#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/4/06/19/4061928.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_4061928
_journal_name_full               Organometallics
_journal_year                    2003
_chemical_formula_sum            'C32 H38 Br2 N2 Si2 Sn'
_chemical_formula_weight         785.33
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                108.56(3)
_cell_angle_beta                 102.06(3)
_cell_angle_gamma                113.51(3)
_cell_formula_units_Z            2
_cell_length_a                   13.025(3)
_cell_length_b                   13.109(3)
_cell_length_c                   14.194(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1943.1(7)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.342
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'TRICLINIC' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4061928
loop_
_symmetry_equiv_pos_as_xyz
'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_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Sn1 Sn 0.26041(10) 0.03047(9) 0.26659(10) 0.0482(5) Uani 1 1 d . . .
Br1 Br 0.04164(18) -0.12448(15) 0.09363(16) 0.0727(7) Uani 1 1 d . . .
Br2 Br 0.3918(2) -0.07670(18) 0.2717(2) 0.0805(8) Uani 1 1 d . . .
Si1 Si 0.1438(5) -0.0949(4) 0.4255(5) 0.0629(15) Uani 1 1 d . . .
Si2 Si 0.3399(5) 0.0678(5) 0.0478(5) 0.0681(16) Uani 1 1 d . . .
N1 N 0.1601(12) 0.1379(11) 0.3151(13) 0.057(4) Uani 1 1 d . . .
N2 N 0.4548(12) 0.1970(11) 0.3948(12) 0.057(4) Uani 1 1 d . . .
C1 C 0.3362(17) 0.1737(15) 0.6263(15) 0.062(5) Uani 1 1 d . . .
H1A H 0.3737 0.1371 0.6550 0.075 Uiso 1 1 calc R . .
C2 C 0.331(2) 0.2701(17) 0.6892(18) 0.085(7) Uani 1 1 d . . .
H2 H 0.3667 0.3082 0.7641 0.102 Uiso 1 1 calc R . .
C3 C 0.2607(19) 0.3112(15) 0.6238(19) 0.081(7) Uani 1 1 d . . .
H3A H 0.2522 0.3749 0.6672 0.097 Uiso 1 1 calc R . .
C4 C 0.1994(16) 0.2703(13) 0.5003(16) 0.064(6) Uani 1 1 d . . .
C5 C 0.2111(14) 0.1799(13) 0.4392(15) 0.055(5) Uani 1 1 d . . .
C6 C 0.2765(14) 0.1250(12) 0.5029(13) 0.045(4) Uani 1 1 d . . .
C7 C 0.1309(17) 0.3100(13) 0.4288(17) 0.065(6) Uani 1 1 d . . .
H7A H 0.1182 0.3723 0.4686 0.078 Uiso 1 1 calc R . .
C8 C 0.0792(18) 0.2686(15) 0.3064(19) 0.072(6) Uani 1 1 d . . .
H8A H 0.0397 0.3029 0.2763 0.087 Uiso 1 1 calc R . .
C9 C 0.0958(17) 0.1816(15) 0.2489(17) 0.065(5) Uani 1 1 d . . .
H9A H 0.0707 0.1492 0.1744 0.078 Uiso 1 1 calc R . .
C10 C 0.2690(15) 0.0251(12) 0.4355(14) 0.051(4) Uani 1 1 d . . .
H10A H 0.3405 0.0200 0.4663 0.062 Uiso 1 1 calc R . .
C11 C 0.129(2) -0.2228(16) 0.3345(19) 0.089(7) Uani 1 1 d . . .
H11A H 0.0613 -0.2949 0.3273 0.134 Uiso 1 1 calc R . .
H11B H 0.2019 -0.2266 0.3575 0.134 Uiso 1 1 calc R . .
H11C H 0.1164 -0.2204 0.2663 0.134 Uiso 1 1 calc R . .
C12 C 0.188(2) -0.0833(19) 0.5828(18) 0.093(7) Uani 1 1 d . . .
H12A H 0.1455 -0.1648 0.5782 0.139 Uiso 1 1 calc R . .
H12B H 0.1647 -0.0300 0.6253 0.139 Uiso 1 1 calc R . .
H12C H 0.2739 -0.0498 0.6159 0.139 Uiso 1 1 calc R . .
C13 C -0.0060(17) -0.0893(18) 0.3578(18) 0.084(7) Uani 1 1 d . . .
H13A H -0.0748 -0.1721 0.3199 0.127 Uiso 1 1 calc R . .
H13B H 0.0063 -0.0544 0.3083 0.127 Uiso 1 1 calc R . .
H13C H -0.0204 -0.0386 0.4131 0.127 Uiso 1 1 calc R . .
C14 C 0.3336(17) 0.3043(18) 0.1732(18) 0.073(6) Uani 1 1 d . . .
H14A H 0.2770 0.2760 0.1054 0.087 Uiso 1 1 calc R . .
C15 C 0.412(2) 0.4187(19) 0.241(2) 0.100(8) Uani 1 1 d . . .
H15A H 0.4145 0.4825 0.2246 0.120 Uiso 1 1 calc R . .
C16 C 0.509(2) 0.4520(19) 0.357(2) 0.108(9) Uani 1 1 d . . .
H16A H 0.5649 0.5367 0.3961 0.130 Uiso 1 1 calc R . .
C17 C 0.5291(19) 0.3803(15) 0.4134(18) 0.071(6) Uani 1 1 d . . .
C18 C 0.4450(14) 0.2690(13) 0.3403(14) 0.048(5) Uani 1 1 d . . .
