data_CrCu2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   4.28
_cell_angle_alpha   105.1
_cell_angle_beta   105.1
_cell_angle_gamma   47.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCu2Te
_chemical_formula_sum   'Cr1 Cu2 Te1'
_cell_volume   67.49
_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
  Cr  Cr0  1  0.11  0.0  1.0  1.0
  Cu  Cu1  1  0.86  0.0  0.97  1.0
  Cu  Cu2  1  0.32  0.0  0.37  1.0
  Te  Te3  1  0.57  0.0  0.93  1.0

data_CrCu2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.82
_cell_length_b   4.28
_cell_length_c   4.71
_cell_angle_alpha   105.1
_cell_angle_beta   113.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCu2Te
_chemical_formula_sum   'Cr1 Cu2 Te1'
_cell_volume   67.49
_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
  Cr  Cr0  1  0.0  1.0  0.11  1.0
  Cu  Cu1  1  0.0  0.37  0.32  1.0
  Cu  Cu2  1  0.0  0.97  0.86  1.0
  Te  Te3  1  0.0  0.93  0.57  1.0

Cr Cu Cu Te