data_Ta2SnTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   3.17
_cell_angle_alpha   100.87
_cell_angle_beta   100.87
_cell_angle_gamma   111.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2SnTe
_chemical_formula_sum   'Ta2 Sn1 Te1'
_cell_volume   82.97
_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  0.01  0.25  0.5  1.0
  Ta  Ta2  1  0.01  0.75  0.5  1.0
  Sn  Sn0  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.08  0.0  0.0  1.0

data_Ta2SnTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   5.45
_cell_length_c   5.45
_cell_angle_alpha   111.24
_cell_angle_beta   100.87
_cell_angle_gamma   100.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2SnTe
_chemical_formula_sum   'Ta2 Sn1 Te1'
_cell_volume   82.97
_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  0.5  0.01  0.25  1.0
  Ta  Ta1  1  0.5  0.01  0.75  1.0
  Sn  Sn2  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.08  0.0  1.0

Ta Ta Sn Te