B6OED7
-OEChem-04022110092D
29 31 0 0 0 0 0 0 0999 V2000
10.1279 -0.1970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 0.6077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 -1.0018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1279 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1279 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 0.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 -1.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6279 0.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6279 -1.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1279 -0.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7369 1.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.4230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3179 1.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3179 -1.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.3399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 0.2660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9379 1.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9379 -1.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4379 -0.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 29 1 0 0 0 0
2 4 1 0 0 0 0
2 6 1 0 0 0 0
2 18 1 0 0 0 0
3 5 1 0 0 0 0
3 6 2 0 0 0 0
4 5 2 0 0 0 0
4 7 1 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
7 9 2 0 0 0 0
7 19 1 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
9 11 1 0 0 0 0
9 14 1 0 0 0 0
10 11 2 0 0 0 0
10 20 1 0 0 0 0
11 21 1 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 24 1 0 0 0 0
14 25 1 0 0 0 0
14 26 1 0 0 0 0
15 17 2 0 0 0 0
15 27 1 0 0 0 0
16 17 1 0 0 0 0
16 28 1 0 0 0 0
M END
$$$$