# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.01269313
_cell_length_b   17.27040867
_cell_length_c   16.49073595
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   66.58677555
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H447
_cell_volume   4184.94952109
_cell_formula_units_Z   223
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
  H  H1  1  0.955404  0.145697  0.942063  1
  H  H2  1  0.892134  0.126719  0.485792  1
  H  H3  1  0.834382  0.261492  0.992294  1
  H  H4  1  0.764962  0.256742  0.470386  1
  H  H5  1  0.707324  0.391276  0.963216  1
  H  H6  1  0.639111  0.383882  0.461261  1
  H  H7  1  0.580577  0.520360  0.933714  1
  H  H8  1  0.512566  0.512510  0.433841  1
  H  H9  1  0.454574  0.647822  0.904498  1
  H  H10  1  0.386042  0.641065  0.406093  1
  H  H11  1  0.328920  0.774297  0.910099  1
  H  H12  1  0.258724  0.771216  0.380248  1
  H  H13  1  0.201776  0.903912  0.896173  1
  H  H14  1  0.139168  0.883559  0.439055  1
  H  H15  1  0.083083  0.013991  0.962194  1
  H  H16  1  0.152502  0.017054  0.418200  1
  H  H17  1  0.098127  0.145716  0.942020  1
  H  H18  1  0.034645  0.126274  0.484544  1
  H  H19  1  0.977227  0.261468  0.992348  1
  H  H20  1  0.907853  0.256718  0.470371  1
  H  H21  1  0.850200  0.391290  0.963221  1
  H  H22  1  0.781938  0.383838  0.461498  1
  H  H23  1  0.723412  0.520402  0.933838  1
  H  H24  1  0.655419  0.512449  0.433944  1
  H  H25  1  0.597343  0.647910  0.904636  1
  H  H26  1  0.528862  0.641103  0.406038  1
  H  H27  1  0.471707  0.774381  0.909981  1
  H  H28  1  0.401511  0.771353  0.380055  1
  H  H29  1  0.344662  0.903972  0.895904  1
  H  H30  1  0.281900  0.883703  0.438823  1
  H  H31  1  0.226030  0.014281  0.961485  1
  H  H32  1  0.295879  0.017033  0.418798  1
  H  H33  1  0.240987  0.145893  0.941732  1
  H  H34  1  0.177490  0.126424  0.484577  1
  H  H35  1  0.120067  0.261511  0.992325  1
  H  H36  1  0.050532  0.257040  0.470908  1
  H  H37  1  0.993030  0.391313  0.963251  1
  H  H38  1  0.924752  0.383829  0.461263  1
  H  H39  1  0.866290  0.520344  0.933645  1
  H  H40  1  0.798225  0.512415  0.433947  1
  H  H41  1  0.740165  0.647849  0.904563  1
  H  H42  1  0.671690  0.641082  0.406059  1
  H  H43  1  0.614563  0.774401  0.909992  1
  H  H44  1  0.544439  0.771362  0.380054  1
  H  H45  1  0.487592  0.903992  0.895842  1
  H  H46  1  0.424819  0.883695  0.438852  1
  H  H47  1  0.368877  0.014340  0.961288  1
  H  H48  1  0.439149  0.017034  0.418954  1
  H  H49  1  0.383899  0.145933  0.941635  1
  H  H50  1  0.320611  0.126540  0.484733  1
  H  H51  1  0.262924  0.261550  0.992359  1
  H  H52  1  0.193283  0.257269  0.471234  1
  H  H53  1  0.135869  0.391337  0.963371  1
  H  H54  1  0.067568  0.384004  0.461449  1
  H  H55  1  0.009109  0.520416  0.933860  1
  H  H56  1  0.941071  0.512411  0.433956  1
  H  H57  1  0.883045  0.647824  0.904527  1
  H  H58  1  0.814530  0.641024  0.406120  1
