fragmenstein/demo/mac1_mols/mac-x0301.mol
mac-x0301
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
0.5370 14.6700 -3.2050 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6890 14.6060 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2040 14.2940 -4.4030 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5570 14.8920 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8600 15.3160 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6410 15.5860 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1200 15.4290 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8060 15.0040 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0660 14.7240 1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2630 14.6080 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2310 14.3060 -0.3200 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0330 14.7260 -0.7830 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
10 11 1 0
4 12 1 0
8 12 2 0
11 12 1 0
M END