0  B6R0.4  CC(C)CCC=O BB58-4980 [0,0,0,0,0,0|0,0,2]=2
1  B6R0.4  CC(C)NCCN BB57-0247 [0,0,0,0,0,0|2,0,2]=4
2  B6R0.4  CC(C)OCCO BB01-5911 [0,0,0,0,0,0|1,0,3]=4
3  B5R0.1  CC(C)CNN BB58-2806 [1,0,0,0,0,0|2,0,1]=4
4  B5R0.1  CC(C)N=C=O BB58-3549 [1,0,0,0,0,0|1,0,1]=3
5  B5R0.1  CC(C)N=C=S BB01-6321 [1,0,0,0,0,0|1,1,1]=4
6  B5R0.2  CCCN=C=O BB58-3576 [1,0,0,0,0,0|1,0,2]=4
7  B7R0.2  CC(C)NC(=O)CCl BB01-5507 [0,1,0,0,0,0|2,0,1]=4
8  B7R0.6  CC(=O)CCN(C)C BB55-6125 [0,1,0,0,0,0|1,0,2]=4
9  B7R0.6  CC(C)OCC(=O)O BB55-5141 [0,1,0,0,0,0|1,0,1]=3
10  B7R0.8  C=CC#CC(C)(C)O BB57-6759 [0,1,0,0,0,0|1,0,2]=4
11  B7R1.2  CC1=NN(C)C=C1 BB01-5082 [0,0,0,1,0,0|3,0,0]=4
12  B7R1.2  CN1C=CC(N)=N1 BB05-1352 [0,0,0,1,0,0|3,0,0]=4
13  B4R0.2  CCN=C=O BB01-7862 [2,0,0,0,0,0|1,0,1]=4
14  B6R0.1  CCC(C)N=C=O BB01-6539 [1,1,0,0,0,0|1,0,1]=4
15  B6R0.2  CC(C)=CC(=O)Cl BB20-1413 [1,1,0,0,0,0|0,0,1]=3
16  B6R0.2  CC(C)NC(N)=S BB20-1187 [1,1,0,0,0,0|1,1,0]=4
17  B6R0.5  CC(C)(C)N=C=O BB01-6171 [1,1,0,0,0,0|1,0,1]=4
18  B8R0.23  CC(C)C(N)CC(=O)O BB01-4066 [0,2,0,0,0,0|0,0,2]=4
19  B8R0.23  CC(C)NC(=O)C(=O)O BB55-4701 [0,2,0,0,0,0|1,0,0]=3
20  B8R0.9  CC(C)CNC(=O)CCl BB53-1221 [0,2,0,0,0,0|1,0,1]=4
21  B6R1.2  CN1C=CC=N1 BB01-6294 [1,0,0,1,0,0|2,0,0]=4
22  B8R1.1  CC1=CC=C(C=O)S1 BB17-2278 [0,1,0,1,0,0|1,0,1]=4
23  B8R1.18  CC1NC(=O)NC1=O BB57-3967 [0,1,0,1,0,0|2,0,0]=4
24  B8R1.7  CC(N)C1=CC=CO1 BB01-4826 [0,1,0,1,0,0|1,0,1]=4
25  B8R1.7  CC(N)C1=CC=CS1 BB01-4334 [0,1,0,1,0,0|1,1,0]=4