data_ZnTe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   6.15
_cell_angle_alpha   105.75
_cell_angle_beta   105.75
_cell_angle_gamma   50.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnTe2Pd
_chemical_formula_sum   'Zn1 Te2 Pd1'
_cell_volume   94.9
_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
  Zn  Zn3  1  0.21  0.0  0.54  1.0
  Te  Te1  1  0.11  0.0  0.5  1.0
  Te  Te2  1  0.04  0.0  0.94  1.0
  Pd  Pd0  1  0.61  0.0  0.82  1.0

data_ZnTe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.91
_cell_length_b   4.58
_cell_length_c   6.15
_cell_angle_alpha   105.75
_cell_angle_beta   90.0
_cell_angle_gamma   115.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnTe2Pd
_chemical_formula_sum   'Zn1 Te2 Pd1'
_cell_volume   94.9
_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
  Zn  Zn0  1  0.0  0.79  0.46  1.0
  Te  Te1  1  0.0  0.89  0.5  1.0
  Te  Te2  1  0.0  0.96  0.06  1.0
  Pd  Pd3  1  0.0  0.39  0.18  1.0

Zn Te Te Pd
Zn Te Te Pd 0 1 o o o 0 3 o o o 2 3 - o o 