data_[K3Pm3B6H24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pm  1.1300  1.8500  1.1100
  B  2.0400  0.8500  0.4100
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.0974]
_cell_length_b [4.0974]
_cell_length_c [23.9801]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [KPm(BH4)2]
_chemical_formula_sum '[K3 Pm3 B6 H24]'
_cell_volume [348.6621]
_cell_formula_units_Z [3]
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
[
  K  K0  3  -0.0000  -0.0000  0.5000  1
  Pm  Pm1  3  0.0000  0.0000  0.0000  1
  B  B2  6  0.0000  0.0000  0.2563  1
  H  H3  18  0.0039  0.5019  0.9409  1
  H  H4  6  0.0000  0.0000  0.7949  1
]