data_[V8Co4H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Co  1.8800  1.3500  0.7683
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [4.6963]
_cell_length_b [8.1020]
_cell_length_c [4.7320]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7917]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [V2CoH3]
_chemical_formula_sum '[V8 Co4 H12]'
_cell_volume [169.4141]
_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  4  0.0000  0.1678  0.5000  1.0
  V  V1  2  0.0000  0.0000  0.0000  1.0
  V  V2  2  0.0000  0.5000  0.5000  1.0
  Co  Co3  4  0.0000  0.3341  0.0000  1.0
  H  H4  8  0.2461  0.1669  0.2476  1.0
  H  H5  4  0.2450  0.5000  0.2425  1.0
]