C19 C 0.3499(18) 0.2323(15) 0.2213(17) 0.064(5) Uani 1 1 d . . .
C20 C 0.621(2) 0.4138(17) 0.528(2) 0.085(7) Uani 1 1 d . . .
H20A H 0.6803 0.4974 0.5692 0.102 Uiso 1 1 calc R . .
C21 C 0.6266(19) 0.342(2) 0.5736(19) 0.097(8) Uani 1 1 d . . .
H21A H 0.6804 0.3689 0.6422 0.117 Uiso 1 1 calc R . .
C22 C 0.5444(16) 0.2282(16) 0.5067(17) 0.069(6) Uani 1 1 d . . .
H22A H 0.5382 0.1644 0.5249 0.083 Uiso 1 1 calc R . .
C23 C 0.2758(15) 0.1140(12) 0.1458(15) 0.056(5) Uani 1 1 d . . .
H23A H 0.1970 0.1030 0.1085 0.067 Uiso 1 1 calc R . .
C24 C 0.312(3) 0.137(2) -0.0624(19) 0.124(10) Uani 1 1 d . . .
H24A H 0.2268 0.1033 -0.0982 0.186 Uiso 1 1 calc R . .
H24B H 0.3451 0.1129 -0.1146 0.186 Uiso 1 1 calc R . .
H24C H 0.3520 0.2258 -0.0253 0.186 Uiso 1 1 calc R . .
C25 C 0.5071(19) 0.112(2) 0.138(2) 0.119(10) Uani 1 1 d . . .
H25A H 0.5004 0.0717 0.1843 0.178 Uiso 1 1 calc R . .
H25B H 0.5556 0.2005 0.1814 0.178 Uiso 1 1 calc R . .
H25C H 0.5446 0.0848 0.0920 0.178 Uiso 1 1 calc R . .
C26 C 0.2599(19) -0.0827(17) -0.0353(19) 0.096(8) Uani 1 1 d . . .
H26A H 0.1811 -0.1028 -0.0791 0.144 Uiso 1 1 calc R . .
H26B H 0.2512 -0.1293 0.0056 0.144 Uiso 1 1 calc R . .
H26C H 0.3009 -0.1032 -0.0807 0.144 Uiso 1 1 calc R . .
C27 C 0.176(5) -0.506(4) 0.056(4) 0.31(5) Uani 1 1 d . . .
H27 H 0.1341 -0.5272 0.0985 0.378 Uiso 1 1 calc R . .
C28 C 0.253(4) -0.392(3) 0.060(3) 0.160(16) Uani 1 1 d . . .
H28A H 0.2387 -0.3289 0.0936 0.192 Uiso 1 1 calc R . .
C29 C 0.339(4) -0.357(4) 0.027(4) 0.148(15) Uani 1 1 d . . .
H29A H 0.3951 -0.2730 0.0564 0.178 Uiso 1 1 calc R . .
C30 C 0.350(4) -0.429(6) -0.040(4) 0.20(2) Uani 1 1 d . . .
H30 H 0.4077 -0.4070 -0.0697 0.238 Uiso 1 1 calc R . .
C31 C 0.270(7) -0.543(5) -0.066(3) 0.19(2) Uani 1 1 d . . .
H31 H 0.2752 -0.6071 -0.1142 0.223 Uiso 1 1 calc R . .
C32 C 0.185(4) -0.573(4) -0.030(4) 0.17(2) Uani 1 1 d . . .
H32 H 0.1198 -0.6540 -0.0717 0.206 Uiso 1 1 calc R . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Sn1 C23 2.312(18) . ?
Sn1 N1 2.321(13) . ?
Sn1 N2 2.372(13) . ?
Sn1 C10 2.402(18) . ?
Sn1 Br2 2.615(2) . ?
Sn1 Br1 2.749(3) . ?
Si1 C11 1.67(2) . ?
Si1 C10 1.694(15) . ?
Si1 C13 2.03(2) . ?
Si1 C12 2.12(2) . ?
Si1 C6 2.391(14) . ?
Si2 C26 1.653(18) . ?
Si2 C23 1.830(16) . ?
Si2 C25 2.02(2) . ?
Si2 C24 2.08(3) . ?
N1 C9 1.52(2) . ?
N1 C5 1.57(2) . ?
N2 C18 1.42(2) . ?
N2 C22 1.58(2) . ?
C1 C2 1.33(2) . ?
C1 C6 1.55(2) . ?
C2 C3 1.53(3) . ?
C3 C4 1.57(3) . ?
C4 C5 1.31(2) . ?
C4 C7 1.56(3) . ?
C5 C6 1.63(2) . ?
C6 C10 1.304(19) . ?
C7 C8 1.55(3) . ?
C8 C9 1.30(2) . ?
C14 C15 1.29(3) . ?
C14 C19 1.38(3) . ?
C15 C16 1.65(4) . ?
C16 C17 1.48(3) . ?
C17 C18 1.30(2) . ?
C17 C20 1.61(3) . ?
C18 C19 1.66(3) . ?
C19 C23 1.34(2) . ?
C20 C21 1.31(3) . ?
C21 C22 1.30(2) . ?
C27 C32 1.32(7) . ?
C27 C28 1.41(7) . ?
C28 C29 1.28(5) . ?
C28 C32 1.99(5) . ?
C29 C30 1.18(6) . ?
C30 C31 1.30(5) . ?
C31 C32 1.29(7) . ?
