# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84023162
_cell_length_b   5.36419547
_cell_length_c   45.93799335
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.81819713
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H40
_cell_volume   1064.44454535
_cell_formula_units_Z   20
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  0.766627  0.533255  0.276797  1
  H  H2  1  0.072196  0.144391  0.314112  1
  H  H3  1  0.452736  0.905472  0.299524  1
  H  H4  1  0.386087  0.772174  0.291385  1
  H  H5  1  0.138844  0.277689  0.322251  1
  H  H6  1  0.444413  0.888826  0.359567  1
  H  H7  1  0.824953  0.649906  0.344979  1
  H  H8  1  0.758304  0.516609  0.336840  1
  H  H9  1  0.511062  0.022123  0.367706  1
  H  H10  1  0.816630  0.633260  0.405021  1
  H  H11  1  0.197170  0.394340  0.390433  1
  H  H12  1  0.130521  0.261043  0.382294  1
  H  H13  1  0.883279  0.766558  0.413160  1
  H  H14  1  0.188847  0.377694  0.450476  1
  H  H15  1  0.569387  0.138775  0.435888  1
  H  H16  1  0.502739  0.005477  0.427749  1
  H  H17  1  0.255496  0.510992  0.458615  1
  H  H18  1  0.561064  0.122129  0.495930  1
  H  H19  1  0.941604  0.883209  0.481342  1
  H  H20  1  0.874956  0.749912  0.473203  1
  H  H21  1  0.627713  0.255426  0.504070  1
  H  H22  1  0.933282  0.866563  0.541385  1
  H  H23  1  0.313822  0.627643  0.526797  1
  H  H24  1  0.247173  0.494346  0.518658  1
  H  H25  1  0.999930  0.999860  0.549524  1
  H  H26  1  0.305499  0.610997  0.586840  1
  H  H27  1  0.686039  0.372078  0.572251  1
  H  H28  1  0.619390  0.238780  0.564112  1
  H  H29  1  0.372147  0.744295  0.594979  1
  H  H30  1  0.677716  0.355432  0.632294  1
  H  H31  1  0.058256  0.116512  0.617706  1
  H  H32  1  0.991607  0.983214  0.609567  1
  H  H33  1  0.744365  0.488729  0.640433  1
  H  H34  1  0.049933  0.099866  0.677749  1
  H  H35  1  0.430473  0.860946  0.663160  1
  H  H36  1  0.363824  0.727649  0.655021  1
  H  H37  1  0.116582  0.233163  0.685888  1
  H  H38  1  0.422150  0.844300  0.723203  1
  H  H39  1  0.802690  0.605381  0.708615  1
  H  H40  1  0.736042  0.472083  0.700476  1
