# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.83391146
_cell_length_b   16.85753727
_cell_length_c   48.43282887
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.43073494
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H384
_cell_volume   7770.80000536
_cell_formula_units_Z   192
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  0.363617  0.134276  0.271802  1
  H  H2  1  0.823381  0.118839  0.290808  1
  H  H3  1  0.323381  0.618839  0.290808  1
  H  H4  1  0.863617  0.634276  0.271802  1
  H  H5  1  0.486263  0.290383  0.264183  1
  H  H6  1  0.944638  0.219640  0.298560  1
  H  H7  1  0.444638  0.719640  0.298560  1
  H  H8  1  0.986263  0.790383  0.264183  1
  H  H9  1  0.309805  0.374027  0.291558  1
  H  H10  1  0.836764  0.358945  0.288104  1
  H  H11  1  0.336764  0.858945  0.288104  1
  H  H12  1  0.809805  0.874027  0.291558  1
  H  H13  1  0.208138  0.511634  0.281497  1
  H  H14  1  0.729329  0.499583  0.279307  1
  H  H15  1  0.229329  -0.000417  0.279307  1
  H  H16  1  0.708138  0.011634  0.281497  1
  H  H17  1  1.117654  0.141675  0.270379  1
  H  H18  1  0.595693  0.150566  0.273269  1
  H  H19  1  1.095693  0.650566  0.273269  1
  H  H20  1  0.617654  0.641675  0.270379  1
  H  H21  1  0.251465  0.271387  0.262865  1
  H  H22  1  0.716509  0.256721  0.280859  1
  H  H23  1  0.216509  0.756721  0.280859  1
  H  H24  1  0.751465  0.771387  0.262865  1
  H  H25  1  1.075078  0.358230  0.289560  1
  H  H26  1  0.600738  0.397990  0.271820  1
  H  H27  1  1.100738  0.897990  0.271820  1
  H  H28  1  0.575078  0.858230  0.289560  1
  H  H29  1  0.972838  0.496469  0.279965  1
  H  H30  1  0.492252  0.538717  0.262837  1
  H  H31  1  0.992252  0.038717  0.262837  1
  H  H32  1  0.472838  -0.003531  0.279965  1
  H  H33  1  0.284123  0.085777  0.310761  1
  H  H34  1  0.744456  0.057601  0.327459  1
  H  H35  1  0.244456  0.557601  0.327459  1
  H  H36  1  0.784123  0.585777  0.310761  1
  H  H37  1  0.412465  0.232980  0.302320  1
  H  H38  1  0.863790  0.159336  0.335727  1
  H  H39  1  0.363790  0.659336  0.335727  1
  H  H40  1  0.912465  0.732980  0.302320  1
  H  H41  1  0.230874  0.318873  0.329994  1
  H  H42  1  0.760172  0.298739  0.326287  1
  H  H43  1  0.260172  0.798739  0.326287  1
  H  H44  1  0.730874  0.818873  0.329994  1
  H  H45  1  1.124648  0.455505  0.320074  1
  H  H46  1  0.655494  0.437585  0.317259  1
  H  H47  1  1.155494  0.937585  0.317259  1
  H  H48  1  0.624648  0.955505  0.320074  1
  H  H49  1  1.049552  0.077297  0.308725  1
  H  H50  1  0.518474  0.093474  0.311238  1
  H  H51  1  1.018474  0.593474  0.311238  1
  H  H52  1  0.549552  0.577297  0.308725  1
  H  H53  1  0.181095  0.222949  0.302599  1
  H  H54  1  0.638539  0.196778  0.318422  1
  H  H55  1  1.138539  0.696778  0.318422  1
  H  H56  1  0.681095  0.722949  0.302599  1
  H  H57  1  0.994316  0.310209  0.328844  1
  H  H58  1  0.533724  0.335402  0.309744  1
  H  H59  1  1.033724  0.835402  0.309744  1
