fragmenstein/demo/mac1_mols/diamond-x0334_A.mol
RDKit 3D
14 14 0 0 0 0 0 0 0 0999 V2000
4.0160 24.7090 16.7450 N 0 0 0 0 0 0 0 0 0 0 0 0
5.7090 22.9530 16.9570 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4670 24.4320 16.7460 C 0 0 2 0 0 0 0 0 0 0 0 0
-2.0760 26.1380 15.9110 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1630 25.2610 17.8000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6210 26.0550 16.3090 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1200 26.1630 16.1940 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4870 25.9570 14.9790 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1070 25.9400 14.8800 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6920 26.1360 16.0080 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0490 26.3600 17.2330 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3330 26.3820 17.3130 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9250 26.3200 17.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7480 25.8640 14.6510 C 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0
1 6 1 0
3 2 1 1
3 5 1 0
6 7 1 0
4 10 1 0
4 13 1 0
4 14 1 0
10 9 2 0
10 11 1 0
7 8 2 0
7 12 1 0
8 9 1 0
12 11 2 0
M END