data_Y2Th5O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   22.82
_cell_length_b   22.82
_cell_length_c   22.82
_cell_angle_alpha   9.86
_cell_angle_beta   9.86
_cell_angle_gamma   9.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2Th5O13
_chemical_formula_sum   'Y2 Th5 O13'
_cell_volume   302.86
_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
  Y  Y0  1  0.0  0.0  0.04  1.0
  Y  Y1  1  0.0  0.0  0.34  1.0
  Th  Th2  1  0.0  0.0  0.01  1.0
  Th  Th3  1  0.0  0.0  0.44  1.0
  Th  Th4  1  0.0  0.0  0.76  1.0
  Th  Th5  1  0.0  0.0  0.65  1.0
  Th  Th6  1  0.0  0.0  0.21  1.0
  O  O7  1  0.0  0.0  0.41  1.0
  O  O8  1  0.0  0.0  0.05  1.0
  O  O9  1  0.0  0.0  0.84  1.0
  O  O10  1  0.0  0.0  0.5  1.0
  O  O11  1  0.0  0.0  0.07  1.0
  O  O12  1  0.0  0.0  0.15  1.0
  O  O13  1  0.0  0.0  0.96  1.0
  O  O14  1  0.0  0.0  0.04  1.0
  O  O15  1  0.0  0.0  0.6  1.0
  O  O16  1  0.0  0.0  0.27  1.0
  O  O17  1  0.0  0.0  0.72  1.0
  O  O18  1  0.0  0.0  0.89  1.0
  O  O19  1  0.0  0.0  0.4  1.0

data_Y2Th5O13
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.8
_cell_length_b   3.92
_cell_length_c   22.82
_cell_angle_alpha   90.0
_cell_angle_beta   95.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Y2Th5O13
_chemical_formula_sum   'Y4 Th10 O26'
_cell_volume   605.72
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.0  0.0  0.66  1.0
  Y  Y1  2  0.0  0.0  0.96  1.0
  Th  Th2  2  0.0  0.0  0.24  1.0
  Th  Th3  2  0.0  0.0  0.35  1.0
  Th  Th4  2  0.0  0.0  0.56  1.0
  Th  Th5  2  0.0  0.0  0.79  1.0
  Th  Th6  2  0.0  0.0  0.99  1.0
  O  O7  2  0.0  0.0  0.04  1.0
  O  O8  2  0.0  0.0  0.11  1.0
  O  O9  2  0.0  0.0  0.16  1.0
  O  O10  2  0.0  0.0  0.28  1.0
  O  O11  2  0.0  0.0  0.4  1.0
  O  O12  2  0.0  0.0  0.5  1.0
  O  O13  2  0.0  0.0  0.59  1.0
  O  O14  2  0.0  0.0  0.6  1.0
  O  O15  2  0.0  0.0  0.73  1.0
  O  O16  2  0.0  0.0  0.85  1.0
  O  O17  2  0.0  0.0  0.93  1.0
  O  O18  2  0.0  0.0  0.95  1.0
  O  O19  2  0.0  0.0  0.96  1.0

Y Y Th Th Th Th Th O O O O O O O O O O O O O 0 14 o o o 0 2 o o o 0 8 o o o 1 19 o o o 1 16 o o o 2 14 o o o 2 13 o o - 3 7 o o o 3 10 o o o 4 17 o o o 5 15 o o o 6 12 o o o 6 16 o o o 7 19 o o o 8 14 o o o 8 11 o o o 9 18 o o o 13 18 o o o 