data_[Cr4Mo6W8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Mo  2.1600  1.4500  0.7750
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.3338]
_cell_length_b [6.5088]
_cell_length_c [9.0015]
_cell_angle_alpha [75.6072]
_cell_angle_beta [74.0461]
_cell_angle_gamma [72.4433]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cr2Mo3W4]
_chemical_formula_sum '[Cr4 Mo6 W8]'
_cell_volume [281.7589]
_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
[
  Cr  Cr0  2  0.0593  0.6083  0.8287  1
  Cr  Cr1  2  0.1824  0.1583  0.4466  1
  Mo  Mo2  2  0.1182  0.3861  0.6358  1
  Mo  Mo3  2  0.3539  0.2243  0.9662  1
  Mo  Mo4  2  0.3801  0.9623  0.7466  1
  W  W5  2  0.1313  0.9796  0.2497  1
  W  W6  2  0.1475  0.7680  0.0300  1
  W  W7  2  0.3409  0.7333  0.5035  1
  W  W8  2  0.4185  0.4824  0.2616  1
]