fragmenstein/demo/mac1_mols/mac-x0188.mol
mac-x0188
RDKit 3D
15 16 0 0 0 0 0 0 0 0999 V2000
1.3510 13.0880 -4.8290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0510 13.4520 -4.5030 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0700 13.5100 -5.2800 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1500 13.8420 -4.6520 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8320 14.1350 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4640 13.8590 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4730 14.0190 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9160 15.1570 -1.9000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7930 13.0060 -1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7880 14.6480 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9810 15.1460 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8820 15.6140 -1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5240 15.5880 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3220 15.0540 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4360 14.5960 -1.0800 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 2 0
2 6 2 0
5 6 1 0
6 7 1 0
7 8 2 0
7 9 1 0
5 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