1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39
|
-ISIS- 07191219392D
16 17 0 0 0 0 0 0 0 0999 V2000
-3.9531 1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9416 0.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4278 0.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4257 -0.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9264 -0.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4444 -0.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4497 0.3477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4623 1.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4798 2.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9940 2.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0000 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9652 2.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4538 2.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4426 1.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1190 2.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9700 0.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 2 1 0 0 0 0
1 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 1 2 0 0 0 0
13 15 1 0 0 0 0
7 16 1 0 0 0 0
M END
$$$$
|