data_TaMnTl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26
_cell_length_b   3.29
_cell_length_c   7.83
_cell_angle_alpha   90.0
_cell_angle_beta   99.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMnTl2
_chemical_formula_sum   'Ta1 Mn1 Tl2'
_cell_volume   82.78
_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  Ta1  1  0.79  0.64  0.33  1.0
  Mn  Mn0  1  0.43  0.0  0.24  1.0
  Tl  Tl2  1  0.03  0.0  0.43  1.0
  Tl  Tl3  1  0.0  0.64  0.3  1.0

data_TaMnTl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   3.29
_cell_length_c   7.83
_cell_angle_alpha   90.0
_cell_angle_beta   99.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMnTl2
_chemical_formula_sum   'Ta1 Mn1 Tl2'
_cell_volume   82.78
_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  0.79  0.64  0.33  1.0
  Mn  Mn1  1  0.43  0.0  0.24  1.0
  Tl  Tl2  1  0.0  0.64  0.3  1.0
  Tl  Tl3  1  0.03  0.0  0.43  1.0

Ta Mn Tl Tl