data_[V2Re2W2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Re  1.9000  1.3500  0.7125
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [4.3902]
_cell_length_b [4.3902]
_cell_length_c [5.3710]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [VReW]
_chemical_formula_sum '[V2 Re2 W2]'
_cell_volume [89.6532]
_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  1  0.0000  0.0000  0.0306  1.0
  V  V1  1  0.6667  0.3333  0.1907  1.0
  Re  Re2  1  0.3333  0.6667  0.3547  1.0
  Re  Re3  1  0.6667  0.3333  0.6979  1.0
  W  W4  1  0.0000  0.0000  0.5247  1.0
  W  W5  1  0.3333  0.6667  0.8675  1.0
]