0 B7R0.6 CC(=O)C=CC(C)=O SY233697 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.6 CC(=O)CCC(N)=O SY273013 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.6 CC(=O)NCC(=O)O SY013515 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.6 CC(=O)NNC(N)=S SY109331 [0,0,0,0,0,0|1,1,2]=4 4 B7R0.6 N=C(N)NCC(=O)O SY015122 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 NC(=O)CCC(N)=O SY057038 [0,0,0,0,0,0|2,0,0]=2 6 B6R0.4 NCCCC(N)=O SY174709 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.4 O=CNCC(=O)O SY052094 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.9 NCC(=O)CCC(=O)O SY017972 [0,1,0,0,0,0|3,0,0]=4 9 B8R0.9 NCC(=O)NCC(=O)O SY018005 [0,1,0,0,0,0|2,0,1]=4 10 B8R0.9 NCC(=O)NCC(N)=O SY250873 [0,1,0,0,0,0|1,0,1]=3 11 B8R0.9 NNC(=O)NCC(=O)O SY249404 [0,1,0,0,0,0|2,0,1]=4 12 B8R0.23 NC(=O)C[C@@H](N)C(=O)O SY004421 [0,1,0,0,0,0|3,0,0]=4 13 B8R0.23 NC(=O)C[C@@H](N)C(=O)O SY008178 [0,1,0,0,0,0|3,0,0]=4 14 B8R0.23 NC(=O)C[C@H](N)C(=O)O SY014875 [0,1,0,0,0,0|3,0,0]=4 15 B8R1.3 CC1=CNC(=O)C=N1 SY027652 [0,0,0,1,0,0|3,0,0]=4 16 B8R1.3 CC1=NN=C(N)C=C1 SY003794 [0,0,0,1,0,0|3,0,0]=4 17 B8R1.3 NC1=CC=C(Br)N=N1 SY008154 [0,0,0,1,0,0|3,0,0]=4 18 B8R1.3 NC1=CN=C(N)C=N1 SY020175 [0,0,0,1,0,0|3,0,0]=4 19 B8R1.3 NC1=NC=C(Br)N=N1 SY024208 [0,0,0,1,0,0|3,0,0]=4 20 B8R1.3 NC1=NN=C(Cl)C=C1 SY002931 [0,0,0,1,0,0|3,0,0]=4 21 B8R1.3 NC1=NN=C(Cl)N=N1 SY268410 [0,0,0,1,0,0|2,0,1]=4 22 B8R1.3 NC1=NN=C(F)C=C1 SY070052 [0,0,0,1,0,0|3,0,0]=4 23 B8R1.3 NC1=NN=C(I)C=C1 SY035873 [0,0,0,1,0,0|3,0,0]=4 24 B8R1.3 NC1=NN=C(O)C=C1 SY033382 [0,0,0,1,0,0|2,0,1]=4 25 B8R1.3 O=C1C=NC(Cl)=CN1 SY030969 [0,0,0,1,0,0|3,0,0]=4 26 B6R0.2 N=C(N)CC(N)=O SY109396 [0,0,0,0,1,0|2,0,0]=3 27 B6R0.2 N=C(N)NC(=N)N SY225981 [0,0,0,0,1,0|2,0,1]=4 28 B6R0.2 NC(=O)CC(N)=O SY018470 [0,0,0,0,1,0|1,0,0]=2 29 B6R0.2 O=C(O)CC(=O)O SY001875 [0,0,0,0,1,0|3,0,0]=4 30 B5R0.1 C=CNC(N)=O SY159600 [2,0,0,0,0,0|1,0,1]=4 31 B5R0.1 NCCC(N)=O SY024863 [2,0,0,0,0,0|1,0,1]=4 32 B5R0.1 NCCC(N)=O SY101590 [2,0,0,0,0,0|1,0,1]=4 33 B5R0.2 O=CNNC=O SY012914 [2,0,0,0,0,0|0,0,2]=4 34 B7R0.16 NC(=O)C(N)C(N)=O SY016230 [0,1,0,0,1,0|1,0,0]=3 35 B7R1.2 CC1=NN=C(N)O1 SY008409 [1,0,0,1,0,0|1,0,1]=4 36 B7R1.2 CC1=NN=C(N)S1 SY004265 [1,0,0,1,0,0|1,1,0]=4 37 B7R1.2 NC1=CC(N)=NN1 SY022707 [1,0,0,1,0,0|1,0,1]=4 38 B7R1.2 NC1=NN=C(Br)S1 SY031824 [1,0,0,1,0,0|1,1,0]=4 39 B7R1.2 NC1=NN=C(S)S1 SY015050 [1,0,0,1,0,0|0,2,0]=4 40 B7R1.2 NC1=NNC(N)=N1 SY049252 [1,0,0,1,0,0|1,0,1]=4 41 B7R1.2 O=C1CSC(=O)N1 SY001546 [1,0,0,1,0,0|2,0,0]=4 42 B7R1.3 NC1=NC=CN=N1 SY011250 [1,0,0,1,0,0|2,0,0]=4 43 B7R1.3 NC1=NN=CC=C1 SY017896 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.35 NC(=O)C1=NNC(N)=C1 SY018555 [0,0,0,1,0,1|1,0,1]=4 45 B9R1.69 CC1=CC(=O)NNC1=O SY020308 [0,1,0,1,0,0|2,0,0]=4 46 B9R1.69 NC1=CNC(=O)NC1=O SY035728 [0,1,0,1,0,0|1,0,1]=4 47 B9R1.69 O=C1NN=C(Br)C(=O)N1 SY013841 [0,1,0,1,0,0|1,0,1]=4 48 B5R0.5 C=C(C)C(N)=O SY010261 [0,0,0,0,2,0|2,0,0]=4 49 B5R0.5 CC(N)C(N)=O SY012823 [0,0,0,0,2,0|1,0,1]=4 50 B5R0.5 CC(N)C(N)=O SY027188 [0,0,0,0,2,0|1,0,1]=4 51 B5R0.5 C[C@@H](N)C(N)=O SY030965 [0,0,0,0,2,0|1,0,1]=4 52 B5R0.5 C[C@@H](N)C(N)=O SY111070 [0,0,0,0,2,0|1,0,1]=4 53 B5R0.5 C[C@H](N)C(N)=O SY031439 [0,0,0,0,2,0|1,0,1]=4 54 B5R0.5 NC(=S)C(N)=S SY049427 [0,0,0,0,2,0|0,2,0]=4