BS1WG4
-OEChem-04022105362D
34 36 0 0 0 0 0 0 0999 V2000
2.0000 -0.7507 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
6.1569 2.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5878 0.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1601 1.6785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3191 0.3913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1569 2.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.6569 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8479 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4659 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6569 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 1.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4170 1.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7908 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5229 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 1.5971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7908 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5229 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6569 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2788 1.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1112 1.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8543 2.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1259 0.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9055 0.6276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2539 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0598 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 2.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2539 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0598 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6569 -2.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6891 1.2009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2692 1.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3150 2.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4394 2.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 20 1 0 0 0 0
2 6 1 0 0 0 0
2 9 1 0 0 0 0
3 11 1 0 0 0 0
3 20 1 0 0 0 0
4 12 1 0 0 0 0
4 21 1 0 0 0 0
5 21 2 0 0 0 0
6 8 2 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
7 10 1 0 0 0 0
8 11 1 0 0 0 0
9 12 1 0 0 0 0
10 13 2 0 0 0 0
10 14 1 0 0 0 0
11 15 2 0 0 0 0
12 23 1 0 0 0 0
12 24 1 0 0 0 0
13 16 1 0 0 0 0
13 25 1 0 0 0 0
14 17 2 0 0 0 0
14 26 1 0 0 0 0
15 19 1 0 0 0 0
15 27 1 0 0 0 0
16 18 2 0 0 0 0
16 28 1 0 0 0 0
17 18 1 0 0 0 0
17 29 1 0 0 0 0
18 30 1 0 0 0 0
19 20 2 0 0 0 0
19 31 1 0 0 0 0
21 22 1 0 0 0 0
22 32 1 0 0 0 0
22 33 1 0 0 0 0
22 34 1 0 0 0 0
M END
$$$$