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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/60/1536040.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_1536040
loop_
_publ_author_name
'Vigdorchik, A.G.'
'Malinovskii, Yu.A.'
'Dryuchko, A.G.'
_publ_section_title
;
 Crystal structure of cesium - cerium nitrate Cs2: Ce (N O3)5 (H2 O)2:
;
_journal_name_full               Kristallografiya
_journal_page_first              1399
_journal_page_last               1402
_journal_volume                  35
_journal_year                    1990
_chemical_formula_sum            'Ce Cs2 H4 N5 O17'
_chemical_name_systematic        'Cs2 (Ce (N O3)5 (H2 O)2)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.77
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.125
_cell_length_b                   8.798
_cell_length_c                   16.503
_cell_volume                     1568.852
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Vigdorchik_KRISAJ_1990_1062.cif
_cod_data_source_block           H4Ce1Cs2N5O17
_cod_original_formula_sum        'H4 Ce1 Cs2 N5 O17'
_cod_database_code               1536040
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z-1/2
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
Ce1 Ce+3 0 0.038 0.25 1 0.0
O9 O-2 0.421 0.321 0.3226 1 0.0
N2 N+5 0.2312 0.4839 0.1534 1 0.0
O1 O-2 0.4609 0.3165 0.0091 1 0.0
N3 N+5 0 0.384 0.25 1 0.0
O2 O-2 0.0562 0.127 0.1185 1 0.0
N1 N+5 0.0093 0.1658 0.4503 1 0.0
O5 O-2 0.3201 0.4051 0.1403 1 0.0
O3 O-2 0.1219 0.1874 0.4592 1 0.0
O8 O-2 0.5 0.0234 0.25 1 0.0
O7 O-2 0.0951 0.3091 0.2848 1 0.0
O4 O-2 0.2425 0.0725 0.2843 1 0.0
Cs1 Cs+1 0.3107 0.0475 0.0746 1 0.0
O6 O-2 0.1275 0.4812 0.1071 1 0.0
