data_TlCo2Re
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   4.74
_cell_angle_alpha   100.71
_cell_angle_beta   100.71
_cell_angle_gamma   35.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCo2Re
_chemical_formula_sum   'Tl1 Co2 Re1'
_cell_volume   58.16
_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  Tl3  1  0.53  0.0  0.63  1.0
  Co  Co0  1  0.08  0.0  0.05  1.0
  Co  Co1  1  0.42  0.0  0.29  1.0
  Re  Re2  1  0.93  0.0  0.01  1.0

data_TlCo2Re
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   4.67
_cell_length_c   4.74
_cell_angle_alpha   100.71
_cell_angle_beta   90.0
_cell_angle_gamma   107.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCo2Re
_chemical_formula_sum   'Tl1 Co2 Re1'
_cell_volume   58.16
_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  0.47  0.37  1.0
  Co  Co1  1  0.0  0.58  0.71  1.0
  Co  Co2  1  0.0  0.92  0.95  1.0
  Re  Re3  1  0.0  0.07  0.99  1.0

Tl Co Co Re