# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.46715857
_cell_length_b   3.69925573
_cell_length_c   47.83668232
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   70.34574918
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H28
_cell_volume   577.803083027
_cell_formula_units_Z   14
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  0.379926  0.732249  0.283157  1
  H  H2  1  0.721061  0.114731  0.299717  1
  H  H3  1  0.039010  0.494371  0.315701  1
  H  H4  1  0.355631  0.882573  0.331456  1
  H  H5  1  0.665002  0.276554  0.346905  1
  H  H6  1  0.974019  0.673074  0.362341  1
  H  H7  1  0.281118  0.072113  0.377711  1
  H  H8  1  0.587930  0.471124  0.393126  1
  H  H9  1  0.894942  0.869590  0.408505  1
  H  H10  1  0.202138  0.267595  0.423901  1
  H  H11  1  0.509415  0.665570  0.439308  1
  H  H12  1  0.816658  0.063588  0.454709  1
  H  H13  1  0.123859  0.461694  0.470110  1
  H  H14  1  0.431033  0.859829  0.485513  1
  H  H15  1  0.738224  0.257964  0.500911  1
  H  H16  1  0.045398  0.656098  0.516314  1
  H  H17  1  0.352598  0.054204  0.531716  1
  H  H18  1  0.659842  0.452223  0.547116  1
  H  H19  1  0.967119  0.850197  0.562523  1
  H  H20  1  0.274314  0.248202  0.577920  1
  H  H21  1  0.581326  0.646669  0.593298  1
  H  H22  1  0.888138  0.045679  0.608713  1
  H  H23  1  0.195237  0.444719  0.624083  1
  H  H24  1  0.504254  0.841238  0.639520  1
  H  H25  1  0.813625  0.235220  0.654968  1
  H  H26  1  0.130246  0.623421  0.670723  1
  H  H27  1  0.448196  1.003061  0.686707  1
  H  H28  1  0.789330  0.385543  0.703267  1
