data_[Zn4Ni12H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ni  1.9100  1.3500  0.7400
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.6059]
_cell_length_b [4.4993]
_cell_length_c [6.5805]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2587]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [ZnNi3H]
_chemical_formula_sum '[Zn4 Ni12 H4]'
_cell_volume [192.4612]
_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
[
  Zn  Zn0  4  0.3124  0.1026  0.4407  1
  Ni  Ni1  4  0.0597  0.0974  0.6849  1
  Ni  Ni2  4  0.1881  0.5904  0.5623  1
  Ni  Ni3  4  0.4385  0.5859  0.3134  1
  H  H4  4  0.1768  0.7064  0.2913  1
]