# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08278418
_cell_length_b   3.56186890
_cell_length_c   46.09859674
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   125.19878421
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H48
_cell_volume   816.156826975
_cell_formula_units_Z   24
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  0.477610  0.763288  0.288153  1
  H  H2  1  0.977610  0.763288  0.288153  1
  H  H3  1  0.476311  0.923164  0.304813  1
  H  H4  1  0.976311  0.923164  0.304813  1
  H  H5  1  0.474773  0.112326  0.324524  1
  H  H6  1  0.974773  0.112326  0.324524  1
  H  H7  1  0.473363  0.285785  0.342600  1
  H  H8  1  0.973363  0.285785  0.342600  1
  H  H9  1  0.471901  0.465713  0.361349  1
  H  H10  1  0.971901  0.465713  0.361349  1
  H  H11  1  0.470464  0.642524  0.379773  1
  H  H12  1  0.970464  0.642524  0.379773  1
  H  H13  1  0.469016  0.820752  0.398345  1
  H  H14  1  0.969016  0.820752  0.398345  1
  H  H15  1  0.467573  0.998316  0.416848  1
  H  H16  1  0.967573  0.998316  0.416848  1
  H  H17  1  0.466127  0.176187  0.435383  1
  H  H18  1  0.966127  0.176187  0.435383  1
  H  H19  1  0.464683  0.353915  0.453903  1
  H  H20  1  0.964683  0.353915  0.453903  1
  H  H21  1  0.463238  0.531710  0.472430  1
  H  H22  1  0.963238  0.531710  0.472430  1
  H  H23  1  0.461793  0.709471  0.490953  1
  H  H24  1  0.961793  0.709471  0.490953  1
  H  H25  1  0.460348  0.887254  0.509479  1
  H  H26  1  0.960348  0.887254  0.509479  1
  H  H27  1  0.458904  0.065015  0.528002  1
  H  H28  1  0.958904  0.065015  0.528002  1
  H  H29  1  0.457459  0.242810  0.546529  1
  H  H30  1  0.957459  0.242810  0.546529  1
  H  H31  1  0.456014  0.420538  0.565049  1
  H  H32  1  0.956014  0.420538  0.565049  1
  H  H33  1  0.454569  0.598409  0.583584  1
  H  H34  1  0.954569  0.598409  0.583584  1
  H  H35  1  0.453126  0.775973  0.602087  1
  H  H36  1  0.953126  0.775973  0.602087  1
  H  H37  1  0.451677  0.954201  0.620659  1
  H  H38  1  0.951677  0.954201  0.620659  1
  H  H39  1  0.450240  0.131012  0.639083  1
  H  H40  1  0.950240  0.131012  0.639083  1
  H  H41  1  0.448778  0.310940  0.657832  1
  H  H42  1  0.948778  0.310940  0.657832  1
  H  H43  1  0.447368  0.484399  0.675908  1
  H  H44  1  0.947368  0.484399  0.675908  1
  H  H45  1  0.445831  0.673561  0.695619  1
  H  H46  1  0.945831  0.673561  0.695619  1
  H  H47  1  0.444531  0.833437  0.712279  1
  H  H48  1  0.944531  0.833437  0.712279  1
