fragmenstein/demo/mac1_mols/diamond-x0900_A.mol
RDKit 3D
6 6 0 0 0 0 0 0 0 0999 V2000
-4.7660 15.1090 -1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0
-5.8820 14.9740 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0230 15.0060 -0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.5280 14.7780 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0890 15.2490 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5570 15.1450 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 6 1 0
2 3 2 0
2 4 1 0
6 5 1 0
4 5 1 0
M END