B0EBK2
-OEChem-04012115162D
37 39 0 0 0 0 0 0 0999 V2000
2.9176 -2.2673 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 1.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 1.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.3263 0.7673 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
12.4603 -0.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 0.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 0.7673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.4603 0.2673 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
3.8000 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 0.8020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -1.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -1.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 1.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -1.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 -0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3252 2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1312 2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 2.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
2 12 2 0 0 0 0
3 19 2 0 0 0 0
4 9 1 0 0 0 0
5 9 2 0 0 0 0
6 11 1 0 0 0 0
6 14 1 0 0 0 0
6 27 1 0 0 0 0
7 8 1 0 0 0 0
7 19 1 0 0 0 0
7 32 1 0 0 0 0
8 24 2 0 0 0 0
9 22 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
10 15 1 0 0 0 0
11 16 1 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
13 19 1 0 0 0 0
14 28 1 0 0 0 0
15 17 2 0 0 0 0
15 29 1 0 0 0 0
16 18 2 0 0 0 0
17 18 1 0 0 0 0
17 30 1 0 0 0 0
18 31 1 0 0 0 0
20 21 2 0 0 0 0
20 23 1 0 0 0 0
20 24 1 0 0 0 0
21 22 1 0 0 0 0
21 33 1 0 0 0 0
22 25 2 0 0 0 0
23 26 2 0 0 0 0
23 34 1 0 0 0 0
24 35 1 0 0 0 0
25 26 1 0 0 0 0
25 36 1 0 0 0 0
26 37 1 0 0 0 0
M CHG 2 4 -1 9 1
M END
$$$$