fragmenstein/demo/mac1_mols/mac-x0565.mol
mac-x0565
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
-5.7790 15.0610 0.8120 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1230 15.0630 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3560 14.9930 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0330 15.0500 -1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3670 15.1670 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3780 15.1230 -3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0420 14.9610 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8460 14.8730 -4.0900 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8280 15.1860 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2950 14.6850 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7030 14.8390 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6940 14.9020 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 1 0
9 10 1 0
7 11 1 0
10 11 1 0
4 12 1 0
11 12 2 0
M END