#------------------------------------------------------------------------------
#$Date: 2013-03-28 18:17:04 +0200 (Thu, 28 Mar 2013) $
#$Revision: 77586 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/78/9007820.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_9007820
loop_
_publ_author_name
'Mackay, K. M.'
'Nicholson, B. K.'
'Service, M.'
_publ_section_title
;
 Structure of dichlorobis(tetracarbonylcobaltio)tin(IV)(2 Co-Sn)
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              1759
_journal_page_last               1761
_journal_volume                  46
_journal_year                    1990
_chemical_formula_structural     SnCl2[Co(CO)4]2
_chemical_formula_sum            'C8 Cl2 Co2 O8 Sn'
_chemical_name_mineral           SnCl2[Co(CO)4]2
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.42
_cell_angle_gamma                90
_cell_length_a                   11.716
_cell_length_b                   11.486
_cell_length_c                   12.765
_cell_volume                     1629.776
_exptl_crystal_density_diffrn    2.166
_[local]_cod_chemical_formula_sum_orig 'Sn Co2 Cl2 C8 O8'
_cod_database_code               9007820
_amcsd_database_code             AMCSD#0009909
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,1/2-y,1/2+z
-x,1/2+y,1/2-z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Sn1 0.77920 0.16878 0.64689 0.04200
Co1 0.98630 0.17260 0.78950 0.04500
Co2 0.57470 0.18680 0.67380 0.04700
Cl1 0.78120 0.31420 0.51530 0.07700
Cl2 0.77170 -0.00300 0.54300 0.07300
C1 0.03780 0.17170 0.66890 0.05200
O1 0.07330 0.17340 0.59790 0.07100
C2 0.94230 0.31270 0.83010 0.05500
O2 0.91760 0.40050 0.85400 0.08300
C3 0.13600 0.17300 0.88940 0.06800
O3 0.29940 0.17290 0.95000 0.10200
C4 0.94230 0.03910 0.83940 0.06100
O4 0.91860 -0.04590 0.87260 0.09000
C5 0.51750 0.17000 0.52580 0.06300
O5 0.48030 0.16090 0.43340 0.09700
C6 0.42970 0.19610 0.69440 0.06200
O6 0.33900 0.20140 0.70800 0.09200
C7 0.61850 0.05990 0.75900 0.05600
O7 0.64070 -0.02060 0.81300 0.08500
C8 0.62040 0.33080 0.72370 0.06700
O8 0.64430 0.42380 0.75290 0.10700