B8FR6N
-OEChem-04012116042D
28 30 0 0 0 0 0 0 0999 V2000
6.9473 -0.5804 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 0.7244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.2244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0309 -0.6417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.3673 -2.2244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5309 0.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5309 0.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9473 1.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0254 -0.7462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6241 -1.5552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2333 -1.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1135 0.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4232 0.8349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1399 1.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.8444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.3956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4402 -0.2855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0177 -1.6841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7997 -1.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 9 1 0 0 0 0
2 18 1 0 0 0 0
2 28 1 0 0 0 0
3 18 2 0 0 0 0
4 7 1 0 0 0 0
4 15 1 0 0 0 0
4 16 1 0 0 0 0
5 16 2 0 0 0 0
5 17 1 0 0 0 0
6 7 1 0 0 0 0
6 10 2 0 0 0 0
7 19 1 0 0 0 0
7 20 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
9 12 1 0 0 0 0
10 21 1 0 0 0 0
11 13 2 0 0 0 0
11 22 1 0 0 0 0
12 14 2 0 0 0 0
12 23 1 0 0 0 0
13 14 1 0 0 0 0
13 18 1 0 0 0 0
14 24 1 0 0 0 0
15 17 2 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
17 27 1 0 0 0 0
M END
$$$$