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	'Cs10.843 O101.157 Na1.877 Si48'
_chemical_formula_weight	4450.824
_cell_length_a	13.6927(9)
_cell_length_b	13.6927(9)
_cell_length_c	13.6927(9)
_cell_angle_alpha	90.000
_cell_angle_beta	90.000
_cell_angle_gamma	90.000
_cell_volume	2567.2(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  0.678 16 b ? d Uani ?
W O  0.1250  0.1250  0.1250  0.322 16 b ? d Uani ?
NA Na  0.2500  0.1250  0.0000  0.08 24 c ? d Uiso  0.03448
SI Si  0.1250  0.66219  0.58781  1.000 48 g ? d Uani ?
O O  0.1047  0.1337  0.7194  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  0.0353  0.0353  0.0353  0.0039  0.0039  0.0039
W  0.0353  0.0353  0.0353  0.0039  0.0039  0.0039
SI  0.0146  0.0155  0.0155  0.0026  0.0026 -0.0020
O  0.050  0.045  0.025  0.009  0.011  0.003
