0  B6R0.4  O=CNCC(=O)O AH-034/32838045 [0,0,0,0,0,0|4,0,0]=4
1  B5R0.1  CCSC(=N)N AE-641/00560030 [1,0,0,0,0,0|3,0,0]=4
2  B7R0.3  CCSCC(=O)NN AE-641/40262190 [0,1,0,0,0,0|3,0,0]=4
3  B7R0.5  CSCC(N)C(=O)O AO-800/41069568 [0,1,0,0,0,0|1,0,0]=2
4  B7R0.6  CC(=O)NCC(=O)O AB-131/40177771 [0,1,0,0,0,0|3,0,0]=4
5  B7R1.3  OC1CCSCC1 AE-641/30104027 [0,0,0,1,0,0|0,0,2]=3
6  B7R1.18  O=C(O)C1CCC1 AJ-190/40848564 [0,0,0,1,0,0|2,0,0]=3
7  B4R0.1  NCC(=O)O AB-131/40217813 [2,0,0,0,0,0|2,0,0]=4
8  B6R0.1  CCNC(=O)CN AS-787/43399854 [1,1,0,0,0,0|1,0,0]=3
9  B6R0.1  CNCC(=O)OC AO-181/25113008 [1,1,0,0,0,0|1,0,0]=3
10  B8R0.16  CCC(CC(N)=O)OC AI-942/25121086 [0,2,0,0,0,0|1,1,0]=4
11  B8R0.6  COCCNC(=O)CN AS-787/43399852 [0,2,0,0,0,0|0,1,0]=3
12  B8R1.3  O=C1CCS(=O)CC1 AN-308/25123005 [0,1,0,1,0,0|0,0,1]=3
13  B8R1.50  CC1C(=O)CCC1=O AC-907/25014141 [0,1,0,1,0,0|2,0,0]=4