D0E3PF
-OEChem-10101305022D
34 35 0 0 0 0 0 0 0999 V2000
5.5686 4.3933 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.3988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3776 2.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5468 4.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0468 3.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 0.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -0.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -0.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 0.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 3.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -4.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -5.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7990 5.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6634 3.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 18 1 0 0 0 0
2 15 2 0 0 0 0
3 14 1 0 0 0 0
3 17 1 0 0 0 0
4 8 1 0 0 0 0
4 15 1 0 0 0 0
4 26 1 0 0 0 0
5 15 1 0 0 0 0
5 16 1 0 0 0 0
5 29 1 0 0 0 0
6 16 2 0 0 0 0
6 19 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
10 12 1 0 0 0 0
10 24 1 0 0 0 0
11 13 2 0 0 0 0
11 25 1 0 0 0 0
12 14 2 0 0 0 0
12 27 1 0 0 0 0
13 14 1 0 0 0 0
13 28 1 0 0 0 0
17 30 1 0 0 0 0
17 31 1 0 0 0 0
17 32 1 0 0 0 0
18 19 2 0 0 0 0
18 33 1 0 0 0 0
19 34 1 0 0 0 0
M END
$$$$