data_[Y1V6Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  V  1.6300  1.3500  0.7775
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmmm]
_cell_length_a [2.8990]
_cell_length_b [4.3101]
_cell_length_c [13.6783]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [47]
_chemical_formula_structural [Y(V3Pd)2]
_chemical_formula_sum '[Y1 V6 Pd2]'
_cell_volume [170.9123]
_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
[
  Y  Y0  1  0.0000  0.0000  0.0000  1
  V  V1  2  0.0000  0.5000  0.1684  1
  V  V2  2  0.5000  0.0000  0.1974  1
  V  V3  1  0.5000  0.5000  0.0000  1
  V  V4  1  0.5000  0.5000  0.5000  1
  Pd  Pd5  2  0.5000  0.5000  0.3224  1
]