  H  H60  1  0.494316  0.810209  0.328844  1
  H  H61  1  0.889731  0.448028  0.319174  1
  H  H62  1  0.428432  0.475977  0.300935  1
  H  H63  1  0.928432  -0.024023  0.300935  1
  H  H64  1  0.389731  0.948028  0.319174  1
  H  H65  1  0.203641  0.029735  0.347421  1
  H  H66  1  0.667580  0.000746  0.364929  1
  H  H67  1  1.167580  0.500746  0.364929  1
  H  H68  1  0.703641  0.529735  0.347421  1
  H  H69  1  0.335852  0.178433  0.339987  1
  H  H70  1  0.785426  0.101640  0.372712  1
  H  H71  1  0.285426  0.601640  0.372712  1
  H  H72  1  0.835852  0.678433  0.339987  1
  H  H73  1  1.150201  0.262294  0.367125  1
  H  H74  1  0.680327  0.241203  0.363237  1
  H  H75  1  0.180327  0.741203  0.363237  1
  H  H76  1  0.650201  0.762294  0.367125  1
  H  H77  1  1.045636  0.401454  0.358222  1
  H  H78  1  0.575266  0.380572  0.354171  1
  H  H79  1  1.075266  0.880572  0.354171  1
  H  H80  1  0.545636  0.901454  0.358222  1
  H  H81  1  0.969131  0.019714  0.345344  1
  H  H82  1  0.440425  0.039391  0.349032  1
  H  H83  1  0.940425  0.539391  0.349032  1
  H  H84  1  0.469131  0.519714  0.345344  1
  H  H85  1  1.097060  0.169119  0.338604  1
  H  H86  1  0.562146  0.139841  0.355666  1
  H  H87  1  1.062146  0.639841  0.355666  1
  H  H88  1  0.597060  0.669119  0.338604  1
  H  H89  1  0.913970  0.252014  0.365408  1
  H  H90  1  0.455921  0.279133  0.346713  1
  H  H91  1  0.955921  0.779133  0.346713  1
  H  H92  1  0.413970  0.752014  0.365408  1
  H  H93  1  0.809392  0.391342  0.356264  1
  H  H94  1  0.350171  0.418313  0.337340  1
  H  H95  1  0.850171  0.918313  0.337340  1
  H  H96  1  0.309392  0.891342  0.356264  1
  H  H97  1  1.123941  -0.027057  0.384311  1
  H  H98  1  0.589765  0.943251  0.402234  1
  H  H99  1  1.089765  0.443251  0.402234  1
  H  H100  1  0.623941  0.472943  0.384311  1
  H  H101  1  0.253377  0.123212  0.376752  1
  H  H102  1  0.708843  0.043636  0.410339  1
  H  H103  1  0.208843  0.543636  0.410339  1
  H  H104  1  0.753377  0.623212  0.376752  1
  H  H105  1  1.066467  0.207020  0.404397  1
  H  H106  1  0.603075  0.183667  0.400889  1
  H  H107  1  1.103075  0.683667  0.400889  1
  H  H108  1  0.566467  0.707020  0.404397  1
  H  H109  1  0.962248  0.345968  0.395065  1
  H  H110  1  0.497448  0.323237  0.391620  1
  H  H111  1  0.997448  0.823237  0.391620  1
  H  H112  1  0.462248  0.845968  0.395065  1
  H  H113  1  0.891239  -0.037654  0.382326  1
  H  H114  1  0.357461  -0.015200  0.386078  1
  H  H115  1  0.857461  0.484800  0.386078  1
  H  H116  1  0.391239  0.462346  0.382326  1
  H  H117  1  1.018387  0.112148  0.375042  1
  H  H118  1  0.483845  0.083075  0.392896  1
  H  H119  1  0.983845  0.583075  0.392896  1
  H  H120  1  0.518387  0.612148  0.375042  1
  H  H121  1  0.833775  0.195454  0.402688  1
  H  H122  1  0.378227  0.222467  0.383827  1
  H  H123  1  0.878227  0.722467  0.383827  1
  H  H124  1  0.333775  0.695454  0.402688  1
  H  H125  1  0.729285  0.334146  0.393370  1
