D09PDD
-OEChem-10101305022D
27 28 0 0 0 0 0 0 0999 V2000
4.2690 -1.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -0.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4931 -0.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4931 1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3991 -0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3991 1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 2.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4859 -1.1720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4859 2.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9349 -0.3502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9349 1.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 3 1 0 0 0 0
2 27 1 0 0 0 0
3 16 1 0 0 0 0
3 26 1 0 0 0 0
4 5 1 0 0 0 0
4 7 1 0 0 0 0
4 10 2 0 0 0 0
5 8 1 0 0 0 0
5 11 2 0 0 0 0
6 7 2 0 0 0 0
6 9 1 0 0 0 0
6 14 1 0 0 0 0
7 17 1 0 0 0 0
8 9 2 0 0 0 0
8 18 1 0 0 0 0
9 19 1 0 0 0 0
10 12 1 0 0 0 0
10 20 1 0 0 0 0
11 13 1 0 0 0 0
11 21 1 0 0 0 0
12 13 2 0 0 0 0
12 22 1 0 0 0 0
13 23 1 0 0 0 0
14 15 2 0 0 0 0
14 24 1 0 0 0 0
15 16 1 0 0 0 0
15 25 1 0 0 0 0
M END
$$$$