fragmenstein/demo/mac1_mols/mac-x0347.mol
mac-x0347
RDKit 3D
15 16 0 0 0 0 0 0 0 0999 V2000
1.3650 14.5100 -3.4190 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5480 14.1840 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9520 13.5060 -1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9260 14.5420 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4700 14.8570 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7620 15.1270 -4.0210 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.5690 15.0810 -2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1050 14.7570 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7500 14.4910 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0820 14.7130 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6990 15.1850 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5940 15.1270 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8390 14.5290 1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2140 14.0050 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3430 14.0950 -0.6390 C 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 2 0
5 6 1 0
6 7 2 0
7 8 1 0
4 9 1 0
8 9 2 0
8 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
13 14 1 0
10 15 1 0
14 15 2 0
M END