data_[Be2Cd2Ge4P8]
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
  Ge  2.0100  1.2500  0.7700
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [5.4742]
_cell_length_b [5.4742]
_cell_length_c [10.8173]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [BeCd(GeP2)2]
_chemical_formula_sum '[Be2 Cd2 Ge4 P8]'
_cell_volume [324.1648]
_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  0.0000  0.0000  0.0000  1
  Cd  Cd1  2  0.0000  0.5000  0.7500  1
  Ge  Ge2  2  0.0000  0.0000  0.5000  1
  Ge  Ge3  2  0.0000  0.5000  0.2500  1
  P  P4  8  0.2233  0.2519  0.1142  1
]