fragmenstein/demo/mac1_mols/mac-x0436.mol
mac-x0436
RDKit 3D
16 17 0 0 0 0 0 0 0 0999 V2000
0.8300 10.9820 -2.9230 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1590 12.1480 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3190 12.7910 -1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4760 12.7910 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2820 13.2350 -5.0640 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5070 12.0230 -5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0060 11.2480 -6.5100 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7070 10.0430 -6.9000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2320 9.2940 -7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9430 8.1420 -8.3530 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0970 7.8040 -7.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5800 8.5390 -6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8940 9.6940 -6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4020 10.4630 -5.1290 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6870 11.6340 -4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0850 12.2820 -3.8660 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 1 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
8 13 1 0
12 13 2 0
13 14 1 0
6 15 1 0
14 15 1 0
15 16 2 0
M END