0  B6R1.2  NC1=NC=CO1 AN-584/43408342 [0,0,0,0,0,0|2,0,2]=4
1  B6R1.2  O=C1NC=CN1 AK-564/25068002 [0,0,0,0,0,0|2,0,2]=4
2  B5R1.1  C1=COC=N1 AA-511/25015522 [1,0,0,0,0,0|1,0,2]=4
3  B7R1.1  NNC1=NCCN1 AG-690/11353675 [0,1,0,0,0,0|3,0,0]=4
4  B7R1.1  ON=C1CCCC1 AH-034/32464031 [0,1,0,0,0,0|1,0,1]=3
5  B7R1.1  O\N=C1/CCCN1 AG-664/25003377 [0,1,0,0,0,0|1,0,1]=3
6  B7R1.2  NC1=NC(=O)CS1 AE-641/00665038 [0,1,0,0,0,0|2,0,1]=4
7  B7R1.4  NC1CCOC1=O AR-527/43171946 [0,1,0,0,0,0|0,0,0]=1
8  B5R0.1  CCSC(=N)N AE-641/00560030 [0,0,1,0,0,0|2,1,0]=4
9  B7R1.3  OC1CCSCC1 AE-641/30104027 [0,0,0,0,0,1|1,0,2]=4
10  B4R0.1  NCC(=O)O AB-131/40217813 [1,0,1,0,0,0|1,0,0]=3
11  B6R0.1  CCNC(=O)CN AS-787/43399854 [0,1,1,0,0,0|1,0,0]=3
12  B6R0.1  CNCC(=O)OC AO-181/25113008 [0,1,1,0,0,0|1,0,0]=3
13  B6R0.2  CC(C)=CC(=O)O AE-848/32066036 [0,1,1,0,0,0|0,0,2]=4
14  B6R0.4  O=CNCC(=O)O AH-034/32838045 [0,1,1,0,0,0|1,0,1]=4
15  B8R1.3  O=C1CCS(=O)CC1 AN-308/25123005 [0,1,0,0,0,1|1,0,0]=3
16  B8R1.3  O=C1CNC(=O)CN1 AC-907/30002028 [0,1,0,0,0,1|1,0,1]=4
17  B8R1.3  O=C1COC(=O)CN1 AO-125/25086006 [0,1,0,0,0,1|0,0,1]=3
18  B8R1.5  OC1OCCOC1O AQ-405/40002464 [0,1,0,0,0,1|0,0,2]=4
19  B8R1.8  N#CN=C1NCCO1 AP-782/41885216 [0,2,0,0,0,0|2,0,0]=4
20  B8R1.11  O=C1OCC\C1=N\O AE-473/31199008 [0,2,0,0,0,0|0,0,1]=3
21  B8R1.50  CC1C(=O)CCC1=O AC-907/25014141 [0,2,0,0,0,0|1,0,1]=4
22  B8R1.51  CC1(C)COC(=S)N1 AA-516/25012015 [0,2,0,0,0,0|1,1,0]=4