data_[Ga1H2O1]
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 [P1]
_cell_length_a [3.1207]
_cell_length_b [3.1202]
_cell_length_c [7.8462]
_cell_angle_alpha [85.7196]
_cell_angle_beta [82.3801]
_cell_angle_gamma [60.0409]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [GaH2O]
_chemical_formula_sum '[Ga1 H2 O1]'
_cell_volume [65.6024]
_cell_formula_units_Z [1]
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  1  0.0222  0.2948  0.2986  1
  H  H1  1  0.2075  0.0678  0.7646  1
  H  H2  1  0.3101  0.8898  0.8378  1
  O  O3  1  0.3846  0.6307  0.2082  1
]