data_TaTl2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01
_cell_length_b   3.01
_cell_length_c   9.71
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTl2Mo
_chemical_formula_sum   'Ta1 Tl2 Mo1'
_cell_volume   80.98
_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  0.0  0.0  0.86  1.0
  Tl  Tl2  1  0.66  0.0  0.35  1.0
  Tl  Tl3  1  0.66  0.0  0.37  1.0
  Mo  Mo0  1  0.0  0.0  0.0  1.0

data_TaTl2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.01
_cell_length_b   3.01
_cell_length_c   9.71
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTl2Mo
_chemical_formula_sum   'Ta1 Tl2 Mo1'
_cell_volume   80.98
_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  0.0  0.0  0.86  1.0
  Tl  Tl1  1  0.66  0.0  0.35  1.0
  Tl  Tl2  1  0.66  0.0  0.37  1.0
  Mo  Mo3  1  0.0  0.0  0.0  1.0

Ta Tl Tl Mo
Ta Tl Tl Mo 0 3 o o + 1 2 o o o 