B0C3QN
-OEChem-04022107572D
26 27 0 0 0 0 0 0 0999 V2000
6.3301 -2.6900 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.3100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
5.4641 1.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3100 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2.8660 0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 2 0 0 0 0
2 14 2 0 0 0 0
3 15 2 0 0 0 0
4 8 1 0 0 0 0
5 8 2 0 0 0 0
6 14 1 0 0 0 0
6 19 1 0 0 0 0
6 24 1 0 0 0 0
7 15 1 0 0 0 0
7 19 1 0 0 0 0
7 25 1 0 0 0 0
8 16 1 0 0 0 0
9 11 1 0 0 0 0
9 12 2 0 0 0 0
9 13 1 0 0 0 0
10 11 2 0 0 0 0
10 14 1 0 0 0 0
10 15 1 0 0 0 0
11 20 1 0 0 0 0
12 16 1 0 0 0 0
12 21 1 0 0 0 0
13 17 2 0 0 0 0
13 22 1 0 0 0 0
16 18 2 0 0 0 0
17 18 1 0 0 0 0
17 23 1 0 0 0 0
18 26 1 0 0 0 0
M CHG 2 4 -1 8 1
M END
$$$$