data_[Y6U2Pa4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  U  1.3800  1.7500  0.9913
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.0171]
_cell_length_b [10.4167]
_cell_length_c [6.0354]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4156]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y3U(PaN3)2]
_chemical_formula_sum '[Y6 U2 Pa4 N12]'
_cell_volume [356.7722]
_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
[
  Y  Y0  4  0.0000  0.1676  0.5000  1
  Y  Y1  2  0.0000  0.5000  0.5000  1
  U  U2  2  0.0000  0.0000  0.0000  1
  Pa  Pa3  4  0.0000  0.3334  0.0000  1
  N  N4  8  0.2427  0.1640  0.2364  1
  N  N5  4  0.2489  0.0000  0.7636  1
]