data_LaTb2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96
_cell_length_b   6.96
_cell_length_c   6.96
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTb2O4
_chemical_formula_sum   'La2 Tb4 O8'
_cell_volume   238.19
_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
  La  La0  1  0.0  0.0  0.0  1.0
  La  La1  1  0.46  0.46  0.46  1.0
  Tb  Tb10  1  0.69  0.69  0.15  1.0
  Tb  Tb11  1  0.69  0.15  0.69  1.0
  Tb  Tb12  1  0.15  0.69  0.69  1.0
  Tb  Tb13  1  0.15  0.15  0.15  1.0
  O  O2  1  0.82  0.82  0.82  1.0
  O  O3  1  0.82  0.02  0.02  1.0
  O  O4  1  0.02  0.82  0.02  1.0
  O  O5  1  0.28  0.28  0.48  1.0
  O  O6  1  0.02  0.02  0.82  1.0
  O  O7  1  0.28  0.48  0.28  1.0
  O  O8  1  0.48  0.48  0.48  1.0
  O  O9  1  0.48  0.28  0.28  1.0

data_LaTb2O4
_symmetry_space_group_name_H-M   R3m
_cell_length_a   6.96
_cell_length_b   6.96
_cell_length_c   17.04
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   LaTb2O4
_chemical_formula_sum   'La6 Tb12 O24'
_cell_volume   714.56
_cell_formula_units_Z   6
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  Tb  Tb0  9  0.03  0.51  0.82  1.0
  La  La1  3  0.0  0.0  0.0  1.0
  La  La2  3  0.0  0.0  0.54  1.0
  Tb  Tb3  3  0.0  0.0  0.85  1.0
  O  O4  9  0.07  0.13  0.65  1.0
  O  O5  9  0.13  0.07  0.05  1.0
  O  O6  3  0.0  0.0  0.18  1.0
  O  O7  3  0.0  0.0  0.52  1.0

La La Tb Tb Tb Tb O O O O O O O O
La La Tb Tb Tb Tb O O O O O O O O 0 8 o - o 0 7 - o o 0 10 o o - 0 5 o o o 1 12 o o o 1 2 o o o 1 3 o o o 1 4 o o o 1 5 + o o 1 5 o + o 1 5 o o + 2 12 o o o 2 6 o o - 2 5 + o o 2 5 o + o 3 12 o o o 3 6 o - o 3 5 + o o 3 5 o o + 4 6 - o o 4 12 o o o 4 5 o + o 4 5 o o + 5 10 o o - 5 10 o o o 5 11 o - o 5 11 o o o 5 8 o - o 5 8 o o o 5 7 - o o 5 7 o o o 5 6 - - o 5 6 - o - 5 6 o - - 5 13 - o o 5 13 o o o 5 12 - o o 5 12 o - o 5 12 o o - 5 9 o o - 5 9 o o o 7 8 + - o 7 10 + o - 8 10 o + - 9 13 o o o 9 11 o o o 11 13 o o o 