data_ZrMnTl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47
_cell_length_b   5.47
_cell_length_c   5.4
_cell_angle_alpha   110.09
_cell_angle_beta   110.09
_cell_angle_gamma   35.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrMnTl2
_chemical_formula_sum   'Zr1 Mn1 Tl2'
_cell_volume   87.92
_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
  Zr  Zr3  1  0.24  0.0  0.52  1.0
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Tl  Tl1  1  0.2  0.0  0.18  1.0
  Tl  Tl2  1  0.27  0.0  0.85  1.0

data_ZrMnTl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   5.4
_cell_length_c   5.47
_cell_angle_alpha   110.09
_cell_angle_beta   107.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrMnTl2
_chemical_formula_sum   'Zr1 Mn1 Tl2'
_cell_volume   87.92
_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
  Zr  Zr0  1  0.0  0.52  0.24  1.0
  Mn  Mn1  1  0.0  0.0  0.0  1.0
  Tl  Tl2  1  0.0  0.18  0.2  1.0
  Tl  Tl3  1  0.0  0.85  0.27  1.0

Zr Mn Tl Tl