fragmenstein/demo/mac1_mols/mac-x0271.mol
mac-x0271
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
-3.6890 15.0240 -3.0710 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3180 15.0630 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5780 15.0970 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2570 15.1150 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6640 15.1070 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4140 15.1260 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8450 14.8910 1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5870 15.0120 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.7730 15.0580 0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.8530 15.0720 -0.5740 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.3910 15.0800 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7040 15.0620 -1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
8 10 1 0
5 11 1 0
10 11 1 0
2 12 1 0
11 12 2 0
M END