fragmenstein/demo/mac1_mols/mac-x0213.mol
mac-x0213
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
-0.1120 11.6020 -2.9430 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3170 12.7530 -2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8380 13.1520 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1450 13.6740 -4.0270 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.3160 14.1270 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2270 15.5690 -4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2200 16.3660 -5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9080 17.6460 -5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6000 18.1260 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3930 17.3070 -4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0730 16.0330 -4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9840 14.9450 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
4 2 1 1
4 5 1 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
6 11 1 0
10 11 2 0
4 12 1 0
11 12 1 0
M END