  H  H126  1  0.272827  0.361668  0.374566  1
  H  H127  1  0.772827  0.861668  0.374566  1
  H  H128  1  0.229285  0.834146  0.393370  1
  H  H129  1  1.042744  0.918386  0.422016  1
  H  H130  1  0.519971  0.877094  0.439167  1
  H  H131  1  1.019971  0.377094  0.439167  1
  H  H132  1  0.542744  0.418386  0.422016  1
  H  H133  1  1.170414  0.067608  0.414079  1
  H  H134  1  0.639264  -0.023280  0.447813  1
  H  H135  1  1.139264  0.476720  0.447813  1
  H  H136  1  0.670414  0.567608  0.414079  1
  H  H137  1  0.981459  0.150770  0.442916  1
  H  H138  1  0.530337  0.119892  0.438316  1
  H  H139  1  1.030337  0.619892  0.438316  1
  H  H140  1  0.481459  0.650770  0.442916  1
  H  H141  1  0.878872  0.289222  0.433137  1
  H  H142  1  0.422523  0.261986  0.429045  1
  H  H143  1  0.922523  0.761986  0.429045  1
  H  H144  1  0.378872  0.789222  0.433137  1
  H  H145  1  0.815370  0.903123  0.419831  1
  H  H146  1  0.275090  0.928252  0.423651  1
  H  H147  1  0.775090  0.428252  0.423651  1
  H  H148  1  0.315370  0.403123  0.419831  1
  H  H149  1  0.937983  0.056731  0.412416  1
  H  H150  1  0.411320  0.019743  0.429935  1
  H  H151  1  0.911320  0.519743  0.429935  1
  H  H152  1  0.437983  0.556731  0.412416  1
  H  H153  1  0.749517  0.143236  0.440878  1
  H  H154  1  0.303306  0.161406  0.420626  1
  H  H155  1  0.803306  0.661406  0.420626  1
  H  H156  1  0.249517  0.643236  0.440878  1
  H  H157  1  0.646652  0.280553  0.431412  1
  H  H158  1  0.196103  0.302518  0.411373  1
  H  H159  1  0.696103  0.802518  0.411373  1
  H  H160  1  1.146652  0.780553  0.431412  1
  H  H161  1  0.955090  0.868492  0.460251  1
  H  H162  1  0.458604  0.802333  0.476840  1
  H  H163  1  0.958604  0.302333  0.476840  1
  H  H164  1  0.455090  0.368492  0.460251  1
  H  H165  1  1.083692  0.012678  0.452962  1
  H  H166  1  0.577875  0.899108  0.485313  1
  H  H167  1  1.077875  0.399108  0.485313  1
  H  H168  1  0.583692  0.512678  0.452962  1
  H  H169  1  0.887226  0.100161  0.482399  1
  H  H170  1  0.466668  0.044164  0.475766  1
  H  H171  1  0.966668  0.544164  0.475766  1
  H  H172  1  0.387226  0.600161  0.482399  1
  H  H173  1  0.786523  0.237386  0.472585  1
  H  H174  1  0.357372  0.188345  0.466327  1
  H  H175  1  0.857372  0.688345  0.466327  1
  H  H176  1  0.286523  0.737386  0.472585  1
  H  H177  1  0.748603  0.832513  0.457081  1
  H  H178  1  0.185803  0.874919  0.462836  1
  H  H179  1  0.685803  0.374919  0.462836  1
  H  H180  1  0.248603  0.332513  0.457081  1
  H  H181  1  0.852514  0.005916  0.450581  1
  H  H182  1  0.348817  0.946643  0.467394  1
  H  H183  1  0.848817  0.446643  0.467394  1
  H  H184  1  0.352514  0.505916  0.450581  1
  H  H185  1  0.657705  0.093733  0.479425  1
  H  H186  1  0.237965  0.090686  0.457940  1
  H  H187  1  0.737965  0.590686  0.457940  1
  H  H188  1  1.157705  0.593733  0.479425  1
  H  H189  1  0.556203  0.231142  0.469795  1
