data_[V10Ga10H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ga  1.8100  1.3000  0.7600
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.1000]
_cell_length_b [3.4320]
_cell_length_c [9.4952]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.7518]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [V5Ga5H2]
_chemical_formula_sum '[V10 Ga10 H4]'
_cell_volume [295.9120]
_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
[
  V  V0  4  0.0945  0.0000  0.6875  1.0
  V  V1  4  0.1034  0.5000  0.1882  1.0
  V  V2  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga3  4  0.1899  0.5000  0.8954  1.0
  Ga  Ga4  4  0.2030  0.0000  0.3943  1.0
  Ga  Ga5  2  0.0000  0.5000  0.5000  1.0
  H  H6  4  0.0411  0.0000  0.1876  1.0
]