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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/1/53/41/1534168.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_1534168
loop_
_publ_author_name
'Artem'eva, M.Yu.'
'Mikhailov, Yu.N.'
'Gorbunova, Yu.E.'
'Serezhkina, L.B.'
'Serezhkin, V.N.'
_publ_section_title
;
 Crystal structure of N H4 (U O2 (C2 O4) (N C S)) * 2(H2 O)
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              1470
_journal_page_last               1472
_journal_volume                  48
_journal_year                    2003
_chemical_formula_sum            'C3 H8 N2 O8 S U'
_chemical_name_systematic        '(N H4) ((U O2) (C2 O4) (N C S)) (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                 99.19
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.129
_cell_length_b                   13.102
_cell_length_c                   8.981
_cell_volume                     1060.413
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Artemeva_ZNOKAQ_2003_502.cif
_cod_data_source_block           C3H8N2O8S1U1
_cod_original_formula_sum        'C3 H8 N2 O8 S1 U1'
_cod_database_code               1534168
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
N1 N-3 0 -0.0183 0.25 1 0.0
O4 O-2 0.1526 0.4229 0.039 1 0.0
S1 S-2 0 -0.2296 0.25 1 0.0
C1 C+4 0 -0.1062 0.25 1 0.0
O1 O-2 0.7957 0.1252 0.0505 1 0.0
O3 O-2 0.1268 0.1652 0.1215 1 0.0
O2 O-2 0.8806 0.3134 0.128 1 0.0
C2 C+3 0.7741 0.3047 0.0227 1 0.0
N2 N-3 0 0.5244 0.25 1 0.0
U1 U+6 0 0.1633 0.25 1 0.0