  H  H190  1  1.128564  0.234050  0.448495  1
  H  H191  1  0.628564  0.734050  0.448495  1
  H  H192  1  1.056203  0.731142  0.469795  1
  H  H193  1  1.090435  0.825510  0.501880  1
  H  H194  1  0.518074  0.822602  0.523180  1
  H  H195  1  1.018074  0.322602  0.523180  1
  H  H196  1  0.590435  0.325510  0.501880  1
  H  H197  1  0.988933  -0.037082  0.492250  1
  H  H198  1  0.408673  -0.034034  0.513735  1
  H  H199  1  0.908673  0.465966  0.513735  1
  H  H200  1  0.488933  0.462918  0.492250  1
  H  H201  1  0.794124  0.050736  0.521094  1
  H  H202  1  0.297821  0.110009  0.504281  1
  H  H203  1  0.797821  0.610009  0.504281  1
  H  H204  1  0.294124  0.550736  0.521094  1
  H  H205  1  0.898035  0.224139  0.514594  1
  H  H206  1  0.460836  0.181733  0.508839  1
  H  H207  1  0.960836  0.681733  0.508839  1
  H  H208  1  0.398035  0.724139  0.514594  1
  H  H209  1  0.860115  0.819266  0.499090  1
  H  H210  1  0.289266  0.868307  0.505348  1
  H  H211  1  0.789266  0.368307  0.505348  1
  H  H212  1  0.360115  0.319266  0.499090  1
  H  H213  1  0.759413  0.956490  0.489276  1
  H  H214  1  0.179970  0.012488  0.495909  1
  H  H215  1  0.679970  0.512488  0.495909  1
  H  H216  1  0.259413  0.456490  0.489276  1
  H  H217  1  0.562947  0.043974  0.518713  1
  H  H218  1  1.068763  0.157544  0.486362  1
  H  H219  1  0.568763  0.657544  0.486362  1
  H  H220  1  1.062947  0.543974  0.518713  1
  H  H221  1  0.691549  0.188160  0.511424  1
  H  H222  1  0.188034  0.254319  0.494835  1
  H  H223  1  0.688034  0.754319  0.494835  1
  H  H224  1  0.191549  0.688160  0.511424  1
  H  H225  1  0.999986  0.776099  0.540263  1
  H  H226  1  0.450535  0.754134  0.560302  1
  H  H227  1  0.950535  0.254134  0.560302  1
  H  H228  1  0.499986  0.276099  0.540263  1
  H  H229  1  0.897122  0.913416  0.530796  1
  H  H230  1  0.343332  0.895246  0.551049  1
  H  H231  1  0.843332  0.395246  0.551049  1
  H  H232  1  0.397122  0.413416  0.530796  1
  H  H233  1  0.708656  -0.000080  0.559259  1
  H  H234  1  0.235318  0.036909  0.541740  1
  H  H235  1  0.735318  0.536909  0.541740  1
  H  H236  1  0.208656  0.499920  0.559259  1
  H  H237  1  0.831268  0.153529  0.551844  1
  H  H238  1  0.371548  0.128400  0.548023  1
  H  H239  1  0.871548  0.628400  0.548023  1
  H  H240  1  0.331268  0.653529  0.551844  1
  H  H241  1  0.767766  0.767429  0.538538  1
  H  H242  1  0.224115  0.794666  0.542630  1
  H  H243  1  0.724115  0.294666  0.542630  1
  H  H244  1  0.267766  0.267429  0.538538  1
  H  H245  1  0.665179  0.905882  0.528759  1
  H  H246  1  1.116301  0.936760  0.533359  1
  H  H247  1  0.616301  0.436760  0.533359  1
  H  H248  1  1.165179  0.405882  0.528759  1
  H  H249  1  0.476225  -0.010957  0.557596  1
  H  H250  1  1.007374  0.079932  0.523861  1
  H  H251  1  0.507374  0.579932  0.523861  1
  H  H252  1  0.976225  0.489043  0.557596  1
  H  H253  1  0.603894  0.138266  0.549659  1
  H  H254  1  1.126667  0.179558  0.532508  1
