# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27454926
_cell_length_b   9.46935143
_cell_length_c   42.96378796
_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   H45
_cell_volume   925.375816718
_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  0.634525  0.867828  0.346080  1
  H  H2  1  0.634525  0.259989  0.334662  1
  H  H3  1  0.634525  0.476975  0.357404  1
  H  H4  1  0.134525  0.683151  0.371371  1
  H  H5  1  0.134525  0.075766  0.359910  1
  H  H6  1  0.134525  0.290472  0.383272  1
  H  H7  1  0.134525  0.502471  0.406369  1
  H  H8  1  0.134525  0.896594  0.395210  1
  H  H9  1  0.634525  0.104346  0.407670  1
  H  H10  1  0.634525  0.317230  0.431045  1
  H  H11  1  0.634525  0.709978  0.419325  1
  H  H12  1  0.634525  0.924049  0.442872  1
  H  H13  1  0.134525  0.131522  0.455610  1
  H  H14  1  0.634525  0.530209  0.454390  1
  H  H15  1  0.134525  0.737656  0.467274  1
  H  H16  1  0.134525  0.951461  0.490833  1
  H  H17  1  0.134525  0.344610  0.479032  1
  H  H18  1  0.134525  0.557634  0.502443  1
  H  H19  1  0.634525  0.765079  0.515297  1
  H  H20  1  0.634525  0.158924  0.503631  1
  H  H21  1  0.634525  0.371985  0.527056  1
  H  H22  1  0.634525  0.585032  0.550480  1
  H  H23  1  0.634525  0.978854  0.538838  1
  H  H24  1  0.134525  0.186306  0.551651  1
  H  H25  1  0.134525  0.399373  0.575079  1
  H  H26  1  0.134525  0.792482  0.563320  1
  H  H27  1  0.134525  1.006244  0.586857  1
  H  H28  1  0.634525  0.213685  0.599665  1
  H  H29  1  0.134525  0.612422  0.598510  1
  H  H30  1  0.634525  0.819887  0.611341  1
  H  H31  1  0.634525  0.033644  0.634886  1
  H  H32  1  0.634525  0.426750  0.623100  1
  H  H33  1  0.634525  0.639860  0.646526  1
  H  H34  1  0.134525  0.847299  0.659338  1
  H  H35  1  0.134525  0.241035  0.647649  1
  H  H36  1  0.134525  0.454359  0.671039  1
  H  H37  1  0.134525  0.667498  0.694386  1
  H  H38  1  0.134525  0.060727  0.682856  1
  H  H39  1  0.634525  0.268630  0.695352  1
  H  H40  1  0.634525  0.481193  0.719005  1
  H  H41  1  0.634525  0.873792  0.707166  1
  H  H42  1  0.634525  0.090003  0.730623  1
  H  H43  1  0.134525  0.298279  0.744654  1
  H  H44  1  0.634525  0.690903  0.743086  1
  H  H45  1  0.134525  0.904759  0.755515  1
