data_TlTe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   6.21
_cell_angle_alpha   143.23
_cell_angle_beta   123.19
_cell_angle_gamma   69.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlTe2Pd
_chemical_formula_sum   'Tl1 Te2 Pd1'
_cell_volume   117.78
_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
  Tl  Tl3  1  0.0  0.0  0.1  1.0
  Te  Te1  1  0.0  0.95  0.3  1.0
  Te  Te2  1  0.96  0.0  0.8  1.0
  Pd  Pd0  1  0.0  0.0  0.0  1.0

data_TlTe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.91
_cell_length_b   5.9
_cell_length_c   6.21
_cell_angle_alpha   118.4
_cell_angle_beta   108.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlTe2Pd
_chemical_formula_sum   'Tl1 Te2 Pd1'
_cell_volume   117.78
_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
  Tl  Tl0  1  0.0  0.1  0.1  1.0
  Te  Te1  1  0.0  0.8  0.84  1.0
  Te  Te2  1  0.05  0.35  0.35  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

Tl Te Te Pd