data_[Pm6Pr2Sc1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Pr  1.1300  1.8500  1.0600
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [3.6264]
_cell_length_b [3.6264]
_cell_length_c [26.8997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Pm6Pr2Sc]
_chemical_formula_sum '[Pm6 Pr2 Sc1]'
_cell_volume [306.3630]
_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
[
  Pm  Pm0  2  0.0000  0.0000  0.2116  1
  Pm  Pm1  2  0.0000  0.0000  0.4365  1
  Pr  Pr2  2  0.3333  0.6667  0.3269  1
  Pm  Pm3  2  0.3333  0.6667  0.8993  1
  Sc  Sc4  1  0.0000  0.0000  0.0000  1
]