data_YHO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.22
_cell_length_b   3.56
_cell_length_c   4.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YHO2
_chemical_formula_sum   'Y4 H4 O8'
_cell_volume   196.47
_cell_formula_units_Z   4
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
  Y  Y0  1  0.6  0.89  0.3  1.0
  Y  Y1  1  0.99  0.89  0.16  1.0
  Y  Y2  1  0.23  0.67  0.76  1.0
  Y  Y3  1  0.62  0.67  0.62  1.0
  H  H4  1  0.59  0.89  0.5  1.0
  H  H5  1  0.98  0.89  0.97  1.0
  H  H6  1  0.24  0.67  0.96  1.0
  H  H7  1  0.63  0.67  0.43  1.0
  O  O8  1  0.66  0.89  0.03  1.0
  O  O9  1  0.45  0.67  0.94  1.0
  O  O10  1  0.06  0.67  0.52  1.0
  O  O11  1  0.27  0.89  0.44  1.0
  O  O12  1  0.95  0.67  0.49  1.0
  O  O13  1  0.16  0.89  0.41  1.0
  O  O14  1  0.77  0.89  0.98  1.0
  O  O15  1  0.56  0.67  0.9  1.0

data_YHO2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.56
_cell_length_b   4.92
_cell_length_c   11.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   YHO2
_chemical_formula_sum   'Y4 H4 O8'
_cell_volume   196.47
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Y  Y0  2  0.39  0.16  0.51  1.0
  Y  Y1  2  0.39  0.3  0.12  1.0
  H  H2  2  0.39  0.5  0.13  1.0
  H  H3  2  0.39  0.97  0.52  1.0
  O  O4  2  0.39  0.03  0.84  1.0
  O  O5  2  0.39  0.06  0.95  1.0
  O  O6  2  0.39  0.44  0.45  1.0
  O  O7  2  0.39  0.48  0.34  1.0

Y Y Y Y H H H H O O O O O O O O