fragmenstein/demo/mac1_mols/mac-x0444.mol
mac-x0444
RDKit 3D
12 13 0 0 0 0 0 0 0 0999 V2000
19.4670 28.5860 4.6290 N 0 0 0 0 0 0 0 0 0 0 0 0
20.2940 27.6920 3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0
20.5120 27.9360 2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0
20.8600 26.4480 4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0
20.0980 25.7920 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0
20.6010 24.6580 6.2030 C 0 0 0 0 0 0 0 0 0 0 0 0
21.8610 24.1930 5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0
22.6380 24.8520 4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0
23.8890 24.6070 4.3980 N 0 0 0 0 0 0 0 0 0 0 0 0
24.2100 25.5060 3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0
23.1480 26.3830 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0
22.1470 25.9650 4.2550 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 2 0
4 12 1 0
8 12 2 0
11 12 1 0
M END