data_[V4Re4Mo6]
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
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.3543]
_cell_length_b [4.3623]
_cell_length_c [5.1457]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.0190]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [V2Re2Mo3]
_chemical_formula_sum '[V4 Re4 Mo6]'
_cell_volume [208.8185]
_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  4  0.1432  0.0000  0.5702  1.0
  Re  Re1  4  0.0737  0.5000  0.2920  1.0
  Mo  Mo2  4  0.2150  0.5000  0.8524  1.0
  Mo  Mo3  2  0.0000  0.0000  0.0000  1.0
]