fragmenstein/demo/mac1_mols/mac-x0373.mol
mac-x0373
RDKit 3D
16 17 0 0 0 0 0 0 0 0999 V2000
0.3020 13.0680 -1.5980 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0140 14.2150 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8350 15.1370 -1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3230 14.4910 -2.7670 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.7080 13.2370 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0380 12.9520 -4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3510 11.8090 -5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3210 10.9310 -5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9960 11.2100 -3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6690 12.3490 -3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4180 14.9410 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5900 15.4960 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5920 15.9260 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4270 15.7780 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2590 15.2190 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2490 14.8090 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
4 2 1 1
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
8 9 1 0
5 10 1 0
9 10 2 0
4 11 1 0
11 12 2 0
12 13 1 0
13 14 2 0
14 15 1 0
11 16 1 0
15 16 2 0
M END