data_CaCr2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.9
_cell_length_b   4.84
_cell_length_c   4.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCr2Te
_chemical_formula_sum   'Ca1 Cr2 Te1'
_cell_volume   90.3
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.97  0.42  0.88  1.0
  Cr  Cr2  1  0.89  0.42  0.9  1.0
  Te  Te3  1  0.93  0.0  0.39  1.0

data_CaCr2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.9
_cell_length_b   4.79
_cell_length_c   4.84
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCr2Te
_chemical_formula_sum   'Ca1 Cr2 Te1'
_cell_volume   90.3
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.03  0.12  0.58  1.0
  Cr  Cr2  1  0.11  0.1  0.58  1.0
  Te  Te3  1  0.07  0.61  0.0  1.0

Ca Cr Cr Te