data_LiHO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   3.44
_cell_angle_alpha   109.17
_cell_angle_beta   109.17
_cell_angle_gamma   95.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHO2
_chemical_formula_sum   'Li2 H2 O4'
_cell_volume   78.68
_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
  Li  Li0  1  0.45  0.59  0.0  1.0
  Li  Li1  1  0.45  0.41  0.0  1.0
  H  H2  1  0.97  0.0  0.92  1.0
  H  H3  1  0.24  0.0  0.07  1.0
  O  O4  1  0.89  0.0  0.9  1.0
  O  O5  1  0.32  0.0  0.1  1.0
  O  O6  1  0.61  0.63  0.5  1.0
  O  O7  1  0.61  0.37  0.5  1.0

data_LiHO2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.44
_cell_length_b   5.13
_cell_length_c   5.13
_cell_angle_alpha   95.66
_cell_angle_beta   109.17
_cell_angle_gamma   109.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHO2
_chemical_formula_sum   'Li2 H2 O4'
_cell_volume   78.68
_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
  Li  Li0  1  -0.0  0.45  0.41  1.0
  Li  Li1  1  -0.0  0.45  0.59  1.0
  H  H2  1  0.07  0.24  0.0  1.0
  H  H3  1  0.92  0.97  0.0  1.0
  O  O4  1  0.1  0.32  0.0  1.0
  O  O5  1  0.5  0.61  0.37  1.0
  O  O6  1  0.5  0.61  0.63  1.0
  O  O7  1  0.9  0.89  0.0  1.0

Li Li H H O O O O