D0Q7KI
-OEChem-09301911162D
28 30 0 0 0 0 0 0 0999 V2000
3.4030 1.0504 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.9473 0.8551 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.9496 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.9030 1.9164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9030 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9473 -0.7543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.0697 -0.4496 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 1.5504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.0697 0.5504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.8096 -1.7097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.5504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.5504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.0504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5309 0.0504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5309 0.0504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1186 -0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1186 0.8594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.5696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9271 1.4491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5713 -0.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 2.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2245 -2.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2032 -1.8386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 8 1 0 0 0 0
1 13 1 0 0 0 0
2 11 1 0 0 0 0
2 15 1 0 0 0 0
3 17 1 0 0 0 0
6 12 1 0 0 0 0
6 15 2 0 0 0 0
7 9 1 0 0 0 0
7 19 1 0 0 0 0
7 24 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 20 2 0 0 0 0
10 19 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 12 1 0 0 0 0
11 14 2 0 0 0 0
12 16 2 0 0 0 0
13 14 1 0 0 0 0
13 17 2 0 0 0 0
14 21 1 0 0 0 0
15 18 1 0 0 0 0
16 17 1 0 0 0 0
16 22 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
20 23 1 0 0 0 0
M END
$$$$