fragmenstein/demo/mpro_mols/Mpro-6xb2.mol
RDKit 3D
9 9 0 0 0 0 0 0 0 0999 V2000
18.2490 -12.9110 -6.0510 O 0 0 0 0 0 0 0 0 0 0 0 0
18.9610 -14.9350 -5.1340 N 0 0 0 0 0 0 0 0 0 0 0 0
16.6340 -14.6410 -5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0
18.9980 -16.9710 -4.0360 O 0 0 0 0 0 0 0 0 0 0 0 0
18.0130 -14.0170 -5.5770 C 0 0 0 0 0 0 0 0 0 0 0 0
18.3850 -16.1090 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0
16.9180 -16.1080 -5.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
20.4190 -14.7260 -5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0
20.8480 -13.2600 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0
5 1 2 0
5 3 1 0
5 2 1 0
6 4 2 0
6 2 1 0
7 6 1 0
7 3 1 0
8 2 1 0
9 8 1 0
M END