data_PrTlO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.15
_cell_length_b   6.15
_cell_length_c   6.15
_cell_angle_alpha   58.06
_cell_angle_beta   58.06
_cell_angle_gamma   58.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrTlO3
_chemical_formula_sum   'Pr2 Tl2 O6'
_cell_volume   157.44
_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
  Pr  Pr6  1  0.0  0.0  0.06  1.0
  Pr  Pr7  1  0.0  0.0  0.23  1.0
  Tl  Tl8  1  0.0  0.0  0.48  1.0
  Tl  Tl9  1  0.0  0.0  0.82  1.0
  O  O0  1  0.75  0.35  0.36  1.0
  O  O1  1  0.05  0.74  0.36  1.0
  O  O2  1  0.2  0.9  0.36  1.0
  O  O3  1  0.8  0.1  0.93  1.0
  O  O4  1  0.95  0.26  0.93  1.0
  O  O5  1  0.25  0.65  0.93  1.0

data_PrTlO3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   5.97
_cell_length_b   5.97
_cell_length_c   6.15
_cell_angle_alpha   60.97
_cell_angle_beta   60.97
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   PrTlO3
_chemical_formula_sum   'Pr2 Tl2 O6'
_cell_volume   157.44
_cell_formula_units_Z   2
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
  Pr  Pr0  2  0.0  0.41  0.09  1.0
  Tl  Tl1  2  0.0  0.17  0.33  1.0
  O  O2  2  0.1  0.28  0.32  1.0
  O  O3  2  0.26  0.28  0.01  1.0
  O  O4  2  0.35  0.72  0.68  1.0

Pr Pr Tl Tl O O O O O O