B4B2TU
-OEChem-04022118233D
27 29 0 0 0 0 0 0 0999 V2000
-7.2427 -0.6569 -0.5345 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.4871 -0.8372 0.0433 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.4917 0.4604 -0.5696 S 0 0 0 0 0 0 0 0 0 0 0 0
2.9523 -0.9496 -0.0507 S 0 0 0 0 0 0 0 0 0 0 0 0
6.8111 -1.1021 0.4548 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3965 -2.5030 -0.6414 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5180 2.9144 0.0611 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6155 1.7088 -0.0092 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5830 0.5043 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8637 0.1744 0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1149 1.7108 0.0636 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5270 1.5088 0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1692 -0.3802 0.1205 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9724 0.5244 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5509 -1.5866 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9475 -1.8241 0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8575 2.8204 0.0242 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5802 -0.7899 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6423 -0.2817 -0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6262 -1.4155 -0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2422 2.3220 0.1353 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8818 -2.2791 1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4569 -2.7102 0.8709 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3981 3.7603 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 0.3037 0.8219 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7974 0.3439 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4469 -1.8482 0.4155 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 9 1 0 0 0 0
2 10 1 0 0 0 0
3 13 1 0 0 0 0
3 18 1 0 0 0 0
4 14 1 0 0 0 0
4 19 1 0 0 0 0
5 20 1 0 0 0 0
5 27 1 0 0 0 0
6 20 2 0 0 0 0
7 11 1 0 0 0 0
7 17 2 0 0 0 0
8 14 2 0 0 0 0
8 17 1 0 0 0 0
9 11 2 0 0 0 0
9 14 1 0 0 0 0
10 12 2 0 0 0 0
10 13 1 0 0 0 0
11 12 1 0 0 0 0
12 21 1 0 0 0 0
13 15 2 0 0 0 0
15 16 1 0 0 0 0
15 22 1 0 0 0 0
16 18 2 0 0 0 0
16 23 1 0 0 0 0
17 24 1 0 0 0 0
19 20 1 0 0 0 0
19 25 1 0 0 0 0
19 26 1 0 0 0 0
M END
$$$$