data_Polluc
_audit_creation_method	'Created with Diamond v2.0'
_audit_creation_date	09-03-09
_audit_update_record	09-03-09
_chemical_formula_sum	'Cs10.366 O101.633 Na2.237 Si48'
_chemical_formula_weight	4403.307
_cell_length_a	13.6978(8)
_cell_length_b	13.6978(8)
_cell_length_c	13.6978(8)
_cell_angle_alpha	90.000
_cell_angle_beta	90.000
_cell_angle_gamma	90.000
_cell_volume	2570.1(3)
_symmetry_int_tables_number	230
_symmetry_space_group_name_H-M	'I a -3 d'
_symmetry_space_group_name_Hall	'-I_4bd_2c_3'

loop_
_atom_type_symbol
_atom_type_oxidation_number
_atom_type_radius_bond
	?	1.200
Na	?	1.180
Si	?	1.200
O	?	1.200


loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_attached_hydrogens
_atom_site_calc_flag
_atom_site_thermal_displace_type
_atom_site_u_iso_or_equiv
CS Cs  0.1250  0.1250  0.1250  0.648 16 b ? d Uani ?
W O  0.1250  0.1250  0.1250  0.352 16 b ? d Uani ?
NA Na  0.2500  0.1250  0.0000  0.09 24 c ? d Uiso  0.03485
SI Si  0.1250  0.66225  0.58775  1.000 48 g ? d Uani ?
O O  0.1046  0.1338  0.7193  1.000 96 h ? d Uani ?


loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
CS  0.0356  0.0356  0.0356  0.0032  0.0032  0.0032
W  0.0356  0.0356  0.0356  0.0032  0.0032  0.0032
SI  0.0148  0.0165  0.0165  0.0025  0.0025 -0.0014
O  0.051  0.047  0.024  0.0103  0.0098  0.0021
