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 40 41 42 43 44 45 46 47 48 49 50 51 52 53
|
22 25 0 0 0 0 0 0 0 0999 V2000
5.6377 1.0226 1.3547 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2669 0.9932 -0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3481 -0.1048 0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0112 -1.4984 -0.1838 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8540 -1.9143 0.6295 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6839 -1.1220 0.3143 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4637 -1.6872 0.1987 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7634 0.2306 0.1809 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7496 1.0161 -0.2403 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8316 2.4961 -0.1581 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6354 0.3222 -0.6643 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3702 -0.9706 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9431 -1.3587 0.2164 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1001 -0.6049 -0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0260 -0.2157 0.9123 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2362 0.2745 0.4297 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0745 0.2643 -1.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2444 0.8157 -1.6111 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3980 0.6652 -0.8961 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6974 0.4620 -1.1735 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.3995 0.4931 -0.0527 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.4964 0.4213 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 1 0
6 7 2 0
6 8 1 0
8 9 2 0
9 10 1 0
9 11 1 0
11 12 2 0
12 13 1 0
13 14 1 0
15 16 2 0
14 15 1 0
14 17 2 0
17 18 1 0
18 19 2 0
19 20 1 0
20 21 1 0
21 22 2 0
1 3 1 0
7 12 1 0
16 19 1 0
16 22 1 0
M END
$$$$
|