data_[Be2Cd2P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  Cd  1.6900  1.5500  1.0900
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.6519]
_cell_length_b [5.5940]
_cell_length_c [6.1276]
_cell_angle_alpha [63.7338]
_cell_angle_beta [76.0240]
_cell_angle_gamma [89.0076]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BeCdP]
_chemical_formula_sum '[Be2 Cd2 P2]'
_cell_volume [108.3532]
_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
[
  Be  Be0  2  0.2590  0.1599  0.4003  1
  Cd  Cd1  2  0.1457  0.3741  0.7288  1
  P  P2  2  0.1726  0.8396  0.7843  1
]