  H  H59  1  0.757445  0.774285  0.910101  1
  H  H60  1  0.687381  0.771339  0.380066  1
  H  H61  1  0.630547  0.903967  0.895909  1
  H  H62  1  0.567775  0.883688  0.438849  1
  H  H63  1  0.511724  0.014337  0.961285  1
  H  H64  1  0.582432  0.017014  0.418791  1
  H  H65  1  0.526859  0.145873  0.941730  1
  H  H66  1  0.463854  0.126511  0.484720  1
  H  H67  1  0.405786  0.261545  0.992324  1
  H  H68  1  0.336192  0.257323  0.471345  1
  H  H69  1  0.278722  0.391347  0.963407  1
  H  H70  1  0.210416  0.384082  0.461653  1
  H  H71  1  0.151947  0.520511  0.934160  1
  H  H72  1  0.083960  0.512397  0.434141  1
  H  H73  1  0.025866  0.647991  0.904956  1
  H  H74  1  0.957429  0.640886  0.406301  1
  H  H75  1  0.900353  0.774302  0.910571  1
  H  H76  1  0.830280  0.771198  0.380247  1
  H  H77  1  0.773496  0.903888  0.896174  1
  H  H78  1  0.710690  0.883689  0.438818  1
  H  H79  1  0.654633  0.014267  0.961480  1
  H  H80  1  0.725786  0.017049  0.418193  1
  H  H81  1  0.669883  0.145693  0.942021  1
  H  H82  1  0.607058  0.126398  0.484568  1
  H  H83  1  0.548677  0.261501  0.992263  1
  H  H84  1  0.479133  0.257254  0.471201  1
  H  H85  1  0.421593  0.391313  0.963250  1
  H  H86  1  0.353300  0.384082  0.461526  1
  H  H87  1  0.294847  0.520435  0.933937  1
  H  H88  1  0.226861  0.512416  0.434164  1
  H  H89  1  0.168759  0.648002  0.904975  1
  H  H90  1  0.100383  0.640811  0.406461  1
  H  H91  1  0.043190  0.774277  0.910811  1
  H  H92  1  0.973262  0.770725  0.380565  1
  H  H93  1  0.916259  0.903810  0.895943  1
  H  H94  1  0.853540  0.883552  0.439052  1
  H  H95  1  0.797833  0.013975  0.962192  1
  H  H96  1  0.869247  0.017579  0.416053  1
  H  H97  1  0.812627  0.145687  0.942065  1
  H  H98  1  0.750001  0.126286  0.484554  1
  H  H99  1  0.691557  0.261459  0.992315  1
  H  H100  1  0.622029  0.257059  0.470906  1
  H  H101  1  0.564463  0.391285  0.963176  1
  H  H102  1  0.496179  0.384029  0.461282  1
  H  H103  1  0.437740  0.520338  0.933633  1
  H  H104  1  0.369725  0.512481  0.433946  1
  H  H105  1  0.311695  0.647858  0.904596  1
  H  H106  1  0.243265  0.640904  0.406313  1
  H  H107  1  0.185986  0.774336  0.910577  1
  H  H108  1  0.116153  0.770731  0.380570  1
  H  H109  1  0.059081  0.903825  0.895943  1
  H  H110  1  0.996724  0.882689  0.439650  1
  H  H111  1  0.940507  0.013870  0.962422  1
  H  H112  1  0.980250  0.085202  0.182844  1
  H  H113  1  0.059575  0.069299  0.722979  1
  H  H114  1  0.862399  0.196112  0.243876  1
  H  H115  1  0.932208  0.199785  0.706348  1
  H  H116  1  0.735257  0.326018  0.222071  1
  H  H117  1  0.807732  0.323651  0.729211  1
  H  H118  1  0.609200  0.453495  0.197298  1
  H  H119  1  0.681684  0.451086  0.698896  1
  H  H120  1  0.483206  0.580890  0.170941  1
  H  H121  1  0.555670  0.578521  0.667080  1
  H  H122  1  0.357303  0.708001  0.150946  1
  H  H123  1  0.428787  0.707808  0.637570  1
  H  H124  1  0.229602  0.839142  0.134358  1
