# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27577075
_cell_length_b   8.02012248
_cell_length_c   47.89232713
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   98.23519777
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H44
_cell_volume   865.115199872
_cell_formula_units_Z   22
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  0.113568  0.712366  0.272733  1
  H  H2  1  0.346975  0.178994  0.294250  1
  H  H3  1  0.253183  0.991059  0.258685  1
  H  H4  1  0.481447  0.448378  0.278376  1
  H  H5  1  0.579346  0.644112  0.314789  1
  H  H6  1  0.813173  0.111718  0.335886  1
  H  H7  1  0.716340  0.917819  0.300568  1
  H  H8  1  0.950508  0.386444  0.320925  1
  H  H9  1  0.046213  0.578104  0.356581  1
  H  H10  1  0.279486  0.044599  0.377502  1
  H  H11  1  0.183070  0.851588  0.341749  1
  H  H12  1  0.416597  0.318796  0.362467  1
  H  H13  1  0.512686  0.511190  0.398305  1
  H  H14  1  0.745972  0.977824  0.419189  1
  H  H15  1  0.649757  0.785217  0.383367  1
  H  H16  1  0.883061  0.251927  0.404159  1
  H  H17  1  0.979192  0.444403  0.440012  1
  H  H18  1  0.212461  0.911032  0.460871  1
  H  H19  1  0.116278  0.718476  0.425029  1
  H  H20  1  0.349561  0.185144  0.445857  1
  H  H21  1  0.445696  0.377625  0.481708  1
  H  H22  1  0.678964  0.844260  0.502552  1
  H  H23  1  0.582789  0.651719  0.466706  1
  H  H24  1  0.816057  0.118354  0.487550  1
  H  H25  1  0.912192  0.310835  0.523402  1
  H  H26  1  0.145476  0.777502  0.544229  1
  H  H27  1  0.049293  0.584947  0.508388  1
  H  H28  1  0.282561  0.051575  0.529247  1
  H  H29  1  0.378692  0.244051  0.565100  1
  H  H30  1  0.611996  0.710762  0.585892  1
  H  H31  1  0.515781  0.518154  0.550070  1
  H  H32  1  0.749067  0.984788  0.570954  1
  H  H33  1  0.845156  0.177182  0.606791  1
  H  H34  1  0.078683  0.644390  0.627509  1
  H  H35  1  0.982267  0.451379  0.591757  1
  H  H36  1  0.215540  0.917874  0.612678  1
  H  H37  1  0.311245  0.109534  0.648334  1
  H  H38  1  0.545414  0.578160  0.668691  1
  H  H39  1  0.448580  0.384260  0.633373  1
  H  H40  1  0.682407  0.851867  0.654470  1
  H  H41  1  0.780306  0.047600  0.690883  1
  H  H42  1  0.008570  0.504919  0.710574  1
  H  H43  1  0.914778  0.316984  0.675008  1
  H  H44  1  0.148185  0.783612  0.696525  1
