data_[Pm3Ho7Sc1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [6.9978]
_cell_length_b [6.9978]
_cell_length_c [8.5778]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Pm3Ho7Sc]
_chemical_formula_sum '[Pm3 Ho7 Sc1]'
_cell_volume [363.7774]
_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  3  0.0016  0.5008  0.7808  1
  Ho  Ho1  3  0.1683  0.8317  0.1233  1
  Ho  Ho2  3  0.3352  0.1676  0.4462  1
  Ho  Ho3  1  0.6667  0.3333  0.1210  1
  Sc  Sc4  1  0.3333  0.6667  0.4433  1
]