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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/95/1529593.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1529593
loop_
_publ_author_name
'Barnes, J.C.'
'Sesay, L.J.'
'Hetherington, A.'
'Duncan, C.S.'
'Paton, J.'
'Smith, W.R.'
_publ_section_title
;
 Metal ions doped into cesium cadmium trinitrite. Spectroscopic,
 crystallographic and thermal decomposition studies
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              287
_journal_page_last               295
_journal_volume                  63
_journal_year                    1979
_chemical_formula_sum            'Cd Cs N3 O6'
_chemical_name_systematic        'Cs Cd (N O2)3'
_space_group_IT_number           200
_symmetry_space_group_name_Hall  '-P 2 2 3'
_symmetry_space_group_name_H-M   'P m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   5.466
_cell_length_b                   5.466
_cell_length_c                   5.466
_cell_volume                     163.309
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Barnes_JCOMAH_1979_386.cif
_cod_data_source_block           Cd1Cs1N3O6
_cod_original_cell_volume        163.3085
_cod_original_formula_sum        'Cd1 Cs1 N3 O6'
_cod_database_code               1529593
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z
-x,y,-z
z,x,y
-z,-x,y
z,-x,-y
-z,x,-y
y,z,x
y,-z,-x
-y,z,-x
-y,-z,x
-x,-y,-z
x,y,-z
-x,y,z
x,-y,z
-z,-x,-y
z,x,-y
-z,x,y
z,-x,y
-y,-z,-x
-y,z,x
y,-z,x
y,z,-x
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_U_iso_or_equiv
N1 N+3 0.5 0.918 0.5 0.5 0.0
O1 O-2 0.5 0.026 0.691 0.5 0.0
Cd1 Cd+2 0.5 0.5 0.5 1 0.0
Cs1 Cs+1 0 0 0 1 0.0
