data_[V2Cr8Mo2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [4.9012]
_cell_length_b [7.2990]
_cell_length_c [4.9044]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5108]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [VCr4Mo]
_chemical_formula_sum '[V2 Cr8 Mo2]'
_cell_volume [152.6883]
_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  2  0.5000  0.0000  0.5000  1
  Cr  Cr1  4  0.1035  0.1634  0.6022  1
  Cr  Cr2  4  0.3994  0.6670  0.3978  1
  Mo  Mo3  2  0.0000  0.0000  0.0000  1
]