fragmenstein/demo/mac1_mols/mac-x0190.mol
mac-x0190
RDKit 3D
11 12 0 0 0 0 0 0 0 0999 V2000
-9.1430 14.9480 2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.9690 14.1310 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5490 14.5020 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3170 14.7300 -0.3810 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.0430 14.9950 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2760 15.3110 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9410 15.5320 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3050 15.4350 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0300 15.1070 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4660 14.8640 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3990 14.5890 1.5280 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
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
3 11 1 0
10 11 1 0
M END