  H  H125  1  0.305848  0.827835  0.676559  1
  H  H126  1  0.112576  0.948512  0.199598  1
  H  H127  1  0.178372  0.958212  0.657686  1
  H  H128  1  0.124137  0.084127  0.181237  1
  H  H129  1  0.202325  0.069315  0.722524  1
  H  H130  1  0.005819  0.196044  0.243528  1
  H  H131  1  0.075078  0.199589  0.706221  1
  H  H132  1  0.878194  0.326024  0.222062  1
  H  H133  1  0.950670  0.323505  0.729133  1
  H  H134  1  0.752080  0.453521  0.197308  1
  H  H135  1  0.824574  0.451042  0.698828  1
  H  H136  1  0.626043  0.580926  0.170977  1
  H  H137  1  0.698479  0.578556  0.667157  1
  H  H138  1  0.500127  0.708113  0.150930  1
  H  H139  1  0.571667  0.707821  0.637563  1
  H  H140  1  0.372436  0.839493  0.134286  1
  H  H141  1  0.448745  0.827878  0.676409  1
  H  H142  1  0.254611  0.949276  0.199651  1
  H  H143  1  0.321367  0.958115  0.657922  1
  H  H144  1  0.267214  0.084399  0.180922  1
  H  H145  1  0.345240  0.069354  0.722338  1
  H  H146  1  0.148749  0.195413  0.243717  1
  H  H147  1  0.217971  0.199563  0.706308  1
  H  H148  1  0.021171  0.325873  0.222127  1
  H  H149  1  0.093511  0.323436  0.729267  1
  H  H150  1  0.894984  0.453522  0.197293  1
  H  H151  1  0.967465  0.450941  0.698765  1
  H  H152  1  0.768915  0.580907  0.170972  1
  H  H153  1  0.841348  0.578475  0.667077  1
  H  H154  1  0.642948  0.708130  0.150958  1
  H  H155  1  0.714556  0.707807  0.637569  1
  H  H156  1  0.515178  0.839631  0.134300  1
  H  H157  1  0.591687  0.827871  0.676414  1
  H  H158  1  0.396793  0.949627  0.199826  1
  H  H159  1  0.464409  0.958094  0.657965  1
  H  H160  1  0.410241  0.084478  0.180821  1
  H  H161  1  0.488213  0.069340  0.722338  1
  H  H162  1  0.291405  0.195424  0.243902  1
  H  H163  1  0.360925  0.199563  0.706308  1
  H  H164  1  0.164023  0.325759  0.222299  1
  H  H165  1  0.236390  0.323448  0.729426  1
  H  H166  1  0.037849  0.453494  0.197370  1
  H  H167  1  0.110282  0.451056  0.699265  1
  H  H168  1  0.911794  0.580967  0.170964  1
  H  H169  1  0.984214  0.578485  0.667349  1
  H  H170  1  0.785874  0.708004  0.150948  1
  H  H171  1  0.857449  0.707735  0.637659  1
  H  H172  1  0.658036  0.839498  0.134293  1
  H  H173  1  0.734627  0.827819  0.676562  1
  H  H174  1  0.539280  0.949626  0.199824  1
  H  H175  1  0.607444  0.958090  0.657927  1
  H  H176  1  0.553345  0.084386  0.180915  1
  H  H177  1  0.631173  0.069291  0.722527  1
  H  H178  1  0.433992  0.195412  0.243883  1
  H  H179  1  0.503900  0.199518  0.706304  1
  H  H180  1  0.306838  0.325760  0.222330  1
  H  H181  1  0.379293  0.323421  0.729324  1
  H  H182  1  0.180679  0.453481  0.197477  1
  H  H183  1  0.253140  0.451055  0.699305  1
  H  H184  1  0.054606  0.581016  0.171093  1
  H  H185  1  0.127085  0.578506  0.667586  1
  H  H186  1  0.928723  0.708347  0.151110  1
  H  H187  1  0.000308  0.707686  0.637875  1
  H  H188  1  0.801178  0.839136  0.134357  1
  H  H189  1  0.877476  0.827691  0.676827  1
