data_CeU2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62
_cell_length_b   8.62
_cell_length_c   8.62
_cell_angle_alpha   154.31
_cell_angle_beta   154.31
_cell_angle_gamma   36.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeU2O6
_chemical_formula_sum   'Ce1 U2 O6'
_cell_volume   120.16
_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
  Ce  Ce0  1  0.0  0.0  0.0  1.0
  U  U1  1  0.0  0.0  0.46  1.0
  U  U2  1  0.0  0.0  0.9  1.0
  O  O3  1  0.92  0.0  0.74  1.0
  O  O4  1  0.0  0.92  0.09  1.0
  O  O5  1  0.92  0.0  0.44  1.0
  O  O6  1  0.92  0.0  0.09  1.0
  O  O7  1  0.0  0.92  0.44  1.0
  O  O8  1  0.0  0.92  0.74  1.0

data_CeU2O6
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.42
_cell_length_b   5.42
_cell_length_c   8.62
_cell_angle_alpha   90.0
_cell_angle_beta   108.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CeU2O6
_chemical_formula_sum   'Ce2 U4 O12'
_cell_volume   240.32
_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
  Ce  Ce0  2  0.0  0.0  0.0  1.0
  U  U1  2  0.0  0.0  0.1  1.0
  U  U2  2  0.0  0.0  0.54  1.0
  O  O3  4  0.46  0.46  0.18  1.0
  O  O4  4  0.46  0.46  0.47  1.0
  O  O5  4  0.46  0.46  0.82  1.0

Ce U U O O O O O O