data_[Ga2H2O2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [2.6447]
_cell_length_b [3.2730]
_cell_length_c [8.0908]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.5076]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [GaHO]
_chemical_formula_sum '[Ga2 H2 O2]'
_cell_volume [69.8177]
_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
[
  Ga  Ga0  2  0.2588  0.7500  0.6488  1
  H  H1  2  0.3485  0.7500  0.1403  1
  O  O2  2  0.2978  0.2500  0.8086  1
]