  H  H190  1  0.681768  0.949272  0.199648  1
  H  H191  1  0.750354  0.958193  0.657687  1
  H  H192  1  0.696658  0.084118  0.181229  1
  H  H193  1  0.773931  0.069289  0.722985  1
  H  H194  1  0.576654  0.195398  0.243690  1
  H  H195  1  0.646749  0.199579  0.706242  1
  H  H196  1  0.449660  0.325739  0.222233  1
  H  H197  1  0.522143  0.323417  0.729118  1
  H  H198  1  0.323521  0.453463  0.197424  1
  H  H199  1  0.396022  0.450980  0.698941  1
  H  H200  1  0.197433  0.581010  0.171123  1
  H  H201  1  0.269971  0.578505  0.667424  1
  H  H202  1  0.071395  0.708468  0.151429  1
  H  H203  1  0.143142  0.707692  0.637896  1
  H  H204  1  0.943857  0.841233  0.135809  1
  H  H205  1  0.020307  0.827662  0.676929  1
  H  H206  1  0.824459  0.948509  0.199596  1
  H  H207  1  0.893005  0.958226  0.657673  1
  H  H208  1  0.839619  0.085201  0.182839  1
  H  H209  1  0.916751  0.069296  0.723185  1
  H  H210  1  0.719037  0.196044  0.243526  1
  H  H211  1  0.789433  0.199791  0.706364  1
  H  H212  1  0.592409  0.325858  0.222097  1
  H  H213  1  0.664905  0.323527  0.729094  1
  H  H214  1  0.466349  0.453467  0.197304  1
  H  H215  1  0.538885  0.450961  0.698688  1
  H  H216  1  0.340283  0.580954  0.170985  1
  H  H217  1  0.412839  0.578489  0.667112  1
  H  H218  1  0.214165  0.708351  0.151126  1
  H  H219  1  0.285954  0.707746  0.637673  1
  H  H220  1  0.085127  0.841238  0.135811  1
  H  H221  1  0.163109  0.827706  0.676828  1
  H  H222  1  0.965257  0.956115  0.206237  1
  H  H223  1  0.035696  0.958230  0.657674  1
  H  H224  1  0.039228  0.116181  0.061825  1
  H  H225  1  0.094535  0.986449  0.537393  1
  H  H226  1  0.919670  0.229084  0.119463  1
  H  H227  1  0.976534  0.096437  0.604499  1
  H  H228  1  0.792537  0.359147  0.093493  1
  H  H229  1  0.849468  0.226267  0.589477  1
  H  H230  1  0.666063  0.487543  0.065757  1
  H  H231  1  0.723955  0.352330  0.594898  1
  H  H232  1  0.539647  0.615899  0.038252  1
  H  H233  1  0.597972  0.479755  0.565657  1
  H  H234  1  0.413923  0.742617  0.028324  1
  H  H235  1  0.471217  0.608918  0.536262  1
  H  H236  1  0.286306  0.873550  0.014849  1
  H  H237  1  0.344041  0.738784  0.507286  1
  H  H238  1  0.168302  0.983053  0.080844  1
  H  H239  1  0.223013  0.854399  0.558292  1
  H  H240  1  0.182110  0.116457  0.061310  1
  H  H241  1  0.237767  0.986074  0.538102  1
  H  H242  1  0.062622  0.228977  0.119410  1
  H  H243  1  0.119209  0.096336  0.603740  1
  H  H244  1  0.935427  0.359147  0.093508  1
  H  H245  1  0.992393  0.225819  0.589261  1
  H  H246  1  0.808944  0.487558  0.065738  1
  H  H247  1  0.866930  0.352303  0.594874  1
  H  H248  1  0.682460  0.615926  0.038331  1
  H  H249  1  0.740807  0.479802  0.565797  1
  H  H250  1  0.556718  0.742698  0.028311  1
  H  H251  1  0.614050  0.608938  0.536274  1
  H  H252  1  0.429151  0.873667  0.014716  1
  H  H253  1  0.486933  0.738796  0.507214  1
