  1  0.214837  0.239121  0.406187  1
  H  H203  1  0.252830  0.851182  0.425671  1
  H  H204  1  0.271586  0.643821  0.393691  1
  H  H205  1  0.034593  0.156914  0.382803  1
  H  H206  1  0.042692  0.791172  0.400822  1
  H  H207  1  0.072329  0.383664  0.411659  1
  H  H208  1  0.230292  0.272991  0.381271  1
  H  H209  1  0.067188  0.882431  0.388785  1
  H  H210  1  0.080006  0.465005  0.403084  1
  H  H211  1  0.075587  0.030321  0.405335  1
  H  H212  1  0.077973  0.666053  0.420205  1
  H  H213  1  0.165475  0.399945  0.350099  1
  H  H214  1  0.231313  0.345619  0.384112  1
  H  H215  1  0.240624  0.949178  0.420852  1
  H  H216  1  0.242911  0.779755  0.382882  1
  H  H217  1  0.576347  0.039231  0.463500  1
  H  H218  1  0.576267  0.649723  0.472584  1
  H  H219  1  0.560537  0.253728  0.502122  1
  H  H220  1  0.907232  0.929012  0.482854  1
  H  H221  1  0.901782  0.534346  0.490710  1
  H  H222  1  0.900585  0.320893  0.446974  1
  H  H223  1  0.735851  0.068877  0.505606  1
  H  H224  1  0.742624  0.858711  0.455964  1
  H  H225  1  0.734072  0.461985  0.466409  1
  H  H226  1  0.746664  0.953619  0.453478  1
  H  H227  1  0.740499  0.561631  0.460270  1
  H  H228  1  0.731662  0.168200  0.495336  1
  H  H229  1  0.739047  0.109076  0.456369  1
  H  H230  1  0.744090  0.711446  0.472853  1
  H  H231  1  0.720489  0.318005  0.495440  1
  H  H232  1  0.904073  0.028487  0.479195  1
  H  H233  1  0.906037  0.633092  0.487519  1
  H  H234  1  0.895102  0.420863  0.440490  1
  H  H235  1  0.233886  0.909099  0.469345  1
  H  H236  1  0.235495  0.516026  0.476825  1
  H  H237  1  0.224420  0.302648  0.433462  1
  H  H238  1  0.575235  0.798642  0.486746  1
  H  H239  1  0.585403  0.589270  0.427468  1
  H  H240  1  0.563667  0.191059  0.461765  1
  H  H241  1  0.419030  0.117248  0.440743  1
  H  H242  1  0.407903  0.727879  0.458015  1
  H  H243  1  0.392629  0.331779  0.479064  1
  H  H244  1  0.405255  0.034852  0.508195  1
  H  H245  1  0.406471  0.824515  0.456384  1
  H  H246  1  0.399013  0.429819  0.469022  1
  H  H247  1  0.407795  0.973976  0.467820  1
  H  H248  1  0.404553  0.580878  0.473716  1
  H  H249  1  0.395640  0.369440  0.428442  1
  H  H250  1  0.571645  0.895750  0.485834  1
  H  H251  1  0.568713  0.501110  0.492751  1
  H  H252  1  0.558580  0.288750  0.450899  1
  H  H253  1  0.903408  0.170986  0.449921  1
  H  H254  1  0.905256  0.779530  0.472830  1
  H  H255  1  0.899612  0.381152  0.488495  1
  H  H256  1  0.236556  0.060981  0.476554  1
  H  H257  1  0.242621  0.666900  0.486900  1
  H  H258  1  0.237867  0.454381  0.435078  1
  H  H259  1  0.074318  0.986427  0.450679  1
  H  H260  1  0.080221  0.595033  0.457794  1
  H  H261  1  0.063203  0.201669  0.492974  1
  H  H262  1  0.076859  0.083596  0.443977  1
  H  H263  1  0.079718  0.691855  0.459365  1
  H  H264  1  0.060467  0.298919  0.480450  1
  H  H265  1  0.072046  0.844211  0.471281  1
  H  H266  1  0.065031  0.449765  0.482165  1
  H  H267  1  0.065318  0.235370  0.444195  1
  H  H268  1  0.237345  0.159643  0.467771  1
  H  H269  1  0.240772  0.764839  0.487805  1
  H  H270  1  0.236647  0.560208  0.427076  1
  H  H271  1  0.573071  0.852715  0.531788  1
  H  H272  1  0.565788  0.461435  0.539993  1
  H  H273  1  0.560838  0.070909  0.576807  1
  H  H274  1  0.909603  0.740180  0.548234  1
  H  H275  1  0.892765  0.356195  0.564696  1
  H  H276  1  0.892871  0.141670  0.528303  1
  H  H277  1  0.748197  0.877894  0.577257  1
  H  H278  1  0.737496  0.669455  0.519597  1
