data_[Nd2Ag1P2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ag  1.9300  1.6000  1.0867
  P  2.1900  1.0000  0.5500
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.2120]
_cell_length_b [6.0045]
_cell_length_c [6.2624]
_cell_angle_alpha [62.9777]
_cell_angle_beta [89.4532]
_cell_angle_gamma [67.8983]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Nd2Ag(PN3)2]
_chemical_formula_sum '[Nd2 Ag1 P2 N6]'
_cell_volume [158.6357]
_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
[
  Nd  Nd0  2  0.2884  0.3875  0.7966  1.0
  Ag  Ag1  1  0.5000  0.0000  0.5000  1.0
  P  P2  2  0.0047  0.9690  0.2487  1.0
  N  N3  2  0.1005  0.1994  0.2256  1.0
  N  N4  2  0.2034  0.6565  0.3469  1.0
  N  N5  2  0.3274  0.9289  0.8360  1.0
]