0 B4R0.1 C#CC(N)=O P39827 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C=C(Br)CO B39863 [0,0,0,0,0,0|2,1,1]=4 2 B4R0.1 C=C(I)CO I9998 [0,0,0,0,0,0|2,1,1]=4 3 B4R0.1 CC(=N)NN A38897 [0,0,0,0,0,0|4,0,0]=4 4 B4R0.1 CC(=O)CN A38843 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 CC(=O)CO H60801 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 CC(=O)NN A64932 [0,0,0,0,0,0|4,0,0]=4 7 B4R0.1 CC(C)=CBr B2881 [0,0,0,0,0,0|2,1,0]=3 8 B4R0.1 CC(N)=NO H37897 [0,0,0,0,0,0|4,0,0]=4 9 B4R0.1 CCC(=N)N P39882 [0,0,0,0,0,0|3,0,1]=4 10 B4R0.1 CCC(=N)N P39927 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 CCC(N)=O P68920 [0,0,0,0,0,0|3,0,1]=4 12 B4R0.1 CNC(=N)N M38407 [0,0,0,0,0,0|4,0,0]=4 13 B4R0.1 COC(=N)N M69240 [0,0,0,0,0,0|4,0,0]=4 14 B4R0.1 CSC(=N)N M60715 [0,0,0,0,0,0|4,0,0]=4 15 B4R0.1 C[C@@H](Cl)CO C39879 [0,0,0,0,0,0|2,0,2]=4 16 B4R0.1 C[C@@H](O)CCl C67728 [0,0,0,0,0,0|2,0,2]=4 17 B4R0.1 C[C@H](Cl)CO C39880 [0,0,0,0,0,0|2,0,2]=4 18 B4R0.1 N=C(N)CCl C39776 [0,0,0,0,0,0|2,0,1]=3 19 B4R0.1 N=C(N)CO H39795 [0,0,0,0,0,0|3,0,1]=4 20 B4R0.1 NC(=O)CBr B39771 [0,0,0,0,0,0|2,1,1]=4 21 B4R0.1 NC(=O)CI K60849 [0,0,0,0,0,0|2,1,1]=4 22 B4R0.1 NC(=O)CO H68919 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 NC(=S)CF F6787 [0,0,0,0,0,0|2,1,1]=4 24 B4R0.1 NCC(N)=O G69255 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 NNC(N)=O S69135 [0,0,0,0,0,0|4,0,0]=4 26 B4R0.1 NNC(N)=S T60590 [0,0,0,0,0,0|4,0,0]=4 27 B4R0.1 ON=C(Br)Br D2176 [0,0,0,0,0,0|2,2,0]=4 28 B3R0.1 C#C[Zn]Cl E7775 [1,0,0,0,0,0|2,0,1]=4 29 B3R0.1 NCCCl C68611 [1,0,0,0,0,0|1,0,2]=4 30 B3R0.2 C=C(C)[Mg+] K5651 [1,0,0,0,0,0|2,0,0]=3 31 B3R0.2 CC(=O)O F69263 [1,0,0,0,0,0|2,0,1]=4 32 B3R0.2 CC(=O)[O-] C69398 [1,0,0,0,0,0|2,0,1]=4 33 B3R0.2 CC(=O)[O-] M67642 [1,0,0,0,0,0|2,0,1]=4 34 B3R0.2 CC(=O)[O-] N62590 [1,0,0,0,0,0|2,0,1]=4 35 B3R0.2 CC(=O)[O-] P67455 [1,0,0,0,0,0|2,0,1]=4 36 B3R0.2 CC(=O)[O-] R62611 [1,0,0,0,0,0|2,0,1]=4 37 B3R0.2 CC(=O)[O-] S62515 [1,0,0,0,0,0|2,0,1]=4 38 B3R0.2 Cl[Au](Cl)Cl G62417 [1,0,0,0,0,0|1,0,0]=2 39 B3R0.2 Cl[Rh](Cl)Cl R69173 [1,0,0,0,0,0|1,0,0]=2 40 B3R0.2 Cl[Ru](Cl)Cl R67677 [1,0,0,0,0,0|1,0,0]=2 41 B3R0.2 Cl[Ru](Cl)Cl R69358 [1,0,0,0,0,0|1,0,0]=2 42 B3R0.2 N=C(N)Cl C39757 [1,0,0,0,0,0|2,0,0]=3 43 B3R0.2 NC(=S)S A39756 [1,0,0,0,0,0|3,0,0]=4 44 B3R0.2 O=C([O-])[O-] S60755 [1,0,0,0,0,0|3,0,0]=4 45 B5R0.1 CC(=O)CCCl C69539 [0,1,0,0,0,0|2,0,1]=4 46 B5R0.1 C\C(N)=C\C#N A60547 [0,1,0,0,0,0|3,0,0]=4 47 B5R0.1 O=C(O)\C=C\Br B9431 [0,1,0,0,0,0|2,1,0]=4 48 B5R0.3 C=C(CCl)CCl C10867 [0,1,0,0,0,0|1,0,1]=3 49 B5R0.3 C=CC(=O)NC M37664 [0,1,0,0,0,0|3,0,0]=4 50 B5R0.3 CNC(=O)CCl C67921 [0,1,0,0,0,0|2,0,1]=4 51 B5R0.3 O=C(CCl)CCl D4849 [0,1,0,0,0,0|1,0,1]=3 52 B5R0.4 OCC(Cl)(Cl)Cl T60737 [0,1,0,0,0,0|1,0,2]=4 53 B5R0.5 C=C(F)C(=O)O F39831 [0,1,0,0,0,0|2,1,0]=4 54 B5R0.5 CC(=O)C(=O)[O-] C43424 [0,1,0,0,0,0|3,0,0]=4 55 B5R0.5 CN(C)C(=S)Cl D8332 [0,1,0,0,0,0|3,0,0]=4 56 B5R0.5 C[C@@H](Cl)C(=O)O C60901 [0,1,0,0,0,0|2,0,1]=4 57 B5R0.5 O=C(O)C(=O)O A69569 [0,1,0,0,0,0|3,0,0]=4 58 B5R0.5 O=C(O)C(=O)O E39942 [0,1,0,0,0,0|3,0,0]=4 59 B2R0.1 Cl[Pt]Cl P61330 [2,0,0,0,0,0|1,0,0]=3 60 B2R0.1 N=CN F67909 [2,0,0,0,0,0|2,0,0]=4 61 B6R1.2 ClC1=CC=NN1 C10789 [0,1,0,1,0,0|2,0,0]=4 62 B6R1.2 ClC1=CC=NN1 C39819 [0,1,0,1,0,0|2,0,0]=4 63 B6R1.2 ClC1=CN=CN1 C38031 [0,1,0,1,0,0|2,0,0]=4 64 B6R1.2 ClC1=CNN=C1 C39818 [0,1,0,1,0,0|2,0,0]=4 65 B6R1.2 ClC1=CSC=C1 C40018 [0,1,0,1,0,0|2,0,0]=4 66 B6R1.2 ClC1=CSC=N1 C9773 [0,1,0,1,0,0|2,0,0]=4 67 B6R1.2 ClC1=NC=CN1 C38255 [0,1,0,1,0,0|2,0,0]=4 68 B6R1.2 ClC1=NC=CS1 C2694 [0,1,0,1,0,0|2,0,0]=4 69 B6R1.2 ClC1=NC=NS1 C39789 [0,1,0,1,0,0|2,0,0]=4 70 B6R1.2 ClC1=NNC=N1 C38764 [0,1,0,1,0,0|2,0,0]=4