  H  H279  1  0.723476  0.281419  0.545059  1
  H  H280  1  0.742358  0.768240  0.518848  1
  H  H281  1  0.730265  0.377517  0.534097  1
  H  H282  1  0.731319  0.982862  0.569736  1
  H  H283  1  0.739234  0.919826  0.528657  1
  H  H284  1  0.729468  0.526651  0.537452  1
  H  H285  1  0.723552  0.144948  0.572936  1
  H  H286  1  0.908822  0.839939  0.546487  1
  H  H287  1  0.902412  0.450435  0.558158  1
  H  H288  1  0.893374  0.238251  0.518134  1
  H  H289  1  0.242143  0.727863  0.530758  1
  H  H290  1  0.213680  0.328383  0.555215  1
  H  H291  1  0.232926  0.121363  0.515609  1
  H  H292  1  0.573485  0.607396  0.549712  1
  H  H293  1  0.562594  0.402567  0.502041  1
  H  H294  1  0.569858  1.007980  0.539448  1
  H  H295  1  0.404226  0.934270  0.513894  1
  H  H296  1  0.402120  0.540374  0.521574  1
  H  H297  1  0.391947  0.150396  0.558975  1
  H  H298  1  0.403691  0.844629  0.579079  1
  H  H299  1  0.403340  0.637935  0.516704  1
  H  H300  1  0.386375  0.249974  0.549429  1
  H  H301  1  0.415634  0.788401  0.533074  1
  H  H302  1  0.382032  0.402429  0.547637  1
  H  H303  1  0.391331  0.188282  0.508676  1
  H  H304  1  0.583673  0.708929  0.547528  1
  H  H305  1  0.583074  0.314239  0.570674  1
  H  H306  1  0.564575  0.108305  0.531387  1
  H  H307  1  0.905877  0.989817  0.525827  1
  H  H308  1  0.902227  0.594601  0.533673  1
  H  H309  1  0.889426  0.204336  0.568206  1
  H  H310  1  0.239656  0.873593  0.544812  1
  H  H311  1  0.219761  0.478809  0.554813  1
  H  H312  1  0.230371  0.271063  0.516282  1
  H  H313  1  0.072718  0.801365  0.517816  1
  H  H314  1  0.067160  0.409442  0.532075  1
  H  H315  1  0.068289  0.014366  0.568569  1
  H  H316  1  0.072822  0.901449  0.514621  1
  H  H317  1  0.062748  0.508459  0.522824  1
  H  H318  1  0.062217  0.117464  0.561572  1
  H  H319  1  0.064056  0.653691  0.533054  1
  H  H320  1  0.034000  0.266428  0.563762  1
  H  H321  1  0.063648  0.055105  0.520858  1
  H  H322  1  0.241015  0.974179  0.540914  1
  H  H323  1  0.242590  0.577799  0.549045  1
  H  H324  1  0.225598  0.369811  0.504982  1
  H  H325  1  0.549921  0.665378  0.592291  1
  H  H326  1  0.523957  0.293195  0.618124  1
  H  H327  1  0.568668  0.876318  0.651533  1
  H  H328  1  0.866720  0.567513  0.606497  1
  H  H329  1  0.856858  0.173516  0.664755  1
  H  H330  1  0.881451  0.968683  0.597832  1
  H  H331  1  0.797999  0.663212  0.621885  1
  H  H332  1  0.746723  0.492386  0.586313  1
  H  H333  1  0.734531  0.089725  0.596351  1
  H  H334  1  0.720352  0.581552  0.579573  1
  H  H335  1  0.729401  0.184189  0.623371  1
  H  H336  1  0.668956  0.784578  0.613446  1
  H  H337  1  0.735526  0.723455  0.593845  1
  H  H338  1  0.766230  0.354519  0.604723  1
  H  H339  1  0.726251  0.957167  0.651037  1
  H  H340  1  0.018814  0.658871  0.606479  1
  H  H341  1  0.985988  0.268915  0.659098  1
  H  H342  1  0.920869  0.053582  0.598183  1
  H  H343  1  0.224658  0.548140  0.599343  1
  H  H344  1  0.205619  0.151693  0.636294  1
  H  H345  1  0.235030  0.929316  0.585211  1
  H  H346  1  0.605887  0.468554  0.613461  1
  H  H347  1  0.540281  0.219418  0.581405  1
  H  H348  1  0.549691  0.838042  0.604536  1
  H  H349  1  0.415250  0.742919  0.576520  1
  H  H350  1  0.401998  0.353919  0.580505  1
  H  H351  1  0.435525  0.941179  0.605229  1
  H  H352  1  0.363889  0.635256  0.624279  1
  H  H353  1  0.392701  0.454976  0.592856  1
  H  H354  1  0.377292  0.059067  0.597178  1
  H  H355  1  0.392492  0.603660  0.590632  1
