0  B6R0.1  C\C(=N/C#N)\OC LS41000 [0,0,0,0,0,0|2,0,2]=4
1  B5R0.3  CCC(CO)N LS40333 [1,0,0,0,0,0|1,1,1]=4
2  B5R0.3  CC[C@@H](CO)O LS30248 [1,0,0,0,0,0|1,1,1]=4
3  B5R0.3  CC[C@H](CO)O LS30249 [1,0,0,0,0,0|1,1,1]=4
4  B7R0.2  CCC(C)CC(C)N LS41471 [0,1,0,0,0,0|2,0,1]=4
5  B7R1.3  CC1CCCCN1 LS21158 [0,0,0,1,0,0|1,0,2]=4
6  B4R0.1  CC(=NO)C LS00155 [2,0,0,0,0,0|0,1,1]=4
7  B4R0.1  CC(CCl)Cl LS40550 [2,0,0,0,0,0|2,0,0]=4
8  B4R0.1  CC[C@@H](C)O LS30261 [2,0,0,0,0,0|0,1,0]=3
9  B4R0.1  CC[C@H](C)O LS30260 [2,0,0,0,0,0|0,1,0]=3
10  B4R0.1  C[C@@H](CCl)O LS30025 [2,0,0,0,0,0|1,1,0]=4
11  B4R0.1  C[C@@H](CO)Cl LS30257 [2,0,0,0,0,0|2,0,0]=4
12  B4R0.1  C[C@@H](CO)N LS30252 [2,0,0,0,0,0|1,0,1]=4
13  B4R0.1  C[C@@H](CO)O LS30238 [2,0,0,0,0,0|1,1,0]=4
14  B4R0.1  C[C@H](CCl)O LS30026 [2,0,0,0,0,0|1,1,0]=4
15  B4R0.1  C[C@H](CO)Cl LS30085 [2,0,0,0,0,0|2,0,0]=4
16  B4R0.1  C[C@H](CO)N LS30253 [2,0,0,0,0,0|1,0,1]=4
17  B4R0.1  C[C@H](CO)O LS30239 [2,0,0,0,0,0|1,1,0]=4