fragmenstein/demo/mpro_mols/Mpro-7bqy.mol
RDKit 3D
8 8 0 0 0 0 0 0 0 0999 V2000
-0.1530 5.3720 -16.1580 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0040 5.1200 -17.4900 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5870 3.8550 -18.1100 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4430 6.1930 -18.1630 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8840 7.1300 -17.2420 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7060 6.6230 -16.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0580 7.3140 -14.7050 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4660 8.3660 -14.3380 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0
3 2 1 0
4 2 1 0
5 4 1 0
6 1 1 0
6 5 1 0
7 6 1 0
8 7 1 0
M CHG 1 8 -1
M END