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
|
MJ221900
17 16 0 0 0 0 0 0 0 0999 V2000
-1.1535 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1535 3.7580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 1.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6424 3.0781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6695 3.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6695 2.8459 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 2.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1535 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1535 3.7580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 2.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6424 3.0781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 1.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1535 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1535 3.7580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 2.5205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6424 3.0781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4390 1.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
5 11 1 0 0 0 0
6 13 1 0 0 0 0
1 7 1 0 0 0 0
7 3 1 0 0 0 0
7 4 1 0 0 0 0
8 10 1 0 0 0 0
8 9 2 0 0 0 0
10 12 1 0 0 0 0
10 11 1 0 0 0 0
13 15 1 0 0 0 0
13 14 2 0 0 0 0
15 17 1 0 0 0 0
15 16 1 0 0 0 0
16 1 1 0 0 0 0
4 8 1 0 0 0 0
M STY 1 1 MUL
M SAL 1 15 1 2 3 4 7 8 9 10 11 12 13 14 15 16 17
M SPA 1 5 1 2 3 4 7
M SMT 1 3
M SBL 1 2 15 14
M END
|