# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.70330980
_cell_length_b   2.25791116
_cell_length_c   61.08184518
_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   H52
_cell_volume   1062.42030399
_cell_formula_units_Z   26
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  0.968073  0.944044  0.177345  1
  H  H2  1  0.705176  0.944044  0.160347  1
  H  H3  1  0.468073  0.444044  0.177345  1
  H  H4  1  0.205176  0.444044  0.160347  1
  H  H5  1  0.995071  0.444044  0.211250  1
  H  H6  1  0.731347  0.444044  0.194655  1
  H  H7  1  0.495071  0.944044  0.211250  1
  H  H8  1  0.231347  0.944044  0.194655  1
  H  H9  1  0.022506  0.944044  0.245087  1
  H  H10  1  0.758841  0.944044  0.228239  1
  H  H11  1  0.522506  0.444044  0.245087  1
  H  H12  1  0.258841  0.444044  0.228239  1
  H  H13  1  0.049706  0.444044  0.278941  1
  H  H14  1  0.786110  0.444044  0.262039  1
  H  H15  1  0.549706  0.944044  0.278941  1
  H  H16  1  0.286110  0.944044  0.262039  1
  H  H17  1  0.076895  0.944044  0.312785  1
  H  H18  1  0.813299  0.944044  0.295871  1
  H  H19  1  0.576895  0.444044  0.312785  1
  H  H20  1  0.313299  0.444044  0.295871  1
  H  H21  1  0.104085  0.444044  0.346626  1
  H  H22  1  0.840490  0.444044  0.329708  1
  H  H23  1  0.604085  0.944044  0.346626  1
  H  H24  1  0.340490  0.944044  0.329708  1
  H  H25  1  0.131276  0.944044  0.380465  1
  H  H26  1  0.867681  0.944044  0.363546  1
  H  H27  1  0.631276  0.444044  0.380465  1
  H  H28  1  0.367681  0.444044  0.363546  1
  H  H29  1  0.158467  0.444044  0.414304  1
  H  H30  1  0.894872  0.444044  0.397386  1
  H  H31  1  0.658467  0.944044  0.414304  1
  H  H32  1  0.394872  0.944044  0.397386  1
  H  H33  1  0.185658  0.944044  0.448141  1
  H  H34  1  0.922062  0.944044  0.431226  1
  H  H35  1  0.685658  0.444044  0.448141  1
  H  H36  1  0.422062  0.444044  0.431226  1
  H  H37  1  0.212847  0.444044  0.481972  1
  H  H38  1  0.949252  0.444044  0.465070  1
  H  H39  1  0.712847  0.944044  0.481972  1
  H  H40  1  0.449252  0.944044  0.465070  1
  H  H41  1  0.240116  0.944044  0.515772  1
  H  H42  1  0.976452  0.944044  0.498924  1
  H  H43  1  0.740116  0.444044  0.515772  1
  H  H44  1  0.476452  0.444044  0.498924  1
  H  H45  1  0.267610  0.444044  0.549356  1
  H  H46  1  0.003886  0.444044  0.532761  1
  H  H47  1  0.767610  0.944044  0.549356  1
  H  H48  1  0.503886  0.944044  0.532761  1
  H  H49  1  0.293782  0.944044  0.583664  1
  H  H50  1  0.030884  0.944044  0.566666  1
  H  H51  1  0.793782  0.444044  0.583664  1
  H  H52  1  0.530884  0.444044  0.566666  1
