data_[La1Pm3Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pm  1.1300  1.8500  1.1100
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [5.6952]
_cell_length_b [5.6952]
_cell_length_c [8.7528]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [LaPm3Zn8]
_chemical_formula_sum '[La1 Pm3 Zn8]'
_cell_volume [245.8627]
_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
[
  La  La0  1  0.0000  0.0000  0.5513  1
  Pm  Pm1  1  0.0000  0.0000  0.9495  1
  Pm  Pm2  1  0.6667  0.3333  0.0553  1
  Pm  Pm3  1  0.6667  0.3333  0.4454  1
  Zn  Zn4  3  0.0011  0.5005  0.7524  1
  Zn  Zn5  3  0.1707  0.3413  0.2475  1
  Zn  Zn6  1  0.3333  0.6667  0.5017  1
  Zn  Zn7  1  0.3333  0.6667  0.9974  1
]