B0U2PZ
-OEChem-04012113282D
31 32 0 1 0 0 0 0 0999 V2000
7.1962 1.0670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.4330 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0
8.9282 2.0670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.5622 2.4330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.5622 0.7010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.6962 1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.6962 0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
1 7 2 0 0 0 0
1 9 1 0 0 0 0
1 16 1 0 0 0 0
2 8 2 0 0 0 0
2 12 1 0 0 0 0
2 13 1 0 0 0 0
3 16 1 0 0 0 0
4 16 1 0 0 0 0
5 16 1 0 0 0 0
9 11 1 0 0 0 0
9 23 1 0 0 0 0
10 15 2 0 0 0 0
10 17 1 0 0 0 0
11 12 2 0 0 0 0
11 14 1 0 0 0 0
12 15 1 0 0 0 0
13 18 2 0 0 0 0
13 19 1 0 0 0 0
14 17 2 0 0 0 0
14 24 1 0 0 0 0
15 25 1 0 0 0 0
17 26 1 0 0 0 0
18 20 1 0 0 0 0
18 27 1 0 0 0 0
19 21 2 0 0 0 0
19 28 1 0 0 0 0
20 22 2 0 0 0 0
20 29 1 0 0 0 0
21 22 1 0 0 0 0
21 30 1 0 0 0 0
22 31 1 0 0 0 0
M END
$$$$