fragmenstein/demo/mac1_mols/diamond-x0592_A.mol
RDKit 3D
11 11 0 0 0 0 0 0 0 0999 V2000
-2.7960 14.9100 1.1250 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.2790 14.8360 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5860 14.8030 -1.1300 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7450 14.8000 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8240 14.9760 -1.1360 N 0 0 0 0 0 0 0 0 0 0 0 0
-7.3640 15.1080 3.0660 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.5320 15.0020 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8820 14.7270 0.1940 N 0 0 0 0 0 0 0 0 0 0 0 0
-8.1820 14.6030 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0340 14.1320 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6630 14.6200 0.7510 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 7 1 0
4 11 2 0
7 5 2 0
11 8 1 0
5 8 1 0
8 9 1 0
6 10 1 0
10 9 1 0
M END