data_TaTlV
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.28
_cell_length_b   7.06
_cell_length_c   2.98
_cell_angle_alpha   82.16
_cell_angle_beta   73.9
_cell_angle_gamma   23.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTlV
_chemical_formula_sum   'Ta1 Tl1 V1'
_cell_volume   56.86
_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
  Ta  Ta0  1  0.69  0.45  0.5  1.0
  Tl  Tl1  1  0.69  0.45  0.2  1.0
  V  V2  1  0.69  0.45  0.7  1.0

data_TaTlV
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.39
_cell_length_b   13.7
_cell_length_c   2.98
_cell_angle_alpha   90.0
_cell_angle_beta   124.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TaTlV
_chemical_formula_sum   'Ta2 Tl2 V2'
_cell_volume   113.72
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ta  Ta0  2  0.45  0.0  0.81  1.0
  Tl  Tl1  2  0.45  0.0  0.11  1.0
  V  V2  2  0.45  0.0  0.6  1.0

Ta Tl V