data_[Mn4V16W2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  V  1.6300  1.3500  0.7775
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.1258]
_cell_length_b [8.0857]
_cell_length_c [4.9704]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.5736]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn2V8W]
_chemical_formula_sum '[Mn4 V16 W2]'
_cell_volume [322.9206]
_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
[
  Mn  Mn0  4  0.1411  0.0000  0.4627  1
  V  V1  8  0.1537  0.2371  0.7217  1
  V  V2  4  0.0855  0.5000  0.3549  1
  V  V3  4  0.1928  0.5000  0.9500  1
  W  W4  2  0.0000  0.0000  0.0000  1
]