data_[V2Rh4Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.4272]
_cell_length_b [3.4850]
_cell_length_c [9.8316]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.4651]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [VRh2Se3]
_chemical_formula_sum '[V2 Rh4 Se6]'
_cell_volume [249.4001]
_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  0.1970  0.2500  0.7019  1.0
  Rh  Rh1  2  0.0806  0.2500  0.4332  1.0
  Rh  Rh2  2  0.3782  0.7500  0.9166  1.0
  Se  Se3  2  0.0419  0.7500  0.8250  1.0
  Se  Se4  2  0.3046  0.7500  0.5197  1.0
  Se  Se5  2  0.4762  0.7500  0.1885  1.0
]