fragmenstein/demo/mac1_mols/mac-x0139.mol
mac-x0139
RDKit 3D
16 17 0 0 0 0 0 0 0 0999 V2000
-2.2300 15.1570 -3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0580 15.0860 -2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2310 14.9750 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3710 13.6080 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8530 12.4130 -2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4290 12.7110 -1.8790 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7570 11.2110 -3.1160 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1750 15.0900 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0810 15.0640 -0.3150 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0910 15.0470 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1790 15.0780 1.6290 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3500 15.1240 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5600 15.1670 1.4440 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.3840 15.2210 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7260 15.1970 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3920 15.1290 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 2 0
5 7 1 0
2 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 1 0
13 14 1 0
14 15 2 0
8 16 1 0
12 16 2 0
15 16 1 0
M END