fragmenstein/demo/mac1_mols/mac-x0394.mol
mac-x0394
RDKit 3D
12 12 0 0 0 0 0 0 0 0999 V2000
1.1760 18.2960 -4.7640 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.2590 15.5420 -5.3830 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.1620 11.3640 -3.1520 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6730 12.5110 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8900 13.0570 -1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1730 13.1710 -4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4450 14.4480 -4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1240 15.6600 -4.5190 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3840 16.7590 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9090 16.7510 -5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5530 15.6020 -5.0510 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8780 14.4420 -4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 0
1 9 1 0
8 9 1 0
9 10 2 0
2 11 1 0
10 11 1 0
7 12 1 0
11 12 2 0
M END