data_Tl2CrCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84
_cell_length_b   4.84
_cell_length_c   5.23
_cell_angle_alpha   106.04
_cell_angle_beta   106.04
_cell_angle_gamma   41.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CrCo
_chemical_formula_sum   'Tl2 Cr1 Co1'
_cell_volume   77.65
_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
  Tl  Tl2  1  0.48  0.0  0.32  1.0
  Tl  Tl3  1  0.02  0.0  0.68  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.75  0.0  0.5  1.0

data_Tl2CrCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.44
_cell_length_b   4.84
_cell_length_c   5.23
_cell_angle_alpha   106.04
_cell_angle_beta   90.0
_cell_angle_gamma   110.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CrCo
_chemical_formula_sum   'Tl2 Cr1 Co1'
_cell_volume   77.65
_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
  Tl  Tl0  1  0.0  0.52  0.68  1.0
  Tl  Tl1  1  0.0  0.98  0.32  1.0
  Cr  Cr2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.25  0.5  1.0

Tl Tl Cr Co
Tl Tl Cr Co 0 3 o o o 1 3 - o o 1 2 o o + 