# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.34840400
_cell_length_b   6.26274781
_cell_length_c   32.49465195
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.23918086
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H24
_cell_volume   463.231089762
_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  0.715853  0.434812  0.513643  1
  H  H2  1  0.888550  0.807503  0.495456  1
  H  H3  1  0.356918  0.696283  0.554483  1
  H  H4  1  0.546251  0.070805  0.533933  1
  H  H5  1  0.001316  -0.044837  0.592123  1
  H  H6  1  0.182766  0.327570  0.573470  1
  H  H7  1  0.638491  0.209238  0.630628  1
  H  H8  1  0.819501  0.582582  0.611863  1
  H  H9  1  0.276421  0.464522  0.668801  1
  H  H10  1  0.457837  0.837675  0.649488  1
  H  H11  1  -0.085127  0.720453  0.707011  1
  H  H12  1  0.095622  0.092408  0.687916  1
  H  H13  1  0.553205  -0.023950  0.745360  1
  H  H14  1  0.733954  0.348005  0.726265  1
  H  H15  1  0.190990  0.230783  0.783788  1
  H  H16  1  0.372405  0.603935  0.764475  1
  H  H17  1  0.829326  0.485875  0.821413  1
  H  H18  1  0.010335  0.859220  0.802648  1
  H  H19  1  0.466061  0.740887  0.859806  1
  H  H20  1  0.647511  0.113294  0.841153  1
  H  H21  1  0.102575  -0.002348  0.899343  1
  H  H22  1  0.291909  0.372174  0.878793  1
  H  H23  1  0.760277  0.260954  0.937820  1
  H  H24  1  -0.067026  0.633645  0.919633  1
