0 B3R0.1 C=CC[CH2-] BBS-00027244 [0,0,0,0,0,0|1,0,1]=2 1 B3R0.1 CCNO BBS-00026502 [0,0,0,0,0,0|1,0,3]=4 2 B3R0.1 NCCBr BBS-00028408 [0,0,0,0,0,0|2,0,2]=4 3 B3R0.1 NCCN BBS-00032793 [0,0,0,0,0,0|2,0,2]=4 4 B3R0.1 NCCN BBS-00032909 [0,0,0,0,0,0|2,0,2]=4 5 B3R0.1 NCCS BBS-00020848 [0,0,0,0,0,0|1,1,2]=4 6 B3R0.1 N\C=N/O BBS-00031964 [0,0,0,0,0,0|2,0,1]=3 7 B3R0.1 OCCO BBS-00004320 [0,0,0,0,0,0|1,0,3]=4 8 B3R0.1 OCCS BBS-00024265 [0,0,0,0,0,0|1,0,3]=4 9 B2R0.1 N#CN BBS-00027438 [1,0,0,0,0,0|2,0,1]=4 10 B2R0.1 N#C[S-] BBS-00032389 [1,0,0,0,0,0|1,1,1]=4 11 B4R0.1 C=CC(C)=O BBS-00028059 [0,1,0,0,0,0|0,0,0]=1 12 B4R0.1 CC(=O)CCl BBS-00004082 [0,1,0,0,0,0|1,0,1]=3 13 B4R0.1 CCC(=N)N BBS-00024955 [0,1,0,0,0,0|1,0,2]=4 14 B4R0.1 CCC(N)=O BBS-00028396 [0,1,0,0,0,0|0,0,2]=3 15 B4R0.1 CNC(N)=O BBS-00036244 [0,1,0,0,0,0|1,0,1]=3 16 B4R0.1 COC(C)=O BBS-00032571 [0,1,0,0,0,0|1,0,1]=3 17 B4R0.1 C\C(N)=N\O BBS-00013452 [0,1,0,0,0,0|1,0,2]=4 18 B4R0.1 N=C(N)CO BBS-00025049 [0,1,0,0,0,0|1,0,2]=4 19 B4R0.1 NCC(=O)O BBS-00003777 [0,1,0,0,0,0|1,0,1]=3 20 B4R0.1 NNC(N)=S BBS-00004328 [0,1,0,0,0,0|2,1,0]=4 21 B4R0.1 O=C(Br)CBr BBS-00004286 [0,1,0,0,0,0|1,0,1]=3 22 B4R0.1 O=C(O)CO BBS-00004277 [0,1,0,0,0,0|1,0,1]=3 23 B4R0.1 O=CC(=O)O BBS-00020891 [0,1,0,0,0,0|1,0,0]=2 24 B4R0.2 C(=O)[N-]C=O BBS-00029757 [0,1,0,0,0,0|1,0,0]=2 25 B4R0.2 C=COC=C BBS-00029457 [0,1,0,0,0,0|1,0,0]=2 26 B3R0.2 CC(=N)N BBS-00004306 [1,1,0,0,0,0|1,0,1]=4 27 B3R0.2 CC(=N)N BBS-00028162 [1,1,0,0,0,0|1,0,1]=4 28 B3R0.2 CC(N)=O BBS-00020846 [1,1,0,0,0,0|0,0,1]=3 29 B3R0.2 CC(N)=S BBS-00004249 [1,1,0,0,0,0|0,1,1]=4 30 B3R0.2 NC(N)=O BBS-00004448 [1,1,0,0,0,0|1,0,0]=3 31 B3R0.2 NC(N)=S BBS-00004390 [1,1,0,0,0,0|1,1,0]=4 32 B5R0.1 CC(=O)\C=C/[O-] BBS-00032493 [0,2,0,0,0,0|0,0,0]=2 33 B5R0.1 CNCC(=O)O BBS-00022461 [0,2,0,0,0,0|0,0,2]=4 34 B5R0.1 CNCC(N)=O BBS-00031965 [0,2,0,0,0,0|0,0,2]=4 35 B5R0.1 C\C(N)=C/C#N BBS-00028082 [0,2,0,0,0,0|1,0,1]=4 36 B5R0.1 N#CCC(N)=O BBS-00016404 [0,2,0,0,0,0|0,0,2]=4 37 B5R0.1 NCCC(=O)O BBS-00028074 [0,2,0,0,0,0|0,0,2]=4 38 B5R0.1 NOCC(=O)O BBS-00039484 [0,2,0,0,0,0|1,0,1]=4 39 B5R0.1 O=C(O)CCS BBS-00038803 [0,2,0,0,0,0|0,0,2]=4 40 B5R0.3 C(=O)C(O)CO BBS-00029374 [0,2,0,0,0,0|0,0,2]=4 41 B5R0.3 C(C)=C(\C)CO BBS-00029567 [0,2,0,0,0,0|0,0,2]=4 42 B5R0.3 C=CC(=O)OC BBS-00004387 [0,2,0,0,0,0|0,0,0]=2 43 B5R0.3 CCC(=O)NN BBS-00028086 [0,2,0,0,0,0|0,0,2]=4 44 B5R0.3 CNC(=O)CBr BBS-00025180 [0,2,0,0,0,0|1,0,1]=4 45 B5R0.3 CNC(=O)NC BBS-00036243 [0,2,0,0,0,0|1,0,1]=4 46 B5R0.3 COC(=O)CN BBS-00028749 [0,2,0,0,0,0|1,0,1]=4 47 B5R0.3 NCC(=O)NO BBS-00022565 [0,2,0,0,0,0|1,0,1]=4 48 B5R0.3 O=C(CCl)CCl BBS-00020931 [0,2,0,0,0,0|1,0,1]=4 49 B5R0.5 CC(N)C(=O)O BBS-00003820 [0,2,0,0,0,0|0,0,2]=4 50 B5R0.5 CC(N)C(N)=O BBS-00028694 [0,2,0,0,0,0|0,0,2]=4 51 B5R0.5 CC(O)C(=O)[O-] BBS-00028838 [0,2,0,0,0,0|0,0,2]=4 52 B5R0.5 CC(O)C(=O)[O-] BBS-00038938 [0,2,0,0,0,0|0,0,2]=4 53 B5R0.5 CN(C)C(=O)Cl BBS-00004352 [0,2,0,0,0,0|1,0,1]=4 54 B5R0.5 C[C@H](N)C(=O)O BBS-00039166 [0,2,0,0,0,0|0,0,2]=4 55 B5R0.5 O=C([O-])C(Cl)Cl BBS-00028928 [0,2,0,0,0,0|1,0,1]=4 56 B5R0.2 C=CCN=C=O BBS-00026322 [0,2,0,0,0,0|0,0,1]=3 57 B5R0.2 C=CCN=C=S BBS-00024237 [0,2,0,0,0,0|0,1,1]=4 58 B5R1.1 C1=CNC=N1 BBS-00004265 [0,1,0,1,0,0|1,0,0]=3 59 B5R1.1 C1=NC=NN1 BBS-00004410 [0,1,0,1,0,0|2,0,0]=4 60 B5R1.1 N1C=NN=C1 BBS-00010696 [0,1,0,1,0,0|2,0,0]=4