data_[V3Zn3Ga6]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [3.9140]
_cell_length_b [3.9140]
_cell_length_c [15.3912]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [VZnGa2]
_chemical_formula_sum '[V3 Zn3 Ga6]'
_cell_volume [204.2000]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3260  1
  Zn  Zn1  3  0.0000  0.0000  0.5078  1
  Ga  Ga2  3  0.0000  0.0000  0.7456  1
  Ga  Ga3  3  0.0000  0.0000  0.9207  1
]