# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27811553
_cell_length_b   23.93199948
_cell_length_c   48.37475419
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H132
_cell_volume   2637.3848055
_cell_formula_units_Z   66
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  0.252206  0.961582  0.266258  1
  H  H2  1  0.252206  0.267591  0.309866  1
  H  H3  1  0.752206  0.628698  0.263694  1
  H  H4  1  0.752206  0.782804  0.285820  1
  H  H5  1  0.752206  0.117518  0.279804  1
  H  H6  1  0.252206  0.449883  0.282526  1
  H  H7  1  0.752206  0.720985  0.250726  1
  H  H8  1  0.752206  0.027236  0.293933  1
  H  H9  1  0.252206  0.357469  0.295271  1
  H  H10  1  0.252206  0.868775  0.279152  1
  H  H11  1  0.252206  0.205809  0.274509  1
  H  H12  1  0.752206  0.537621  0.277286  1
  H  H13  1  0.752206  0.936106  0.307682  1
  H  H14  1  0.752206  0.243589  0.350926  1
  H  H15  1  0.252206  0.604597  0.305271  1
  H  H16  1  0.252206  0.758687  0.326891  1
  H  H17  1  0.252206  0.094424  0.321423  1
  H  H18  1  0.752206  0.425853  0.323721  1
  H  H19  1  0.252206  0.695579  0.291985  1
  H  H20  1  0.252206  1.003009  0.334911  1
  H  H21  1  0.752206  0.335055  0.337321  1
  H  H22  1  0.752206  0.845430  0.321216  1
  H  H23  1  0.752206  0.180349  0.315892  1
  H  H24  1  0.252206  0.513143  0.318698  1
  H  H25  1  0.252206  0.912459  0.348558  1
  H  H26  1  0.252206  0.219680  0.392086  1
  H  H27  1  0.752206  0.580304  0.346044  1
  H  H28  1  0.752206  0.734448  0.367890  1
  H  H29  1  0.752206  0.070362  0.362251  1
  H  H30  1  0.252206  0.402082  0.364693  1
  H  H31  1  0.752206  0.671777  0.332561  1
  H  H32  1  0.752206  0.979070  0.375984  1
  H  H33  1  0.252206  0.310805  0.378296  1
  H  H34  1  0.252206  0.821146  0.362268  1
  H  H35  1  0.252206  0.157023  0.356742  1
  H  H36  1  0.752206  0.488935  0.359555  1
  H  H37  1  0.752206  0.888391  0.389572  1
  H  H38  1  0.752206  0.195626  0.433181  1
  H  H39  1  0.252206  0.556244  0.387019  1
  H  H40  1  0.252206  0.710285  0.408893  1
  H  H41  1  0.252206  0.046394  0.403297  1
  H  H42  1  0.752206  0.378058  0.405749  1
  H  H43  1  0.252206  0.647633  0.373438  1
  H  H44  1  0.252206  0.955023  0.417051  1
  H  H45  1  0.752206  0.286878  0.419444  1
  H  H46  1  0.752206  0.797006  0.403331  1
  H  H47  1  0.752206  0.133010  0.397737  1
  H  H48  1  0.252206  0.464997  0.400640  1
  H  H49  1  0.252206  0.864323  0.430606  1
  H  H50  1  0.252206  0.171599  0.474253  1
  H  H51  1  0.752206  0.532269  0.428071  1
  H  H52  1  0.752206  0.686205  0.449908  1
  H  H53  1  0.752206  1.022360  0.444343  1
  H  H54  1  0.252206  0.354100  0.446857  1
  H  H55  1  0.752206  0.623577  0.414424  1
  H  H56  1  0.752206  0.930959  0.458096  1
  H  H57  1  0.252206  0.262867  0.460545  1
  H  H58  1  0.252206  0.772893  0.444356  1
  H  H59  1  0.252206  0.108996  0.438780  1
  H  H60  1  0.752206  0.441005  0.441718  1
  H  H61  1  0.752206  0.840240  0.471632  1
  H  H62  1  0.752206  0.147570  0.515304  1
  H  H63  1  0.252206  0.508263  0.469132  1
