fragmenstein/demo/mac1_mols/diamond-x0852_B.mol
RDKit 3D
10 10 0 0 0 0 0 0 0 0999 V2000
-9.5480 17.6680 7.2020 N 0 0 0 0 0 0 0 0 0 0 0 0
-8.3650 15.3460 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6860 14.8960 5.9260 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.1890 16.4790 4.9390 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.3690 17.1300 6.2100 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.8810 16.9420 3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.7550 16.2610 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.9690 15.1310 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2680 14.6800 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.6110 16.9560 1.0870 Br 0 0 0 0 0 0 0 0 0 0 0 0
1 5 3 0
5 4 1 0
2 3 1 0
2 4 2 0
2 9 1 0
4 6 1 0
9 8 2 0
6 7 2 0
7 8 1 0
7 10 1 0
M END