BDC07X
-OEChem-04022106542D
42 44 0 1 0 0 0 0 0999 V2000
6.3981 5.0173 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.3981 4.0173 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.3981 4.0173 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -1.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -4.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 0.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -4.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -1.4827 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.8000 -3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -2.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -4.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -2.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -5.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -4.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -2.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0881 -2.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9350 -2.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7081 -1.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9350 -0.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -2.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 -3.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9951 1.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8010 2.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -5.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9951 2.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -3.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -4.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 28 1 0 0 0 0
2 28 1 0 0 0 0
3 28 1 0 0 0 0
4 10 1 0 0 0 0
4 12 1 0 0 0 0
5 15 1 0 0 0 0
5 26 1 0 0 0 0
6 13 2 0 0 0 0
7 26 2 0 0 0 0
8 13 1 0 0 0 0
8 14 1 0 0 0 0
8 34 1 0 0 0 0
9 29 3 0 0 0 0
10 13 1 0 0 0 0
10 16 1 0 0 0 0
10 30 1 0 0 0 0
11 12 1 0 0 0 0
11 15 1 0 0 0 0
11 18 2 0 0 0 0
12 19 2 0 0 0 0
14 17 2 0 0 0 0
14 21 1 0 0 0 0
15 23 2 0 0 0 0
16 31 1 0 0 0 0
16 32 1 0 0 0 0
16 33 1 0 0 0 0
17 22 1 0 0 0 0
17 29 1 0 0 0 0
18 25 1 0 0 0 0
18 35 1 0 0 0 0
19 26 1 0 0 0 0
19 36 1 0 0 0 0
20 22 2 0 0 0 0
20 24 1 0 0 0 0
20 28 1 0 0 0 0
21 24 2 0 0 0 0
21 37 1 0 0 0 0
22 38 1 0 0 0 0
23 27 1 0 0 0 0
23 39 1 0 0 0 0
24 40 1 0 0 0 0
25 27 2 0 0 0 0
25 41 1 0 0 0 0
27 42 1 0 0 0 0
M END
$$$$