D0F5AJ
-OEChem-10101305022D
31 33 0 1 0 0 0 0 0999 V2000
6.7485 0.4010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7523 2.5766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6844 3.2525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.2677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -1.8772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.0724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 0.6828 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.9405 0.9902 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.4026 1.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9422 1.9902 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.9917 2.3009 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7320 -0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 -1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4266 0.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4934 1.2707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9425 1.9085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9411 1.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8463 2.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4309 2.7385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3154 0.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8819 -1.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6886 3.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0781 3.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -3.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -3.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10 1 1 1 0 0 0
1 25 1 0 0 0 0
12 2 1 1 0 0 0
2 27 1 0 0 0 0
13 3 1 6 0 0 0
3 28 1 0 0 0 0
9 4 1 6 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
5 15 2 0 0 0 0
5 16 1 0 0 0 0
6 14 1 0 0 0 0
6 18 2 0 0 0 0
7 17 2 0 0 0 0
7 18 1 0 0 0 0
8 17 1 0 0 0 0
8 30 1 0 0 0 0
8 31 1 0 0 0 0
9 10 1 0 0 0 0
9 11 1 0 0 0 0
9 19 1 0 0 0 0
10 12 1 0 0 0 0
10 20 1 0 0 0 0
11 13 1 0 0 0 0
11 21 1 0 0 0 0
11 22 1 0 0 0 0
12 13 1 0 0 0 0
12 23 1 0 0 0 0
13 24 1 0 0 0 0
14 16 2 0 0 0 0
15 26 1 0 0 0 0
16 17 1 0 0 0 0
18 29 1 0 0 0 0
M END
$$$$