  H  H255  1  0.626667  0.679558  0.532508  1
  H  H256  1  1.103894  0.638266  0.549659  1
  H  H257  1  0.917353  0.722505  0.578305  1
  H  H258  1  0.373811  0.694984  0.597109  1
  H  H259  1  0.873811  0.194984  0.597109  1
  H  H260  1  0.417353  0.222505  0.578305  1
  H  H261  1  0.812863  0.861198  0.568987  1
  H  H262  1  0.268411  0.834184  0.587848  1
  H  H263  1  0.768411  0.334184  0.587848  1
  H  H264  1  0.312863  0.361198  0.568987  1
  H  H265  1  0.628251  0.944504  0.596633  1
  H  H266  1  1.162793  -0.026423  0.578779  1
  H  H267  1  0.662793  0.473577  0.578779  1
  H  H268  1  1.128251  0.444504  0.596633  1
  H  H269  1  0.755399  0.094306  0.589349  1
  H  H270  1  0.289177  0.071852  0.585597  1
  H  H271  1  0.789177  0.571852  0.585597  1
  H  H272  1  0.255399  0.594306  0.589349  1
  H  H273  1  0.684390  0.710684  0.576610  1
  H  H274  1  1.149190  0.733415  0.580055  1
  H  H275  1  0.649190  0.233415  0.580055  1
  H  H276  1  0.184390  0.210684  0.576610  1
  H  H277  1  0.580171  0.849631  0.567278  1
  H  H278  1  1.043564  0.872985  0.570786  1
  H  H279  1  0.543564  0.372985  0.570786  1
  H  H280  1  1.080171  0.349631  0.567278  1
  H  H281  1  0.393261  0.933440  0.594923  1
  H  H282  1  0.937796  0.013016  0.561336  1
  H  H283  1  0.437796  0.513016  0.561336  1
  H  H284  1  0.893261  0.433440  0.594923  1
  H  H285  1  0.522697  0.083709  0.587364  1
  H  H286  1  1.056873  0.113401  0.569441  1
  H  H287  1  0.556873  0.613401  0.569441  1
  H  H288  1  1.022697  0.583709  0.587364  1
  H  H289  1  0.837247  0.665310  0.615410  1
  H  H290  1  0.296467  0.638339  0.634335  1
  H  H291  1  0.796467  0.138339  0.634335  1
  H  H292  1  0.337247  0.165310  0.615410  1
  H  H293  1  0.732668  0.804637  0.606267  1
  H  H294  1  0.190717  0.777519  0.624962  1
  H  H295  1  0.690717  0.277519  0.624962  1
  H  H296  1  0.232668  0.304637  0.606267  1
  H  H297  1  0.549579  0.887533  0.633071  1
  H  H298  1  1.084492  0.916811  0.616009  1
  H  H299  1  0.584492  0.416811  0.616009  1
  H  H300  1  1.049579  0.387533  0.633071  1
  H  H301  1  0.677507  0.036938  0.626331  1
  H  H302  1  0.206213  0.017261  0.622643  1
  H  H303  1  0.706213  0.517261  0.622643  1
  H  H304  1  0.177507  0.536938  0.626331  1
  H  H305  1  0.601002  0.655198  0.613453  1
  H  H306  1  1.071372  0.676079  0.617504  1
  H  H307  1  0.571372  0.176079  0.617504  1
  H  H308  1  1.101002  0.155198  0.613453  1
  H  H309  1  0.496437  0.794358  0.604550  1
  H  H310  1  0.966311  0.815449  0.608438  1
  H  H311  1  0.466311  0.315449  0.608438  1
  H  H312  1  0.996437  0.294358  0.604550  1
  H  H313  1  0.310786  0.878218  0.631688  1
  H  H314  1  0.861212  0.955012  0.598963  1
  H  H315  1  0.361212  0.455012  0.598963  1
  H  H316  1  0.810786  0.378218  0.631688  1
  H  H317  1  0.442997  0.026917  0.624254  1
  H  H318  1  0.979058  0.055906  0.606746  1
  H  H319  1  0.479058  0.555906  0.606746  1
