D0S5LS
-OEChem-10101305022D
34 35 0 0 0 0 0 0 0999 V2000
5.4641 3.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.4050 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -4.4050 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4641 3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4641 3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 4.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 -2.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2087 -2.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 1.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 8 1 0 0 0 0
1 11 1 0 0 0 0
2 18 1 0 0 0 0
3 19 1 0 0 0 0
4 13 2 0 0 0 0
7 9 1 0 0 0 0
7 13 1 0 0 0 0
7 25 1 0 0 0 0
8 33 1 0 0 0 0
8 34 1 0 0 0 0
9 12 1 0 0 0 0
9 23 1 0 0 0 0
9 24 1 0 0 0 0
10 13 1 0 0 0 0
10 14 2 0 0 0 0
10 15 1 0 0 0 0
11 16 2 0 0 0 0
11 17 1 0 0 0 0
12 18 2 0 0 0 0
12 19 1 0 0 0 0
14 16 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 28 1 0 0 0 0
17 29 1 0 0 0 0
18 20 1 0 0 0 0
19 21 2 0 0 0 0
20 22 2 0 0 0 0
20 30 1 0 0 0 0
21 22 1 0 0 0 0
21 31 1 0 0 0 0
22 32 1 0 0 0 0
M END
$$$$