# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.30412706
_cell_length_b   3.99030847
_cell_length_c   50.79591047
_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   H24
_cell_volume   467.026628192
_cell_formula_units_Z   12
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  0.723694  0.148261  0.250709  1
  H  H2  1  1.223694  0.648261  0.250709  1
  H  H3  1  0.723694  0.814903  0.288237  1
  H  H4  1  1.223694  0.314903  0.288237  1
  H  H5  1  0.723694  0.481559  0.325079  1
  H  H6  1  1.223694  -0.018441  0.325079  1
  H  H7  1  0.723694  0.148214  0.362098  1
  H  H8  1  1.223694  0.648214  0.362098  1
  H  H9  1  0.723694  0.814868  0.399127  1
  H  H10  1  1.223694  0.314868  0.399127  1
  H  H11  1  0.723694  0.481522  0.436155  1
  H  H12  1  1.223694  -0.018478  0.436155  1
  H  H13  1  0.723694  0.148176  0.473182  1
  H  H14  1  1.223694  0.648176  0.473182  1
  H  H15  1  0.723694  0.814829  0.510210  1
  H  H16  1  1.223694  0.314829  0.510210  1
  H  H17  1  0.723694  0.481483  0.547240  1
  H  H18  1  1.223694  -0.018517  0.547240  1
  H  H19  1  0.723694  0.148139  0.584258  1
  H  H20  1  1.223694  0.648139  0.584258  1
  H  H21  1  0.723694  0.814794  0.621100  1
  H  H22  1  1.223694  0.314794  0.621100  1
  H  H23  1  0.723694  0.481436  0.658629  1
  H  H24  1  1.223694  -0.018564  0.658629  1