  H  H254  1  0.310908  0.983221  0.080796  1
  H  H255  1  0.365911  0.854346  0.558179  1
  H  H256  1  0.325028  0.116542  0.061072  1
  H  H257  1  0.380910  0.985972  0.538370  1
  H  H258  1  0.205472  0.229045  0.119457  1
  H  H259  1  0.262111  0.096366  0.603621  1
  H  H260  1  0.078266  0.359169  0.093551  1
  H  H261  1  0.135311  0.225820  0.589505  1
  H  H262  1  0.951788  0.487638  0.065713  1
  H  H263  1  0.009791  0.352174  0.594886  1
  H  H264  1  0.825335  0.615847  0.038190  1
  H  H265  1  0.883706  0.479709  0.565642  1
  H  H266  1  0.699578  0.742630  0.028338  1
  H  H267  1  0.756896  0.608913  0.536283  1
  H  H268  1  0.572025  0.873676  0.014724  1
  H  H269  1  0.629856  0.738792  0.507216  1
  H  H270  1  0.453632  0.983231  0.080777  1
  H  H271  1  0.508883  0.854322  0.558158  1
  H  H272  1  0.467968  0.116534  0.061068  1
  H  H273  1  0.524017  0.985955  0.538368  1
  H  H274  1  0.348284  0.229044  0.119471  1
  H  H275  1  0.405142  0.096378  0.603602  1
  H  H276  1  0.221080  0.359201  0.093639  1
  H  H277  1  0.278171  0.225920  0.589662  1
  H  H278  1  0.094591  0.487732  0.065821  1
  H  H279  1  0.152582  0.352344  0.595229  1
  H  H280  1  0.968159  0.616108  0.038355  1
  H  H281  1  0.026549  0.479732  0.565922  1
  H  H282  1  0.842411  0.742566  0.028387  1
  H  H283  1  0.899773  0.608842  0.536371  1
  H  H284  1  0.714980  0.873543  0.014850  1
  H  H285  1  0.772762  0.738773  0.507287  1
  H  H286  1  0.596371  0.983218  0.080791  1
  H  H287  1  0.651841  0.854332  0.558179  1
  H  H288  1  0.610973  0.116440  0.061303  1
  H  H289  1  0.667082  0.986051  0.538097  1
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  H  H291  1  0.548216  0.096306  0.603624  1
  H  H292  1  0.363917  0.359181  0.093596  1
  H  H293  1  0.421146  0.225844  0.589646  1
  H  H294  1  0.237399  0.487730  0.065861  1
  H  H295  1  0.295468  0.352366  0.595258  1
  H  H296  1  0.110865  0.616373  0.038573  1
  H  H297  1  0.169400  0.479791  0.566169  1
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  H  H299  1  0.042654  0.608788  0.536594  1
  H  H300  1  0.857936  0.873748  0.015353  1
  H  H301  1  0.915629  0.738676  0.507489  1
  H  H302  1  0.739129  0.983043  0.080838  1
  H  H303  1  0.794693  0.854386  0.558292  1
  H  H304  1  0.754098  0.116169  0.061820  1
  H  H305  1  0.809984  0.986445  0.537387  1
  H  H306  1  0.634016  0.228960  0.119385  1
  H  H307  1  0.691135  0.096305  0.603751  1
  H  H308  1  0.506786  0.359126  0.093494  1
  H  H309  1  0.564081  0.225732  0.589504  1
  H  H310  1  0.380285  0.487625  0.065740  1
  H  H311  1  0.438368  0.352265  0.595019  1
  H  H312  1  0.253787  0.616115  0.038411  1
  H  H313  1  0.312289  0.479776  0.566006  1
  H  H314  1  0.127920  0.743335  0.029360  1
  H  H315  1  0.185557  0.608801  0.536622  1
  H  H316  1  0.000462  0.873976  0.015147  1
  H  H317  1  0.058504  0.738536  0.507732  1
  H  H318  1  0.882490  0.983088  0.082597  1
