# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27439788
_cell_length_b   11.27662759
_cell_length_c   50.04036425
_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   H66
_cell_volume   1283.41213923
_cell_formula_units_Z   33
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  0.610289  0.237152  0.278162  1
  H  H2  1  0.610289  0.607617  0.265423  1
  H  H3  1  0.610289  -0.015713  0.253415  1
  H  H4  1  1.110289  0.065550  0.288792  1
  H  H5  1  1.110289  0.421540  0.271943  1
  H  H6  1  1.110289  0.794852  0.259120  1
  H  H7  1  0.610289  0.166110  0.322130  1
  H  H8  1  0.610289  0.523967  0.307114  1
  H  H9  1  0.610289  0.886194  0.294568  1
  H  H10  1  1.110289  -0.015252  0.329422  1
  H  H11  1  1.110289  0.342116  0.313691  1
  H  H12  1  1.110289  0.705695  0.300623  1
  H  H13  1  0.610289  0.085504  0.363593  1
  H  H14  1  0.610289  0.443759  0.348622  1
  H  H15  1  0.610289  0.804294  0.335606  1
  H  H16  1  1.110289  0.904303  0.370573  1
  H  H17  1  1.110289  0.265642  0.356188  1
  H  H18  1  1.110289  0.624000  0.341984  1
  H  H19  1  0.610289  0.004974  0.405125  1
  H  H20  1  0.610289  0.365083  0.390763  1
  H  H21  1  0.610289  0.723879  0.377086  1
  H  H22  1  1.110289  0.824346  0.412006  1
  H  H23  1  1.110289  0.185445  0.397993  1
  H  H24  1  1.110289  0.544036  0.383680  1
  H  H25  1  0.610289  0.924856  0.446700  1
  H  H26  1  0.610289  0.285228  0.432579  1
  H  H27  1  0.610289  0.644294  0.418686  1
  H  H28  1  1.110289  0.744694  0.453578  1
  H  H29  1  1.110289  0.105171  0.439678  1
  H  H30  1  1.110289  0.464836  0.425542  1
  H  H31  1  0.610289  0.844972  0.488352  1
  H  H32  1  0.610289  0.205151  0.474289  1
  H  H33  1  0.610289  0.564935  0.460388  1
  H  H34  1  1.110289  0.665209  0.495246  1
  H  H35  1  1.110289  0.024994  0.481345  1
  H  H36  1  1.110289  0.385172  0.467282  1
  H  H37  1  0.610289  0.765309  0.530092  1
  H  H38  1  0.610289  0.124973  0.515956  1
  H  H39  1  0.610289  0.485450  0.502056  1
  H  H40  1  1.110289  0.585850  0.536948  1
  H  H41  1  1.110289  0.944916  0.523055  1
  H  H42  1  1.110289  0.305289  0.508934  1
  H  H43  1  0.610289  0.686108  0.571954  1
  H  H44  1  0.610289  0.044699  0.557641  1
  H  H45  1  0.610289  0.405799  0.543628  1
  H  H46  1  1.110289  0.506265  0.578548  1
  H  H47  1  1.110289  0.865062  0.564871  1
  H  H48  1  1.110289  0.225170  0.550509  1
  H  H49  1  0.610289  0.606144  0.613650  1
  H  H50  1  0.610289  0.964502  0.599446  1
  H  H51  1  0.610289  0.325842  0.585061  1
  H  H52  1  1.110289  0.425850  0.620028  1
  H  H53  1  1.110289  0.786385  0.607012  1
  H  H54  1  1.110289  0.144640  0.592041  1
  H  H55  1  0.610289  0.524450  0.655011  1
  H  H56  1  0.610289  0.888028  0.641943  1
  H  H57  1  0.610289  0.245396  0.626212  1
  H  H58  1  1.110289  0.343950  0.661067  1
  H  H59  1  1.110289  0.706177  0.648520  1
  H  H60  1  1.110289  0.064035  0.633504  1
  H  H61  1  0.610289  0.435292  0.696514  1
  H  H62  1  0.610289  0.808604  0.683691  1
  H  H63  1  0.610289  0.164594  0.666842  1
  H  H64  1  1.110289  0.245858  0.702220  1
  H  H65  1  1.110289  0.622528  0.690211  1
  H  H66  1  1.110289  -0.007007  0.677472  1