  H  H64  1  0.252206  0.662159  0.490939  1
  H  H65  1  0.252206  0.998307  0.485378  1
  H  H66  1  0.752206  0.330105  0.487951  1
  H  H67  1  0.252206  0.599554  0.455454  1
  H  H68  1  0.252206  0.906884  0.499127  1
  H  H69  1  0.752206  0.238862  0.501627  1
  H  H70  1  0.752206  0.748818  0.485381  1
  H  H71  1  0.752206  0.084965  0.479820  1
  H  H72  1  0.252206  0.417020  0.482808  1
  H  H73  1  0.252206  0.816165  0.512663  1
  H  H74  1  0.252206  0.123547  0.556335  1
  H  H75  1  0.752206  0.484257  0.510214  1
  H  H76  1  0.752206  0.638128  0.531979  1
  H  H77  1  0.752206  0.974231  0.526403  1
  H  H78  1  0.252206  0.306119  0.529041  1
  H  H79  1  0.752206  0.575526  0.496506  1
  H  H80  1  0.752206  0.882802  0.540153  1
  H  H81  1  0.252206  0.214856  0.542688  1
  H  H82  1  0.252206  0.724765  0.526416  1
  H  H83  1  0.252206  0.060919  0.520851  1
  H  H84  1  0.752206  0.393024  0.523902  1
  H  H85  1  0.752206  0.792101  0.553708  1
  H  H86  1  0.752206  0.099492  0.597321  1
  H  H87  1  0.252206  0.460246  0.551315  1
  H  H88  1  0.252206  0.614114  0.573022  1
  H  H89  1  0.252206  0.950119  0.567428  1
  H  H90  1  0.752206  0.282127  0.570119  1
  H  H91  1  0.252206  0.551498  0.537578  1
  H  H92  1  0.252206  0.858734  0.581187  1
  H  H93  1  0.752206  0.190880  0.583740  1
  H  H94  1  0.752206  0.700731  0.567461  1
  H  H95  1  0.752206  0.036840  0.561866  1
  H  H96  1  0.252206  0.369066  0.565010  1
  H  H97  1  0.252206  0.768055  0.594775  1
  H  H98  1  0.252206  0.075347  0.638198  1
  H  H99  1  0.752206  0.436319  0.592463  1
  H  H100  1  0.752206  0.590102  0.614017  1
  H  H101  1  0.752206  0.925979  0.608491  1
  H  H102  1  0.252206  0.258189  0.611204  1
  H  H103  1  0.752206  0.527444  0.578673  1
  H  H104  1  0.752206  0.834666  0.622201  1
  H  H105  1  0.252206  0.166821  0.624715  1
  H  H106  1  0.252206  0.676762  0.608508  1
  H  H107  1  0.252206  1.012676  0.602869  1
  H  H108  1  0.752206  0.345043  0.606066  1
  H  H109  1  0.752206  0.744115  0.635848  1
  H  H110  1  0.752206  0.051545  0.678774  1
  H  H111  1  0.252206  0.412070  0.633437  1
  H  H112  1  0.252206  0.566776  0.654867  1
  H  H113  1  0.252206  0.901694  0.649543  1
  H  H114  1  0.752206  0.233982  0.652061  1
  H  H115  1  0.252206  0.503535  0.619833  1
  H  H116  1  0.252206  0.811018  0.663077  1
  H  H117  1  0.752206  0.142528  0.665488  1
  H  H118  1  0.752206  0.652700  0.649336  1
  H  H119  1  0.752206  0.988438  0.643868  1
  H  H120  1  0.252206  0.321271  0.647038  1
  H  H121  1  0.252206  0.719889  0.676826  1
  H  H122  1  0.252206  0.026139  0.720033  1
  H  H123  1  0.752206  0.389655  0.675488  1
  H  H124  1  0.752206  0.541315  0.696250  1
  H  H125  1  0.752206  0.878349  0.691607  1
  H  H126  1  0.252206  0.209503  0.693473  1
  H  H127  1  0.752206  0.479533  0.660893  1
  H  H128  1  0.752206  0.785542  0.704501  1
  H  H129  1  0.252206  0.118426  0.707065  1
  H  H130  1  0.252206  0.629606  0.690955  1
  H  H131  1  0.252206  0.964321  0.684939  1
  H  H132  1  0.752206  0.297241  0.688233  1
