data_[V1Cd2P1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cd  1.6900  1.5500  1.0900
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.1789]
_cell_length_b [3.1789]
_cell_length_c [7.1061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [VCd2P]
_chemical_formula_sum '[V1 Cd2 P1]'
_cell_volume [71.8097]
_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
[
  V  V0  1  0.5000  0.5000  0.5577  1
  Cd  Cd1  1  0.0000  0.0000  0.8464  1
  Cd  Cd2  1  0.5000  0.5000  0.1449  1
  P  P3  1  0.0000  0.0000  0.4510  1
]