fragmenstein/demo/mac1_mols/mac-x0511.mol
mac-x0511
RDKit 3D
11 12 0 0 0 0 0 0 0 0999 V2000
6.0340 45.6390 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0250 45.0570 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2420 43.6810 -0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2930 42.7050 0.0240 C 0 0 2 0 0 0 0 0 0 0 0 0
5.0440 41.7670 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0210 40.9930 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9590 40.3250 0.9250 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0660 40.5850 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3850 42.0300 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3180 43.4460 -1.4310 N 0 0 0 0 0 0 0 0 0 0 0 0
6.7930 44.6490 -1.8460 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
4 3 1 6
4 5 1 0
5 6 1 0
6 7 1 0
7 8 1 0
4 9 1 0
8 9 1 0
3 10 2 0
1 11 1 0
10 11 1 0
M END