data_Tl3Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44
_cell_length_b   6.44
_cell_length_c   6.44
_cell_angle_alpha   148.24
_cell_angle_beta   65.48
_cell_angle_gamma   124.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl3Ga
_chemical_formula_sum   'Tl3 Ga1'
_cell_volume   114.77
_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
  Tl  Tl1  1  0.0  0.42  0.19  1.0
  Tl  Tl2  1  0.0  0.91  0.94  1.0
  Tl  Tl3  1  0.76  0.5  0.93  1.0
  Ga  Ga0  1  0.0  0.0  0.95  1.0

data_Tl3Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.52
_cell_length_b   6.01
_cell_length_c   6.44
_cell_angle_alpha   117.81
_cell_angle_beta   105.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl3Ga
_chemical_formula_sum   'Tl3 Ga1'
_cell_volume   114.77
_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
  Tl  Tl0  1  0.42  0.22  0.22  1.0
  Tl  Tl1  1  0.74  0.57  0.81  1.0
  Tl  Tl2  1  0.91  0.98  0.98  1.0
  Ga  Ga3  1  -0.0  0.05  0.05  1.0

Tl Tl Tl Ga
Tl Tl Tl Ga 0 3 o o - 1 3 o + o 1 2 - o o 2 3 + + o 