0  B4R0.1  CC(C)NN BB0218180 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.1  CCC(=N)N BB0263021 [0,0,0,0,0,0|3,0,1]=4
2  B4R0.1  C\C(N)=N\O BB0241915 [0,0,0,0,0,0|2,0,1]=3
3  B4R0.1  NCC(=O)O BB0265974 [0,0,0,0,0,0|2,0,1]=3
4  B3R0.1  O=CC=O BB0268084 [1,0,0,0,0,0|0,0,0]=1
5  B3R0.2  C=C(C)Br BB0272402 [1,0,0,0,0,0|1,0,0]=2
6  B3R0.2  C=[N+](C)C BB0263006 [1,0,0,0,0,0|2,0,0]=3
7  B3R0.2  NC(N)=O BB0269740 [1,0,0,0,0,0|2,0,0]=3
8  B5R0.1  C\C=C\C(N)=O BB0256989 [0,1,0,0,0,0|2,0,0]=3
9  B5R0.3  CNC(=O)CBr BB0220603 [0,1,0,0,0,0|1,0,1]=3
10  B5R0.5  CC(C)C(=N)N BB0238637 [0,1,0,0,0,0|2,0,1]=4
11  B5R0.5  CN(C)C(=N)N BB0269541 [0,1,0,0,0,0|3,0,0]=4
12  B5R1.2  O=C1COC1 BB0263332 [0,0,0,1,0,0|0,0,2]=3
13  B5R1.3  O=CC1CC1 BB0268091 [0,0,0,1,0,0|1,0,1]=3
14  B4R0.2  C=CCNC BB0263010 [1,1,0,0,0,0|1,0,1]=4
15  B4R0.3  NS(N)(=O)=O BB0260582 [1,1,0,0,0,0|2,0,0]=4
16  B6R0.1  CCCC(=O)NN BB0240969 [0,2,0,0,0,0|2,0,0]=4
17  B6R0.1  CCNC(=O)CBr BB0258309 [0,2,0,0,0,0|1,0,1]=4
18  B6R0.1  CNC(=O)CC#N BB0240860 [0,2,0,0,0,0|1,0,1]=4
19  B6R0.2  CC(C)NC(N)=O BB0266031 [0,2,0,0,0,0|1,0,1]=4
20  B6R0.2  CN(C)CC(N)=O BB0258818 [0,2,0,0,0,0|2,0,0]=4
21  B6R0.3  CN(C)C(=O)CBr BB0254000 [0,2,0,0,0,0|1,0,1]=4
22  B6R0.3  CO[C@@H](C)C(N)=O BB0287968 [0,2,0,0,0,0|0,0,2]=4
23  B6R0.3  N[C@@H](CO)C(=O)O BB0282131 [0,2,0,0,0,0|1,0,1]=4
24  B6R0.3  N[C@@H](CS)C(=O)O BB0282130 [0,2,0,0,0,0|1,0,1]=4
25  B6R0.4  C[C@H](O)CNC=O BB0258832 [0,2,0,0,0,0|0,0,2]=4
26  B6R1.2  CC1=CNN=C1 BB0257933 [0,1,0,1,0,0|2,0,0]=4
27  B6R1.2  O=C1CCOC1 BB0268417 [0,1,0,1,0,0|0,0,2]=4
28  B6R1.2  O=C1NC=CN1 BB0265892 [0,1,0,1,0,0|2,0,0]=4
29  B6R1.3  O=CCC1CC1 BB0261648 [0,1,0,1,0,0|1,0,1]=4
30  B6R1.11  O=C(O)C1CC1 BB0269516 [0,1,0,1,0,0|1,0,1]=4