data_TlCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.65
_cell_length_b   6.65
_cell_length_c   3.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCo2
_chemical_formula_sum   'Tl3 Co6'
_cell_volume   144.36
_cell_formula_units_Z   3
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  Tl6  1  0.0  0.84  0.89  1.0
  Tl  Tl7  1  0.32  0.92  0.89  1.0
  Tl  Tl8  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.65  0.0  0.89  1.0
  Co  Co1  1  0.17  0.43  0.89  1.0
  Co  Co2  1  0.5  0.32  0.89  1.0
  Co  Co3  1  0.93  0.0  0.0  1.0
  Co  Co4  1  0.04  0.4  0.0  1.0
  Co  Co5  1  0.36  0.35  0.0  1.0

data_TlCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.77
_cell_length_b   6.65
_cell_length_c   6.65
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCo2
_chemical_formula_sum   'Tl3 Co6'
_cell_volume   144.36
_cell_formula_units_Z   3
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  0.0  0.0  1.0
  Tl  Tl1  1  0.89  0.0  0.84  1.0
  Tl  Tl2  1  0.89  0.32  0.92  1.0
  Co  Co3  1  0.0  0.04  0.4  1.0
  Co  Co4  1  0.0  0.36  0.35  1.0
  Co  Co5  1  0.0  0.93  0.0  1.0
  Co  Co6  1  0.89  0.17  0.43  1.0
  Co  Co7  1  0.89  0.5  0.32  1.0
  Co  Co8  1  0.89  0.65  0.0  1.0

Tl Tl Tl Co Co Co Co Co Co