data_CoTePd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74
_cell_length_b   4.74
_cell_length_c   4.74
_cell_angle_alpha   128.63
_cell_angle_beta   128.63
_cell_angle_gamma   75.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTePd2
_chemical_formula_sum   'Co1 Te1 Pd2'
_cell_volume   63.19
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.05  0.87  1.0
  Pd  Pd1  1  0.05  0.0  0.87  1.0
  Pd  Pd2  1  0.0  0.0  0.74  1.0

data_CoTePd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.11
_cell_length_b   4.11
_cell_length_c   4.74
_cell_angle_alpha   115.69
_cell_angle_beta   115.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTePd2
_chemical_formula_sum   'Co1 Te1 Pd2'
_cell_volume   63.19
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.18  0.05  0.18  1.0
  Pd  Pd2  1  0.13  0.0  0.18  1.0
  Pd  Pd3  1  0.26  0.0  0.26  1.0

Co Te Pd Pd