data_[La1Pr1Rh2C2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Rh  2.2800  1.3500  0.7450
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.7865]
_cell_length_b [3.7865]
_cell_length_c [7.5455]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [LaPrRh2(CN)2]
_chemical_formula_sum '[La1 Pr1 Rh2 C2 N2]'
_cell_volume [108.1857]
_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
[
  La  La0  1  0.0000  0.0000  0.8288  1
  Pr  Pr1  1  0.5000  0.5000  0.1714  1
  Rh  Rh2  2  0.0000  0.5000  0.4987  1
  C  C3  1  0.0000  0.0000  0.3449  1
  C  C4  1  0.5000  0.5000  0.6566  1
  N  N5  1  0.0000  0.0000  0.1629  1
  N  N6  1  0.5000  0.5000  0.8380  1
]