0  B6R1.2  S=C1NCCO1 HY-W038985 [0,0,0,0,0,0|2,1,1]=4
1  B6R1.2  [C@H]1(F)CCNC1 HY-W004695 [0,0,0,0,0,0|4,0,0]=4
2  B5R1.1  C1CSCN1 HY-I0144 [1,0,0,0,0,0|1,0,0]=2
3  B7R1.1  [C@H]1(CN)CCCO1 HY-W010601 [0,1,0,0,0,0|1,1,0]=3
4  B7R1.4  CC1OCCC1=O HY-W010608 [0,1,0,0,0,0|1,1,0]=3
5  B5R0.3  CCC(O)CC HY-W087988 [0,0,1,0,0,0|3,0,0]=4
6  B5R0.3  CC[C@H](C)CO HY-W093104 [0,0,1,0,0,0|3,0,0]=4
7  B5R1.2  C[C@H]1CCN1 HY-35279 [0,0,0,0,1,0|1,0,0]=2
8  B7R1.3  CC1=CCCCC1 HY-W004338 [0,0,0,0,0,1|2,0,1]=4
9  B4R0.1  C[C@H](N)CO HY-Y0837 [1,0,1,0,0,0|2,0,0]=4
10  B4R0.1  C[C@H](O)CO HY-79334 [1,0,1,0,0,0|1,1,0]=4
11  B4R0.2  CCCNC HY-W250110E [1,0,1,0,0,0|2,0,0]=4
12  B4R0.2  CCCNC HY-W250110I [1,0,1,0,0,0|2,0,0]=4
13  B6R0.2  CC(C)NC(C)C HY-B2210 [0,1,1,0,0,0|2,0,0]=4
14  B6R0.6  NCCOCCS HY-140651 [0,1,1,0,0,0|0,1,0]=3
15  B6R0.6  NCCOCCS HY-168937D [0,1,1,0,0,0|0,1,0]=3
16  B6R0.6  OCCOCCO HY-B1952R [0,1,1,0,0,0|0,2,0]=4
17  B6R1.6  OC[C@H]1CCN1 HY-W061628 [0,1,0,0,1,0|1,0,0]=3
18  B8R1.4  CC1CCN=C(N)S1 HY-101251 [0,1,0,0,0,1|1,0,1]=4
19  B8R1.50  CC1C(=O)CCC1=O HY-W012944 [0,2,0,0,0,0|2,0,0]=4
20  B8R2.34  C1=CC2CCC1C2 HY-W013021 [0,0,0,1,0,1|2,0,0]=4