fragmenstein/demo/mac1_mols/mac-x0455.mol
mac-x0455
RDKit 3D
12 12 0 0 0 0 0 0 0 0999 V2000
-2.1440 14.4000 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9830 14.2000 -3.3950 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.9610 15.3650 -4.1050 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2070 14.1160 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8430 15.1320 -2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6090 13.0570 -1.9890 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0250 12.9850 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0450 12.7130 -5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0270 11.6060 -5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0630 10.7560 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1390 11.0160 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1010 12.1670 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 1
2 3 1 0
2 4 1 0
4 5 2 0
4 6 1 0
2 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
7 12 1 0
11 12 2 0
M END