# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84013018
_cell_length_b   3.84013067
_cell_length_c   5.04666155
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H4
_cell_volume   64.45057248
_cell_formula_units_Z   2
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  H0  1  0.33333300  0.66666700  0.17649588  1.0
  H  H1  1  0.66666700  0.33333300  0.67649588  1.0
  H  H2  1  0.66666700  0.33333300  0.82350412  1.0
  H  H3  1  0.33333300  0.66666700  0.32350412  1.0