data_[V6As6Ru9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  As  2.1800  1.1500  0.6600
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.1827]
_cell_length_b [4.1827]
_cell_length_c [20.4681]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [V2As2Ru3]
_chemical_formula_sum '[V6 As6 Ru9]'
_cell_volume [310.1096]
_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  0.2405  1
  V  V1  3  0.0000  0.0000  0.7568  1
  As  As2  3  0.0000  0.0000  0.0090  1
  As  As3  3  0.0000  0.0000  0.4934  1
  Ru  Ru4  3  0.0000  0.0000  0.3710  1
  Ru  Ru5  3  0.0000  0.0000  0.6267  1
  Ru  Ru6  3  0.0000  0.0000  0.8776  1
]