data_[Al4V14Cr6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.3304]
_cell_length_b [25.5160]
_cell_length_c [2.9628]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Al2V7Cr3]
_chemical_formula_sum '[Al4 V14 Cr6]'
_cell_volume [327.3773]
_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
[
  Al  Al0  4  0.0000  0.1620  0.0000  1
  V  V1  4  0.0000  0.0769  0.5000  1
  V  V2  4  0.0000  0.2667  0.0000  1
  V  V3  4  0.0000  0.4195  0.0000  1
  V  V4  2  0.0000  0.0000  0.0000  1
  Cr  Cr5  4  0.0000  0.3422  0.5000  1
  Cr  Cr6  2  0.0000  0.5000  0.5000  1
]