0 B6R1.2 CC1=CN=CN1 DB03385 [0,0,0,0,0,0|2,0,0]=2 1 B6R1.2 CC1=CNC=C1 DB01932 [0,0,0,0,0,0|2,0,0]=2 2 B6R1.2 CN1C=C[NH+]=C1 DB02671 [0,0,0,0,0,0|3,0,0]=3 3 B6R1.2 IC1=CNN=C1 DB02721 [0,0,0,0,0,0|4,0,0]=4 4 B6R1.2 O=C1CCCO1 DB04699 [0,0,0,0,0,0|1,0,3]=4 5 B5R1.1 C1=CNC=N1 DB03366 [1,0,0,0,0,0|2,0,0]=3 6 B5R1.1 C1=CNN=C1 DB02757 [1,0,0,0,0,0|2,0,0]=3 7 B5R1.1 C1=C[N-]C=N1 DB03840 [1,0,0,0,0,0|2,0,0]=3 8 B5R1.1 C1=NC=NN1 DB03594 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.4 CC1=[NH+]C=CN1C DB03789 [0,1,0,0,0,0|2,0,0]=3 10 B5R0.1 C\C=C\C(=O)O DB02074 [0,0,1,0,0,0|1,0,1]=3 11 B7R1.3 CC1=CC=CN=C1 DB01996 [0,0,0,0,0,1|1,0,0]=2 12 B7R1.3 IC1=CC=CC=C1 DB02252 [0,0,0,0,0,1|2,0,0]=3 13 B7R1.3 NC1=CC=CC=C1 DB06728 [0,0,0,0,0,1|2,0,0]=3 14 B7R1.3 OC1=CC=CC=C1 DB03255 [0,0,0,0,0,1|2,0,0]=3 15 B7R1.3 SC1=CC=CC=N1 DB03329 [0,0,0,0,0,1|2,0,0]=3 16 B4R0.1 C=CC(=O)O DB02579 [1,0,1,0,0,0|1,0,0]=3 17 B4R0.1 CC(=O)C=O DB03587 [1,0,1,0,0,0|1,0,1]=4 18 B4R0.1 CC(=O)O[Hg+] DB02176 [1,0,1,0,0,0|2,0,0]=4 19 B4R0.1 C[C@H](O)C=O DB03776 [1,0,1,0,0,0|1,0,1]=4 20 B4R0.1 O=CC(=O)O DB04343 [1,0,1,0,0,0|2,0,0]=4 21 B4R0.2 C\C=C\C=O DB04381 [1,0,1,0,0,0|0,0,1]=3 22 B6R0.3 C=C[C@H](N)C(=O)O DB03214 [0,1,1,0,0,0|1,0,1]=4 23 B6R0.3 C\C=C(/N)C(=O)O DB03720 [0,1,1,0,0,0|1,0,1]=4 24 B8R1.2 NCC1=CC=CC=C1 DB02464 [0,1,0,0,0,1|1,0,0]=3 25 B8R1.2 OCC1=CC=CN=C1 DB04145 [0,1,0,0,0,1|1,0,0]=3 26 B8R1.2 SCC1=CC=CN=C1 DB04490 [0,1,0,0,0,1|1,0,0]=3 27 B8R1.3 CC1=CC=C(O)C=C1 DB01688 [0,1,0,0,0,1|1,0,0]=3 28 B8R1.3 NC1=CC=C(N)C=C1 DB14141 [0,1,0,0,0,1|2,0,0]=4 29 B8R1.3 NC1=CC=C(O)C=C1 DB14144 [0,1,0,0,0,1|2,0,0]=4 30 B8R1.3 OC1=CC=C(I)C=C1 DB03002 [0,1,0,0,0,1|2,0,0]=4 31 B8R1.4 CC1=CC=CC(O)=C1 DB01776 [0,1,0,0,0,1|1,0,0]=3 32 B8R1.4 C[C@H]1CC=CC(=O)O1 DB14121 [0,1,0,0,0,1|0,0,1]=3 33 B8R1.4 NC1=CN=CC(Cl)=N1 DB02297 [0,1,0,0,0,1|2,0,0]=4 34 B8R1.4 O=C1C=CNC(=O)N1 DB03419 [0,1,0,0,0,1|2,0,0]=4 35 B8R1.4 OC1=CC=CC(Cl)=C1 DB01957 [0,1,0,0,0,1|2,0,0]=4 36 B8R1.5 ClC1=C(Cl)C=CC=C1 DB13963 [0,1,0,0,0,1|2,0,0]=4 37 B8R1.5 NC1=CC=CC=C1F DB02403 [0,1,0,0,0,1|2,0,0]=4 38 B8R1.5 NC1=CC=CC=C1O DB01726 [0,1,0,0,0,1|2,0,0]=4 39 B8R1.5 OC1=CC=CC=C1Br DB04586 [0,1,0,0,0,1|2,0,0]=4 40 B8R1.5 OC1=CC=CC=C1Cl DB03110 [0,1,0,0,0,1|2,0,0]=4 41 B8R1.5 OC1=CC=CC=C1O DB02232 [0,1,0,0,0,1|2,0,0]=4 42 B8R1.7 O=C(O)C1=CC=CN1 DB02543 [0,2,0,0,0,0|1,0,1]=4