data_[V16Ga4Si6]
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
  Si  1.9000  1.1000  0.5400
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.8730]
_cell_length_b [12.3512]
_cell_length_c [4.4838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [V8Ga2Si3]
_chemical_formula_sum '[V16 Ga4 Si6]'
_cell_volume [380.6256]
_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  8  0.1745  0.4008  0.5000  1
  V  V1  4  0.0000  0.1012  0.0000  1
  V  V2  4  0.0000  0.3185  0.0000  1
  Ga  Ga3  4  0.0000  0.2132  0.5000  1
  Si  Si4  4  0.1808  0.5000  0.0000  1
  Si  Si5  2  0.0000  0.0000  0.5000  1
]