B9EU3P
-OEChem-04022105362D
31 33 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
7.6249 0.0312 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
5.6569 -0.2694 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
3.8968 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
7.4170 1.0094 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
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
1.6891 1.2009 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
8.9196 0.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7008 1.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3027 1.9591 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 10 1 0 0 0 0
3 11 1 0 0 0 0
3 20 1 0 0 0 0
4 17 1 0 0 0 0
4 21 1 0 0 0 0
5 17 2 0 0 0 0
6 8 2 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 10 2 0 0 0 0
8 11 1 0 0 0 0
9 12 2 0 0 0 0
9 13 1 0 0 0 0
10 17 1 0 0 0 0
11 14 2 0 0 0 0
12 15 1 0 0 0 0
12 22 1 0 0 0 0
13 16 2 0 0 0 0
13 23 1 0 0 0 0
14 19 1 0 0 0 0
14 24 1 0 0 0 0
15 18 2 0 0 0 0
15 25 1 0 0 0 0
16 18 1 0 0 0 0
16 26 1 0 0 0 0
18 28 1 0 0 0 0
19 20 2 0 0 0 0
19 27 1 0 0 0 0
21 29 1 0 0 0 0
21 30 1 0 0 0 0
21 31 1 0 0 0 0
M END
$$$$