data_[Pm16Nd10Sc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Nd  1.1400  1.8500  1.2765
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [12.8523]
_cell_length_b [10.5891]
_cell_length_c [9.0992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.4392]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Pm8Nd5Sc]
_chemical_formula_sum '[Pm16 Nd10 Sc2]'
_cell_volume [969.9603]
_cell_formula_units_Z [2]
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  4  0.0253  0.2696  0.7091  1
  Pm  Pm1  4  0.1476  0.5894  0.9600  1
  Pm  Pm2  4  0.2026  0.2997  0.2119  1
  Pm  Pm3  4  0.2031  0.8789  0.2127  1
  Nd  Nd4  4  0.0256  0.9096  0.7091  1
  Nd  Nd5  4  0.2389  0.5895  0.4166  1
  Nd  Nd6  2  0.0000  0.5871  0.5000  1
  Sc  Sc7  2  0.0000  0.0894  0.0000  1
]