data_[Tm6Np3Pa3N18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Np  1.3600  1.7500  1.0000
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.8243]
_cell_length_b [5.8243]
_cell_length_c [14.6938]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [Tm2NpPaN6]
_chemical_formula_sum '[Tm6 Np3 Pa3 N18]'
_cell_volume [431.6644]
_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
[
  Tm  Tm0  3  0.0000  0.0000  0.4635  1
  Tm  Tm1  3  0.0000  0.0000  0.9683  1
  Np  Np2  3  0.0000  0.0000  0.6834  1
  Pa  Pa3  3  0.0000  0.0000  0.1892  1
  N  N4  9  0.0587  0.3493  0.7537  1
  N  N5  9  0.0648  0.6875  0.2577  1
]