0  B27R3.368466829  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O S3636 [0,0,0,0,0,0|0,0,0]=0
1  B26R3.23654886  C1C(=C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)Cl S1499 [1,0,0,0,0,0|1,0,0]=2
2  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O S1502 [1,0,0,0,0,0|0,0,0]=1
3  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O S1502 [1,0,0,0,0,0|0,0,0]=1
4  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O S5207 [1,0,0,0,0,0|0,0,0]=1
5  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CCC=CC3)N)SC1)C(=O)O S4671 [1,0,0,0,0,0|0,0,2]=3
6  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CCC=CC3)N)SC1)C(=O)O S4671 [1,0,0,0,0,0|0,0,2]=3
7  B26R3.23654886  CC1=C(N2C(C(C2=O)NC(=O)C(C3=CCC=CC3)N)SC1)C(=O)O S5296 [1,0,0,0,0,0|0,0,2]=3
8  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)O)C S3015 [0,1,0,0,1,0|0,0,2]=4
9  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)O)C S5298 [0,1,0,0,1,0|0,0,2]=4
10  B29R3.60360606  CC=CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O S2544 [0,2,0,0,0,0|0,0,0]=2
11  B29R3.60360606  CC=CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O S2544 [0,2,0,0,0,0|0,0,0]=2
12  B29R3.60360606  CC=CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O S2544 [0,2,0,0,0,0|0,0,0]=2