# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.26980344
_cell_length_b   5.70111401
_cell_length_c   49.81836562
_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   H32
_cell_volume   644.669987044
_cell_formula_units_Z   16
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  0.611524  0.377089  0.262535  1
  H  H2  1  0.611524  0.067912  0.290543  1
  H  H3  1  1.111524  0.412438  0.304645  1
  H  H4  1  1.111524  0.728292  0.276038  1
  H  H5  1  0.611524  0.752857  0.318303  1
  H  H6  1  0.611524  0.438240  0.346030  1
  H  H7  1  1.111524  0.780839  0.359843  1
  H  H8  1  1.111524  0.096025  0.332087  1
  H  H9  1  0.611524  0.123173  0.373740  1
  H  H10  1  0.611524  0.808310  0.401519  1
  H  H11  1  1.111524  0.150859  0.415410  1
  H  H12  1  1.111524  0.465834  0.387644  1
  H  H13  1  0.611524  0.493406  0.429305  1
  H  H14  1  0.611524  0.178474  0.457079  1
  H  H15  1  1.111524  0.521018  0.470970  1
  H  H16  1  1.111524  0.835939  0.443188  1
  H  H17  1  0.611524  0.863549  0.484856  1
  H  H18  1  0.611524  0.548628  0.512637  1
  H  H19  1  1.111524  0.891161  0.526520  1
  H  H20  1  1.111524  0.206093  0.498746  1
  H  H21  1  0.611524  0.233708  0.540415  1
  H  H22  1  0.611524  0.918733  0.568181  1
  H  H23  1  1.111524  0.261394  0.582085  1
  H  H24  1  1.111524  0.576257  0.554306  1
  H  H25  1  0.611524  0.603728  0.595982  1
  H  H26  1  0.611524  0.288542  0.623738  1
  H  H27  1  1.111524  0.631710  0.637522  1
  H  H28  1  1.111524  0.946327  0.609795  1
  H  H29  1  0.611524  0.972129  0.651180  1
  H  H30  1  0.611524  0.656275  0.679787  1
  H  H31  1  1.111524  0.007478  0.693290  1
  H  H32  1  1.111524  0.316656  0.665282  1
