data_[V4Zn4H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.9271]
_cell_length_b [2.8420]
_cell_length_c [5.1105]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.4504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [VZnH]
_chemical_formula_sum '[V4 Zn4 H4]'
_cell_volume [124.2946]
_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
[
  V  V0  2  0.2107  0.0000  0.3423  1
  V  V1  2  0.2360  0.5000  0.8233  1
  Zn  Zn2  2  0.4652  0.0000  0.2982  1
  Zn  Zn3  2  0.4744  0.5000  0.7119  1
  H  H4  2  0.1677  0.5000  0.0951  1
  H  H5  2  0.4671  0.5000  0.0583  1
]