  H  H320  1  0.942997  0.526917  0.624254  1
  H  H321  1  0.756907  0.608623  0.652501  1
  H  H322  1  0.218207  0.580674  0.670740  1
  H  H323  1  0.718207  0.080674  0.670740  1
  H  H324  1  0.256907  0.108623  0.652501  1
  H  H325  1  0.652322  0.746443  0.642830  1
  H  H326  1  1.112915  0.721250  0.661931  1
  H  H327  1  0.612915  0.221250  0.661931  1
  H  H328  1  1.152322  0.246443  0.642830  1
  H  H329  1  0.465543  0.833703  0.669076  1
  H  H330  1  1.008099  0.859874  0.653253  1
  H  H331  1  0.508099  0.359874  0.653253  1
  H  H332  1  0.965543  0.333703  0.669076  1
  H  H333  1  0.597087  -0.020645  0.662950  1
  H  H334  1  1.128165  -0.036822  0.660437  1
  H  H335  1  0.628165  0.463178  0.660437  1
  H  H336  1  1.097087  0.479355  0.662950  1
  H  H337  1  0.521990  0.601147  0.651601  1
  H  H338  1  0.991144  0.619066  0.654416  1
  H  H339  1  0.491144  0.119066  0.654416  1
  H  H340  1  1.021990  0.101147  0.651601  1
  H  H341  1  0.415764  0.737779  0.641681  1
  H  H342  1  0.886466  0.757913  0.645388  1
  H  H343  1  0.386466  0.257913  0.645388  1
  H  H344  1  0.915764  0.237779  0.641681  1
  H  H345  1  0.234174  0.823672  0.669355  1
  H  H346  1  0.782848  0.897316  0.635948  1
  H  H347  1  0.282848  0.397316  0.635948  1
  H  H348  1  0.734174  0.323672  0.669355  1
  H  H349  1  0.362515  -0.029125  0.660914  1
  H  H350  1  0.902183  -0.000949  0.644216  1
  H  H351  1  0.402183  0.499051  0.644216  1
  H  H352  1  0.862515  0.470875  0.660914  1
  H  H353  1  0.673800  0.560183  0.691710  1
  H  H354  1  1.154386  0.517935  0.708838  1
  H  H355  1  0.654386  0.017935  0.708838  1
  H  H356  1  0.173800  0.060183  0.691710  1
  H  H357  1  0.571561  0.698422  0.682115  1
  H  H358  1  1.045901  0.658662  0.699855  1
  H  H359  1  0.545901  0.158662  0.699855  1
  H  H360  1  1.071561  0.198422  0.682115  1
  H  H361  1  0.395173  0.785264  0.708810  1
  H  H362  1  0.930130  0.799931  0.690816  1
  H  H363  1  0.430130  0.299931  0.690816  1
  H  H364  1  0.895173  0.285264  0.708810  1
  H  H365  1  0.528985  0.914976  0.701296  1
  H  H366  1  1.050945  0.906086  0.698406  1
  H  H367  1  0.550945  0.406086  0.698406  1
  H  H368  1  1.028985  0.414976  0.701296  1
  H  H369  1  0.438501  0.545018  0.690178  1
  H  H370  1  0.917309  0.557068  0.692368  1
  H  H371  1  0.417309  0.057068  0.692368  1
  H  H372  1  0.938501  0.045018  0.690178  1
  H  H373  1  0.336834  0.682625  0.680116  1
  H  H374  1  0.809874  0.697707  0.683571  1
  H  H375  1  0.309874  0.197707  0.683571  1
  H  H376  1  0.836834  0.182625  0.680116  1
  H  H377  1  1.160375  0.766269  0.707492  1
  H  H378  1  0.702000  0.837012  0.673115  1
  H  H379  1  0.202000  0.337012  0.673115  1
  H  H380  1  0.660375  0.266269  0.707492  1
  H  H381  1  0.283022  0.922376  0.699873  1
  H  H382  1  0.823257  0.937813  0.680867  1
  H  H383  1  0.323257  0.437813  0.680867  1
  H  H384  1  0.783022  0.422376  0.699873  1
