data_Tl2VSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   5.41
_cell_angle_alpha   133.99
_cell_angle_beta   133.99
_cell_angle_gamma   67.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2VSi
_chemical_formula_sum   'Tl2 V1 Si1'
_cell_volume   80.57
_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  0.11  0.0  0.25  1.0
  Tl  Tl2  1  0.0  0.0  0.51  1.0
  V  V3  1  0.0  0.11  0.25  1.0
  Si  Si0  1  0.0  0.0  0.0  1.0

data_Tl2VSi
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.23
_cell_length_b   4.23
_cell_length_c   5.41
_cell_angle_alpha   113.01
_cell_angle_beta   113.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2VSi
_chemical_formula_sum   'Tl2 V1 Si1'
_cell_volume   80.57
_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  0.49  0.0  0.49  1.0
  Tl  Tl1  1  0.75  0.0  0.86  1.0
  V  V2  1  0.86  0.11  0.86  1.0
  Si  Si3  1  0.0  0.0  0.0  1.0

Tl Tl V Si
Tl Tl V Si 0 2 o o o 0 1 o o o 0 3 o o o 1 2 o o o 2 3 o o o 