fragmenstein/demo/mac1_mols/mac-x0417.mol
mac-x0417
RDKit 3D
13 14 0 0 0 0 0 0 0 0999 V2000
1.2070 12.6730 -2.4030 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8560 12.0140 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9210 10.7400 -3.3270 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3580 12.6710 -4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2740 11.7220 -5.8190 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1330 11.6240 -6.7980 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7560 10.7260 -7.6960 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3140 10.1180 -7.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1360 9.1120 -7.8660 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3260 8.7340 -7.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6960 9.4020 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9170 10.3640 -5.5860 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7340 10.7280 -6.1240 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 1 0
5 6 2 0
6 7 1 0
7 8 1 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
5 13 1 0
8 13 2 0
12 13 1 0
M END