B0WIL3
-OEChem-04022101212D
43 45 0 0 0 0 0 0 0999 V2000
9.7942 -0.6900 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
14.1923 -0.2108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
14.1923 0.8308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2942 0.1760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2942 -1.5560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 -0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2862 -0.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2862 1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8816 -1.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.6799 -1.2037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.6799 1.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8816 1.8144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 1.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1233 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 -0.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 -0.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 0.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 9 1 0 0 0 0
1 13 1 0 0 0 0
2 25 1 0 0 0 0
2 26 1 0 0 0 0
3 4 1 0 0 0 0
3 15 1 0 0 0 0
4 16 1 0 0 0 0
7 24 2 0 0 0 0
8 26 2 0 0 0 0
9 19 1 0 0 0 0
9 35 1 0 0 0 0
10 19 2 0 0 0 0
10 23 1 0 0 0 0
11 12 2 0 0 0 0
11 14 1 0 0 0 0
11 15 1 0 0 0 0
12 16 1 0 0 0 0
12 17 1 0 0 0 0
13 14 2 0 0 0 0
13 18 1 0 0 0 0
14 28 1 0 0 0 0
15 29 1 0 0 0 0
15 30 1 0 0 0 0
16 31 1 0 0 0 0
16 32 1 0 0 0 0
17 18 2 0 0 0 0
17 33 1 0 0 0 0
18 34 1 0 0 0 0
19 20 1 0 0 0 0
20 22 2 0 0 0 0
20 36 1 0 0 0 0
21 22 1 0 0 0 0
21 23 2 0 0 0 0
21 24 1 0 0 0 0
22 37 1 0 0 0 0
23 38 1 0 0 0 0
24 25 1 0 0 0 0
25 39 1 0 0 0 0
25 40 1 0 0 0 0
26 27 1 0 0 0 0
27 41 1 0 0 0 0
27 42 1 0 0 0 0
27 43 1 0 0 0 0
M END
$$$$