#------------------------------------------------------------------------------
#$Date: 2024-05-23 12:45:01 +0300 (Thu, 23 May 2024) $
#$Revision: 292002 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/54/9015463.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9015463
loop_
_publ_author_name
'Bourgault, M.'
'Fourcade, R.'
'Mascherpa, G.'
_publ_section_title
;
 Mise en evidence de l'entite Sb2 F4 O dans un compose d'addition
 moleculaire avec l'uree etude structurale de ((N H2)2 C O)2 Sb2 F4 O
 _cod_database_code 1008123
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              214
_journal_page_last               220
_journal_paper_doi               10.1016/0022-4596(81)90159-6
_journal_volume                  36
_journal_year                    1981
_chemical_formula_sum            'C2 F4 N4 O3 Sb2'
_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                 122.32
_cell_angle_gamma                90
_cell_length_a                   19.98
_cell_length_b                   8.152
_cell_length_c                   15.089
_cell_formula_units_Z            8
_cell_volume                     2076.900
_database_code_amcsd             0016065
_exptl_crystal_density_diffrn    2.863
_cod_duplicate_entry             1008123
_cod_original_formula_sum        'Sb2 F4 O3 N4 C2'
_cod_database_code               9015463
_amcsd_formula_title             'F4 H8 N4 O3 Sb2'
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,1/2+z
1/2+x,1/2-y,1/2+z
-x,y,1/2-z
1/2-x,1/2+y,1/2-z
-x,-y,-z
1/2-x,1/2-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_attached_hydrogens
Sb1 0.17936 0.29998 0.34455 0
Sb2 0.99720 0.40868 0.12234 0
F1 0.12750 0.88700 0.86990 0
F2 0.19610 0.61470 0.97560 0
F3 0.47090 0.86070 0.62770 0
F4 0.07480 0.49700 0.59580 0
O1 0.07630 0.58980 0.77400 0
O2 0.08508 0.17100 0.14430 0
O3 0.23660 0.55900 0.34690 0
N1 0.33300 0.74400 0.63200 2
N2 0.11700 0.09100 0.63300 2
N3 0.99600 0.96400 0.37100 2
N4 0.21200 0.31200 0.11500 2
C1 0.27000 0.20500 0.13300 0
C2 0.06900 0.98100 0.63600 0
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0016065
