data_[Be8Zn4H24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Be  1.5700  1.0500  0.5900
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [4.1164]
_cell_length_b [9.4533]
_cell_length_c [8.2400]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Be2ZnH6]
_chemical_formula_sum '[Be8 Zn4 H24]'
_cell_volume [320.6486]
_cell_formula_units_Z [4]
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  8  0.1463  0.8241  0.0000  1.0
  Zn  Zn1  4  0.0000  0.0000  0.2500  1.0
  H  H2  16  0.2392  0.4054  0.1429  1.0
  H  H3  8  0.2046  0.8143  0.5000  1.0
]