0  B25R3.529931862  CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C S5736 [0,0,0,0,0,0|0,0,0]=0
1  B25R3.529931862  CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C S4160 [0,0,0,0,0,0|0,0,1]=1
2  B25R3.529931862  CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C S5206 [0,0,0,0,0,0|0,0,1]=1
3  B25R3.529931862  CC1(C)SC2C(NC(=O)CC3=CC=CC=C3)C(=O)N2C1C(O)=O S5515 [0,0,0,0,0,0|0,0,0]=0
4  B26R3.529849969  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C S4148 [0,1,0,0,0,0|0,0,0]=1
5  B26R3.529849969  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)[O-])C S3170 [0,1,0,0,0,0|0,0,1]=2
6  B26R3.529849969  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)[O-])C S3170 [0,1,0,0,0,0|0,0,1]=2
7  B26R3.529849978  CC1(C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)[O-])C S3650 [0,0,0,0,0,1|0,0,1]=2
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 [0,2,0,0,0,0|0,0,0]=2
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 [0,2,0,0,0,0|0,0,0]=2
10  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)[O-])C S2565 [0,2,0,0,0,0|0,0,1]=3
11  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)[O-])C S2565 [0,2,0,0,0,0|0,0,1]=3
12  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)[O-])C S2565 [0,2,0,0,0,0|0,0,1]=3
13  B27R3.368466399  CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)[O-])C S2565 [0,2,0,0,0,0|0,0,1]=3