# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.29327231
_cell_length_b   4.68108921
_cell_length_c   34.71367552
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.26920548
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H34
_cell_volume   695.270614768
_cell_formula_units_Z   17
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  0.900865  0.059697  0.440235  1
  H  H2  1  0.431603  -0.172041  0.452319  1
  H  H3  1  0.987601  0.571828  0.464576  1
  H  H4  1  0.538741  0.352022  0.476621  1
  H  H5  1  0.134652  0.124939  0.496572  1
  H  H6  1  0.700702  -0.095593  0.506759  1
  H  H7  1  0.267904  0.668380  0.519308  1
  H  H8  1  0.828605  0.451421  0.531554  1
  H  H9  1  0.415833  0.222597  0.547711  1
  H  H10  1  0.980290  -0.001264  0.560248  1
  H  H11  1  0.548571  0.769037  0.572975  1
  H  H12  1  0.115286  0.544806  0.585650  1
  H  H13  1  0.692068  0.319828  0.600349  1
  H  H14  1  0.261078  0.094344  0.613353  1
  H  H15  1  0.831149  -0.133654  0.626634  1
  H  H16  1  0.398139  0.641876  0.639553  1
  H  H17  1  0.971007  0.415239  0.653369  1
  H  H18  1  0.540599  0.189918  0.666535  1
  H  H19  1  0.113468  -0.036719  0.680350  1
  H  H20  1  0.680457  0.738812  0.693269  1
  H  H21  1  0.250528  0.510813  0.706551  1
  H  H22  1  0.819538  0.285330  0.719555  1
  H  H23  1  0.396320  0.060351  0.734253  1
  H  H24  1  0.963035  -0.163880  0.746929  1
  H  H25  1  0.531316  0.606421  0.759655  1
  H  H26  1  1.095773  0.382561  0.772192  1
  H  H27  1  0.683001  0.153736  0.788350  1
  H  H28  1  0.243703  -0.063223  0.800596  1
  H  H29  1  0.810905  0.700750  0.813144  1
  H  H30  1  0.376955  0.480219  0.823331  1
  H  H31  1  0.972865  0.253135  0.843282  1
  H  H32  1  0.524005  0.033329  0.855327  1
  H  H33  1  1.080003  0.777198  0.867585  1
  H  H34  1  0.610742  0.545460  0.879669  1
