0  B9R1.69  CC1=CC=C(N)C(S)=C1 203553 [2,0,0,0,0,0|1,1,0]=4
1  B9R1.69  CC1=CC=C(S)C(N)=C1 203537 [2,0,0,0,0,0|2,0,0]=4
2  B9R1.69  CC1=CC=C(S)C([NH3+])=C1 203538 [2,0,0,0,0,0|2,0,0]=4
3  B9R1.69  CC1=CC=C([NH3+])C(S)=C1 203554 [2,0,0,0,0,0|1,1,0]=4
4  B11R1.87  CC(C)(C)C1=CC=CC=C1N RT-TM-005 [1,1,0,0,0,0|1,0,0]=3