data_[P2Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.3871]
_cell_length_b [4.2978]
_cell_length_c [4.5403]
_cell_angle_alpha [73.5683]
_cell_angle_beta [78.0397]
_cell_angle_gamma [77.2778]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PPd]
_chemical_formula_sum '[P2 Pd2]'
_cell_volume [61.0904]
_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
[
  P  P0  2  0.2304  0.1729  0.8722  1
  Pd  Pd1  2  0.3478  0.3400  0.3174  1
]