data_[Yb2As2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Yb  1.1000  1.7500  1.0840
  As  2.1800  1.1500  0.6600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4079]
_cell_length_b [5.6255]
_cell_length_c [5.6307]
_cell_angle_alpha [60.7852]
_cell_angle_beta [67.7598]
_cell_angle_gamma [69.4207]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [YbAsO3]
_chemical_formula_sum '[Yb2 As2 O6]'
_cell_volume [135.4043]
_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
[
  Yb  Yb0  1  0.1621  0.1226  0.6497  1
  Yb  Yb1  1  0.8537  0.8223  0.4388  1
  As  As2  1  0.2851  0.3886  0.0026  1
  As  As3  1  0.5526  0.7896  0.0694  1
  O  O4  1  0.0270  0.4875  0.2550  1
  O  O5  1  0.1800  0.5120  0.6959  1
  O  O6  1  0.2015  0.0328  0.0854  1
  O  O7  1  0.4723  0.6794  0.8286  1
  O  O8  1  0.5193  0.1536  0.2178  1
  O  O9  1  0.7465  0.0117  0.7568  1
]