data_HfTl2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49
_cell_length_b   6.49
_cell_length_c   4.8
_cell_angle_alpha   110.6
_cell_angle_beta   110.6
_cell_angle_gamma   28.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTl2Os
_chemical_formula_sum   'Hf1 Tl2 Os1'
_cell_volume   90.08
_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
  Hf  Hf0  1  0.01  0.0  0.49  1.0
  Tl  Tl2  1  0.41  0.0  0.33  1.0
  Tl  Tl3  1  0.08  0.0  0.13  1.0
  Os  Os1  1  0.6  0.0  0.23  1.0

data_HfTl2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   4.8
_cell_length_c   6.49
_cell_angle_alpha   110.6
_cell_angle_beta   104.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTl2Os
_chemical_formula_sum   'Hf1 Tl2 Os1'
_cell_volume   90.08
_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
  Hf  Hf0  1  0.0  0.49  0.01  1.0
  Tl  Tl1  1  0.0  0.13  0.08  1.0
  Tl  Tl2  1  0.0  0.33  0.41  1.0
  Os  Os3  1  0.0  0.23  0.6  1.0

Hf Tl Tl Os
Hf Tl Tl Os 0 2 o o o 1 3 o o o 1 2 o o o 