fragmenstein/demo/mac1_mols/mac-x0228.mol
mac-x0228
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
-1.0650 14.6080 -1.8450 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0110 14.7050 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8120 14.6700 -3.8850 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4140 14.8390 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4290 15.1900 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7160 15.3270 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0300 15.0920 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3380 15.1410 -0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1460 14.4600 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7030 14.6040 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0340 14.7670 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6770 14.6510 -0.6890 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