# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.28147382
_cell_length_b   3.83379094
_cell_length_c   49.55355888
_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   H22
_cell_volume   433.429799856
_cell_formula_units_Z   11
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  0.255605  0.253140  0.267153  1
  H  H2  1  0.755605  0.753140  0.283691  1
  H  H3  1  0.755605  0.253140  0.309496  1
  H  H4  1  0.255605  0.753140  0.325356  1
  H  H5  1  0.255605  0.253140  0.350855  1
  H  H6  1  0.755605  0.753140  0.366972  1
  H  H7  1  0.755605  0.253140  0.392450  1
  H  H8  1  0.255605  0.753140  0.408634  1
  H  H9  1  0.255605  0.253140  0.434085  1
  H  H10  1  0.755605  0.753140  0.450287  1
  H  H11  1  0.755605  0.253140  0.475728  1
  H  H12  1  0.255605  0.753140  0.491934  1
  H  H13  1  0.255605  0.253140  0.517376  1
  H  H14  1  0.755605  0.753140  0.533578  1
  H  H15  1  0.755605  0.253140  0.559028  1
  H  H16  1  0.255605  0.753140  0.575212  1
  H  H17  1  0.255605  0.253140  0.600690  1
  H  H18  1  0.755605  0.753140  0.616808  1
  H  H19  1  0.755605  0.253140  0.642307  1
  H  H20  1  0.255605  0.753140  0.658167  1
  H  H21  1  0.255605  0.253140  0.683971  1
  H  H22  1  0.755605  0.753140  0.700509  1
