data_[V1Rh3Se4]
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 [P-43m]
_cell_length_a [5.6854]
_cell_length_b [5.6854]
_cell_length_c [5.6854]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [215]
_chemical_formula_structural [VRh3Se4]
_chemical_formula_sum '[V1 Rh3 Se4]'
_cell_volume [183.7733]
_cell_formula_units_Z [1]
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  0.5000  0.5000  0.5000  1.0
  Rh  Rh1  3  0.0000  0.5000  0.5000  1.0
  Se  Se2  4  0.2558  0.2558  0.7442  1.0
]