data_Cd2CoTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86
_cell_length_b   3.86
_cell_length_c   5.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2CoTe
_chemical_formula_sum   'Cd2 Co1 Te1'
_cell_volume   83.31
_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
  Cd  Cd0  1  0.93  0.93  0.27  1.0
  Cd  Cd1  1  0.93  0.93  0.32  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.0  0.79  1.0

data_Cd2CoTe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.46
_cell_length_b   5.46
_cell_length_c   5.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cd2CoTe
_chemical_formula_sum   'Cd4 Co2 Te2'
_cell_volume   166.62
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Cd  Cd0  2  0.43  0.5  0.27  1.0
  Cd  Cd1  2  0.43  0.5  0.32  1.0
  Co  Co2  2  0.0  0.0  0.0  1.0
  Te  Te3  2  0.0  0.0  0.79  1.0

Cd Cd Co Te
Cd Cd Co Te 0 1 o o o 2 3 o o - 