data_[Tm6Zn6Co45]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.3405]
_cell_length_b [8.3405]
_cell_length_c [12.0713]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tm2Zn2Co15]
_chemical_formula_sum '[Tm6 Zn6 Co45]'
_cell_volume [727.2300]
_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
[
  Tm  Tm0  6  0.0000  0.0000  0.3485  1
  Zn  Zn1  6  0.0000  0.0000  0.1035  1
  Co  Co2  18  0.0000  0.2908  0.0000  1
  Co  Co3  18  0.0041  0.5020  0.1497  1
  Co  Co4  9  0.0000  0.5000  0.5000  1
]