  H  H356  1  0.369791  0.217249  0.630171  1
  H  H357  1  0.394243  0.997304  0.579478  1
  H  H358  1  0.505649  0.546973  0.610339  1
  H  H359  1  0.491976  0.154278  0.655331  1
  H  H360  1  0.652117  0.918303  0.604392  1
  H  H361  1  0.913935  0.789791  0.591436  1
  H  H362  1  0.882650  0.416236  0.607828  1
  H  H363  1  0.891477  0.015928  0.644224  1
  H  H364  1  0.233187  0.697900  0.615735  1
  H  H365  1  0.195690  0.347141  0.612966  1
  H  H366  1  0.202259  0.091843  0.594226  1
  H  H367  1  0.085073  0.617765  0.580078  1
  H  H368  1  0.052233  0.231203  0.618439  1
  H  H369  1  0.136468  0.799079  0.612906  1
  H  H370  1  0.076992  0.710094  0.576437  1
  H  H371  1  0.013271  0.322285  0.598359  1
  H  H372  1  0.020912  0.922156  0.606241  1
  H  H373  1  0.096460  0.486948  0.599131  1
  H  H374  1  0.051679  0.101427  0.642668  1
  H  H375  1  0.069240  0.860775  0.587823  1
  H  H376  1  0.324306  0.758169  0.604042  1
  H  H377  1  0.149632  0.417984  0.626424  1
  H  H378  1  0.222121  0.187851  0.585264  1
  H  H379  1  0.600748  0.514108  0.653925  1
  H  H380  1  0.676357  0.133043  0.687607  1
  H  H381  1  0.815882  0.719991  0.717517  1
  H  H382  1  0.751098  0.403041  0.702983  1
  H  H383  1  0.023266  0.945848  0.699164  1
  H  H384  1  0.946265  0.751716  0.688679  1
  H  H385  1  0.706837  0.516516  0.726365  1
  H  H386  1  0.708889  0.318807  0.632192  1
  H  H387  1  0.599525  0.860623  0.712952  1
  H  H388  1  0.772154  0.420475  0.651810  1
  H  H389  1  0.903281  0.966770  0.693026  1
  H  H390  1  0.686470  0.618253  0.730289  1
  H  H391  1  0.905953  0.546672  0.716774  1
  H  H392  1  0.647144  0.174653  0.689255  1
  H  H393  1  0.762384  0.758139  0.719277  1
  H  H394  1  0.076957  0.494189  0.712979  1
  H  H395  1  0.880078  0.081247  0.685920  1
  H  H396  1  0.841623  0.871185  0.673469  1
  H  H397  1  0.309876  0.415197  0.714446  1
  H  H398  1  0.385987  0.965530  0.698461  1
  H  H399  1  0.241738  0.734936  0.655890  1
  H  H400  1  0.722357  0.282204  0.694186  1
  H  H401  1  0.581224  0.035442  0.670834  1
  H  H402  1  0.689575  0.654244  0.716332  1
  H  H403  1  0.378179  0.565078  0.656883  1
  H  H404  1  0.385588  0.242009  0.679189  1
  H  H405  1  0.317215  0.802620  0.698026  1
  H  H406  1  0.609401  0.470698  0.721972  1
  H  H407  1  0.541972  0.274800  0.695953  1
  H  H408  1  0.471523  0.813024  0.696697  1
  H  H409  1  0.541606  0.436448  0.662063  1
  H  H410  1  0.515363  0.985051  0.694473  1
  H  H411  1  0.397813  0.798842  0.647901  1
  H  H412  1  0.429849  0.375439  0.707743  1
  H  H413  1  0.651058  0.896710  0.713934  1
  H  H414  1  0.520393  0.725967  0.685251  1
  H  H415  1  0.883114  0.598279  0.677846  1
  H  H416  1  0.943553  0.215390  0.669124  1
  H  H417  1  0.972586  0.842288  0.706284  1
  H  H418  1  0.364028  0.549467  0.723539  1
  H  H419  1  0.351902  0.083805  0.691202  1
  H  H420  1  0.279520  0.889311  0.673439  1
  H  H421  1  0.960825  0.408339  0.697484  1
  H  H422  1  0.898708  0.046890  0.696285  1
  H  H423  1  0.160563  0.650244  0.706153  1
  H  H424  1  0.093015  0.482532  0.669811  1
  H  H425  1  0.245125  0.108448  0.684276  1
  H  H426  1  0.165017  0.753017  0.691633  1
  H  H427  1  0.027354  0.342906  0.690894  1
  H  H428  1  0.120678  0.845895  0.707960  1
  H  H429  1  0.075585  0.672996  0.658737  1
  H  H430  1  0.338574  0.627104  0.714833  1
  H  H431  1  0.208352  0.319607  0.692712  1
  H  H432  1  0.167577  0.013186  0.665471  1