  H  H319  1  0.937461  0.854265  0.558601  1
  H  H320  1  0.896586  0.116357  0.061589  1
  H  H321  1  0.952280  0.986396  0.537555  1
  H  H322  1  0.776874  0.229080  0.119459  1
  H  H323  1  0.833705  0.096435  0.604506  1
  H  H324  1  0.649655  0.359117  0.093496  1
  H  H325  1  0.706939  0.225818  0.589283  1
  H  H326  1  0.523193  0.487545  0.065695  1
  H  H327  1  0.581222  0.352168  0.594811  1
  H  H328  1  0.396836  0.615839  0.038186  1
  H  H329  1  0.455154  0.479732  0.565708  1
  H  H330  1  0.271140  0.742575  0.028394  1
  H  H331  1  0.328402  0.608854  0.536392  1
  H  H332  1  0.143172  0.873766  0.015357  1
  H  H333  1  0.201257  0.738684  0.507499  1
  H  H334  1  0.024903  0.983095  0.082600  1
  H  H335  1  0.080350  0.854268  0.558602  1
  H  H336  1  0.008586  0.017572  0.416056  1
  H  H337  1  0.999831  0.042003  0.842459  1
  H  H338  1  0.808817  0.158070  0.363478  1
  H  H339  1  0.872569  0.172393  0.823533  1
  H  H340  1  0.678909  0.291547  0.348573  1
  H  H341  1  0.749653  0.292502  0.861863  1
  H  H342  1  0.552632  0.419061  0.328695  1
  H  H343  1  0.622852  0.421700  0.832250  1
  H  H344  1  0.426498  0.546656  0.302348  1
  H  H345  1  0.496813  0.549158  0.800436  1
  H  H346  1  0.300363  0.674335  0.277536  1
  H  H347  1  0.370670  0.676777  0.770319  1
  H  H348  1  0.173292  0.804320  0.255975  1
  H  H349  1  0.246121  0.800620  0.793760  1
  H  H350  1  0.054662  0.914334  0.319743  1
  H  H351  1  0.118824  0.930952  0.777201  1
  H  H352  1  0.062678  0.049201  0.299014  1
  H  H353  1  0.142598  0.042073  0.842167  1
  H  H354  1  0.948584  0.158048  0.363467  1
  H  H355  1  0.015383  0.172371  0.823500  1
  H  H356  1  0.821300  0.291996  0.348638  1
  H  H357  1  0.892515  0.292505  0.861891  1
  H  H358  1  0.695373  0.419162  0.328712  1
  H  H359  1  0.765690  0.421773  0.832402  1
  H  H360  1  0.569301  0.546711  0.302327  1
  H  H361  1  0.639619  0.549251  0.800656  1
  H  H362  1  0.443145  0.674473  0.277394  1
  H  H363  1  0.513539  0.676778  0.770301  1
  H  H364  1  0.315872  0.804796  0.255630  1
  H  H365  1  0.388992  0.800654  0.793424  1
  H  H366  1  0.197136  0.915420  0.319003  1
  H  H367  1  0.261583  0.930962  0.777239  1
  H  H368  1  0.208967  0.050287  0.299854  1
  H  H369  1  0.285452  0.042208  0.841720  1
  H  H370  1  0.091162  0.159780  0.364544  1
  H  H371  1  0.158189  0.172328  0.823431  1
  H  H372  1  0.964087  0.291525  0.348571  1
  H  H373  1  0.035370  0.292481  0.861979  1
  H  H374  1  0.838235  0.419143  0.328707  1
  H  H375  1  0.908591  0.421684  0.832242  1
  H  H376  1  0.712129  0.546709  0.302351  1
  H  H377  1  0.782485  0.549207  0.800556  1
  H  H378  1  0.585941  0.674521  0.277398  1
  H  H379  1  0.656392  0.676793  0.770331  1
  H  H380  1  0.458616  0.804965  0.255613  1
  H  H381  1  0.531870  0.800674  0.793357  1
  H  H382  1  0.339741  0.915705  0.319104  1
