#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/65/2106533.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106533
loop_
_publ_author_name
'Kalliomaeki, M.S.'
'Meisalo, V.P.J.'
_publ_section_title
;
 Structure Determination of the High-Pressure Phases Rb N O3 V, Cs N O3
 III and Cs N O3 IV
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              2829
_journal_page_last               2835
_journal_volume                  35
_journal_year                    1979
_chemical_formula_sum            'Cs N O3'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  'P 2 2ab -1ab'
_symmetry_space_group_name_H-M   'P m m n :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.837
_cell_length_b                   5.143
_cell_length_c                   4.978
_cell_volume                     149.438
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Kalliomaeki_ACBCAR_1979_4.cif
_cod_data_source_block           Cs1N1O3
_cod_original_sg_symbol_Hall     '-P 2ab 2a (x-1/4,y-1/4,z)'
_cod_original_formula_sum        'Cs1 N1 O3'
_cod_database_code               2106533
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,y+1/2,-z
-x,y,z
x,-y,z
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
Cs1 Cs+1 0 0.5 0.59 1 0.0
N1 N+5 0 0 0 1 0.0
O2 O-2 0.18 0 -0.12 1 0.0
O1 O-2 0 0 0.24 1 0.0
