0  B8R0.7  CC(=O)CCCOC=O BB54-0059 [0,0,0,0,0,0|3,0,0]=3
1  B8R0.7  COCCCNC(N)=O BB01-7612 [0,0,0,0,0,0|3,0,1]=4
2  B7R0.4  C=CCCNC(C)C BB58-4949 [1,0,0,0,0,0|2,0,1]=4
3  B7R0.4  C=CCSCC(=O)O BB12-3265 [1,0,0,0,0,0|2,0,0]=3
4  B7R0.4  CC(=O)NCCCN BB32-2735 [1,0,0,0,0,0|2,0,0]=3
5  B7R0.4  CC(=O)NCCCO BB12-3384 [1,0,0,0,0,0|2,0,0]=3
6  B9R0.55  CC(=O)CCCOC(C)=O BB54-0058 [0,1,0,0,0,0|0,0,1]=2
7  B9R0.55  CC(=O)NCCNC(C)=O BB20-3038 [0,1,0,0,0,0|2,0,1]=4
8  B9R1.2  NCC1CCNC(=O)C1 BB31-2480 [0,0,0,1,0,0|2,0,1]=4
9  B9R1.7  CCCC1CNC(=O)C1 BB55-7002 [0,0,0,1,0,0|1,0,2]=4
10  B9R1.50  O=C1CCCCCCC1 BB12-2910 [0,0,0,1,0,0|1,0,2]=4
11  B6R0.6  C=CCCCC#N BB12-2224 [2,0,0,0,0,0|1,0,1]=4
12  B6R0.6  [C-]#[N+]CCCOC BB56-1464 [2,0,0,0,0,0|1,0,1]=4
13  B6R0.4  CCCNC(N)=O BB01-7603 [2,0,0,0,0,0|2,0,0]=4
14  B6R0.4  COCCC(C)=O BB58-1056 [2,0,0,0,0,0|1,0,1]=4
15  B6R0.4  NC(=O)CCCCl BB57-2489 [2,0,0,0,0,0|2,0,0]=4
16  B6R0.4  NCCCC(N)=O BB57-4725 [2,0,0,0,0,0|2,0,0]=4
17  B8R0.4  C=CCCNCCC=C BB58-4950 [1,1,0,0,0,0|1,0,1]=4
18  B8R0.4  C=CCCNCCOC BB58-0794 [1,1,0,0,0,0|2,0,0]=4
19  B8R0.8  C=CCSC(C)C(=O)O BB12-3266 [1,1,0,0,0,0|2,0,0]=4
20  B8R0.8  CCCCC(N)C(C)=O BB54-3218 [1,1,0,0,0,0|0,0,2]=4
21  B8R0.28  NC(=O)CCCC(=O)O BB12-2466 [1,1,0,0,0,0|2,0,0]=4
22  B8R1.2  O=CC1CC=CCC1 BB01-8334 [1,0,0,1,0,0|2,0,0]=4
23  B8R1.5  O=C1OCCCC1Br BB17-3008 [1,0,0,1,0,0|1,0,1]=4
24  B8R1.1  CCC1COC(=O)N1 BB57-3665 [1,0,0,1,0,0|1,0,1]=4
25  B8R1.1  O=C1CC(CO)CN1 BB57-1047 [1,0,0,1,0,0|2,0,0]=4
26  B8R1.7  CC(=O)C1CCCC1 BB55-6362 [1,0,0,1,0,0|0,0,2]=4
27  B8R1.7  O=C(O)[C@H]1C=CCN1 BB32-2958 [1,0,0,1,0,0|2,0,0]=4
28  B10R1.61  CC(=O)C1=C(N)CCCC1 BB58-2024 [0,1,0,1,0,0|1,0,1]=4