  H  H383  1  0.404545  0.930957  0.777192  1
  H  H384  1  0.352974  0.050508  0.299997  1
  H  H385  1  0.428345  0.042233  0.841614  1
  H  H386  1  0.234370  0.160309  0.365027  1
  H  H387  1  0.301094  0.172384  0.823320  1
  H  H388  1  0.106914  0.291718  0.348656  1
  H  H389  1  0.178227  0.292471  0.862033  1
  H  H390  1  0.981081  0.419035  0.328756  1
  H  H391  1  0.051425  0.421709  0.832422  1
  H  H392  1  0.854993  0.546655  0.302369  1
  H  H393  1  0.925367  0.549142  0.800500  1
  H  H394  1  0.728779  0.674469  0.277418  1
  H  H395  1  0.799268  0.676766  0.770303  1
  H  H396  1  0.601455  0.804969  0.255625  1
  H  H397  1  0.674773  0.800654  0.793433  1
  H  H398  1  0.482560  0.915738  0.319152  1
  H  H399  1  0.547532  0.930950  0.777196  1
  H  H400  1  0.496636  0.050501  0.299994  1
  H  H401  1  0.571270  0.042190  0.841717  1
  H  H402  1  0.377697  0.160428  0.365170  1
  H  H403  1  0.444045  0.172364  0.823319  1
  H  H404  1  0.249865  0.291876  0.348837  1
  H  H405  1  0.321103  0.292479  0.862054  1
  H  H406  1  0.123937  0.419101  0.328872  1
  H  H407  1  0.194254  0.421774  0.832675  1
  H  H408  1  0.997874  0.546600  0.302471  1
  H  H409  1  0.068178  0.549275  0.800999  1
  H  H410  1  0.871680  0.674326  0.277530  1
  H  H411  1  0.942125  0.676766  0.770518  1
  H  H412  1  0.744347  0.804788  0.255633  1
  H  H413  1  0.817683  0.800598  0.793756  1
  H  H414  1  0.625414  0.915699  0.319100  1
  H  H415  1  0.690499  0.930945  0.777243  1
  H  H416  1  0.640836  0.050281  0.299849  1
  H  H417  1  0.714250  0.042048  0.842168  1
  H  H418  1  0.521127  0.160297  0.365011  1
  H  H419  1  0.587013  0.172287  0.823437  1
  H  H420  1  0.392876  0.291865  0.348791  1
  H  H421  1  0.463987  0.292454  0.861941  1
  H  H422  1  0.266830  0.419128  0.328895  1
  H  H423  1  0.337124  0.421724  0.832507  1
  H  H424  1  0.140761  0.546599  0.302575  1
  H  H425  1  0.211051  0.549279  0.801032  1
  H  H426  1  0.014625  0.674248  0.277721  1
  H  H427  1  0.084984  0.676755  0.770681  1
  H  H428  1  0.887336  0.804312  0.255972  1
  H  H429  1  0.960557  0.800512  0.793965  1
  H  H430  1  0.768264  0.915413  0.318999  1
  H  H431  1  0.833266  0.930937  0.777201  1
  H  H432  1  0.788051  0.049207  0.299011  1
  H  H433  1  0.857076  0.041990  0.842461  1
  H  H434  1  0.664771  0.159787  0.364542  1
  H  H435  1  0.729783  0.172342  0.823513  1
  H  H436  1  0.535943  0.291711  0.348599  1
  H  H437  1  0.606824  0.292469  0.861891  1
  H  H438  1  0.409739  0.419109  0.328756  1
  H  H439  1  0.480012  0.421663  0.832228  1
  H  H440  1  0.283636  0.546624  0.302484  1
  H  H441  1  0.353954  0.549183  0.800625  1
  H  H442  1  0.157484  0.674257  0.277732  1
  H  H443  1  0.227824  0.676782  0.770559  1
  H  H444  1  0.030213  0.804551  0.256167  1
  H  H445  1  0.103327  0.800523  0.793966  1
  H  H446  1  0.911665  0.914334  0.319743  1
  H  H447  1  0.976041  0.930952  0.777147  1
