0  B8R0.4  CCCCCCCCCl BBL011474 [0,0,0,0,0,0|3,0,1]=4
1  B8R0.4  CCCCCCCCI BBL027322 [0,0,0,0,0,0|3,0,1]=4
2  B8R0.4  CCOCCCN=C=O BBL037673 [0,0,0,0,0,0|2,1,0]=3
3  B7R0.1  C=CCCCCCC BBL027759 [1,0,0,0,0,0|2,0,1]=4
4  B7R0.1  CCCCCCCI BBL027321 [1,0,0,0,0,0|2,0,1]=4
5  B7R0.1  CCCCCN=C=S BBL027805 [1,0,0,0,0,0|0,0,0]=1
6  B7R0.1  COCCCN=C=O BBL037672 [1,0,0,0,0,0|0,2,0]=3
7  B7R0.1  COCCCN=C=S BBL027870 [1,0,0,0,0,0|0,1,0]=2
8  B9R0.2  CC(C)OCCCN=C=S BBL029946 [0,1,0,0,0,0|2,0,0]=3
9  B9R1.8  S=C=NC1CCCCC1 BBL011352 [0,0,0,1,0,0|1,0,0]=2
10  B9R1.12  O=C=NCC1CCCO1 BBL037674 [0,0,0,1,0,0|2,1,0]=4
11  B9R1.12  S=C=NCC1CCCO1 BBL012474 [0,0,0,1,0,0|2,0,0]=3
12  B6R0.6  CCCCCCBr BBL012217 [2,0,0,0,0,0|1,0,1]=4
13  B6R0.6  CCCCCCI BBL011465 [2,0,0,0,0,0|1,0,1]=4
14  B6R0.6  CCCCCCN BBL011106 [2,0,0,0,0,0|1,0,1]=4
15  B6R0.6  CCCCN=C=O BBL027371 [2,0,0,0,0,0|0,1,0]=3
16  B6R0.6  COCCN=C=S BBL011963 [2,0,0,0,0,0|0,1,0]=3
17  B10R0.24  CCCCCC(CC)N=C=S BBL010000 [0,2,0,0,0,0|1,0,0]=3
18  B8R1.8  O=C=NC1CCCC1 BBL036935 [1,0,0,1,0,0|0,1,0]=3
19  B8R1.8  S=C=NC1CCCC1 BBL027955 [1,0,0,1,0,0|0,0,0]=2
20  B8R1.22  NC1=NCCCCC1 BBL012958 [1,0,0,1,0,0|1,0,1]=4