fragmenstein/demo/mac1_mols/mac-x0576.mol
mac-x0576
RDKit 3D
13 14 0 0 0 0 0 0 0 0999 V2000
0.5150 14.2770 1.5520 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6710 14.5410 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8170 14.5390 1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.9770 14.7740 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1650 14.7980 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.2790 15.0400 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3090 15.0430 1.3310 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2320 15.2720 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0700 15.2670 -1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.9170 15.0120 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6530 14.9940 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5600 15.1730 -2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5690 14.7540 -0.5180 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
3 4 1 0
4 5 1 0
5 6 1 0
6 7 2 0
6 8 1 0
8 9 2 0
4 10 2 0
9 10 1 0
10 11 1 0
11 12 2 0
2 13 1 0
11 13 1 0
M END