data_[Ac6Pr3Tm2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.6325]
_cell_length_b [8.5480]
_cell_length_c [8.5479]
_cell_angle_alpha [107.1998]
_cell_angle_beta [97.4554]
_cell_angle_gamma [104.8863]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ac6Pr3Tm2]
_chemical_formula_sum '[Ac6 Pr3 Tm2]'
_cell_volume [436.1563]
_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
[
  Ac  Ac0  2  0.1786  0.7357  0.6297  1
  Ac  Ac1  2  0.3644  0.4500  0.2695  1
  Ac  Ac2  2  0.4459  0.8195  0.0981  1
  Pr  Pr3  2  0.0939  0.3560  0.8140  1
  Pr  Pr4  1  0.0000  0.0000  0.0000  1
  Tm  Tm5  2  0.2676  0.0865  0.4543  1
]