0  B27R3.24311386  CCC1=CC=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)N=C1 LX3105 [0,0,0,0,0,0|0,0,0]=0
1  B27R3.24311386  CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 RT15573 [0,0,0,0,0,0|0,0,0]=0
2  B27R3.24311386  CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 XJ6796 [0,0,0,0,0,0|0,0,0]=0
3  B28R3.27435524  CC(=O)C1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 RT16806 [0,1,0,0,0,0|0,0,1]=2
4  B28R3.27435524  CC(O)C1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 RT17266 [0,1,0,0,0,0|0,0,0]=1
5  B28R3.33847183  CCC1=CN=C(C(O)COC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 RT16751 [0,1,0,0,0,0|0,0,0]=1
6  B28R3.241451792  O=C1NC(=O)C(CC2=CC=C(OCCC3=NC=C(CCO)C=C3)C=C2)S1 RT17277 [0,1,0,0,0,0|0,0,0]=1
7  B26R2.5756036  CCOC(=O)C(S)CC1=CC=C(OCCC2=NC=C(CC)C=C2)C=C1 RT12087 [0,0,1,0,0,0|2,0,1]=4
8  B29R3.38061734  O=C(O)CC1=CC=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)N=C1 RT9215 [0,2,0,0,0,0|0,0,1]=3