data_[Si1Ag2B1Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Si  1.9000  1.1000  0.5400
  Ag  1.9300  1.6000  1.0867
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4900]
_cell_length_b [5.7175]
_cell_length_c [5.7332]
_cell_angle_alpha [73.7392]
_cell_angle_beta [74.9502]
_cell_angle_gamma [66.1708]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SiAg2BPd6]
_chemical_formula_sum '[Si1 Ag2 B1 Pd6]'
_cell_volume [155.8171]
_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
[
  Si  Si0  1  0.0000  0.0000  0.0000  1
  Ag  Ag1  2  0.2991  0.1678  0.1835  1
  B  B2  1  0.5000  0.5000  0.5000  1
  Pd  Pd3  2  0.1981  0.3310  0.6691  1
  Pd  Pd4  2  0.2277  0.8355  0.6346  1
  Pd  Pd5  2  0.3401  0.6413  0.1765  1
]