0 B5R0.1 CC#CN(C)C AB76935 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 CC(C)N=C=O AB00193 [0,0,0,0,0,0|0,1,0]=1 2 B4R0.1 C\C(=N\O)\N AB06530 [1,0,0,0,0,0|1,1,1]=4 3 B6R0.2 B(CC(C)C)(O)O AB03722 [0,1,0,0,0,0|2,1,0]=4 4 B6R0.2 CC(C)CC(=N)N AB60903 [0,1,0,0,0,0|2,0,1]=4 5 B6R0.2 CC(C)CC(=S)N AB52630 [0,1,0,0,0,0|1,0,1]=3 6 B6R0.2 CC(C)O[N+](=O)[O-] AB00827 [0,1,0,0,0,0|2,1,0]=4 7 B6R0.3 CC(C)C(=N)NN AB56371 [0,1,0,0,0,0|3,0,0]=4 8 B6R0.3 CC(C)C(=O)NN PB30560 [0,1,0,0,0,0|3,0,0]=4 9 B6R0.3 CC(C)C(C#N)O AB07208 [0,1,0,0,0,0|2,0,1]=4 10 B6R0.5 CC(C)(C)CCI AB29727 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.5 CC(C)(C)N=C=O AB00190 [0,1,0,0,0,0|0,1,0]=2 12 B6R1.2 CC1=NC=CC1 AB12705 [0,0,0,1,0,0|1,0,2]=4 13 B6R1.2 CC1=NN=NC1 AB70603 [0,0,0,1,0,0|2,0,1]=4 14 B6R1.2 CC1CCCN1 AB44503 [0,0,0,1,0,0|1,0,2]=4 15 B6R1.2 CC1CCNC1 AB41901 [0,0,0,1,0,0|2,0,1]=4 16 B6R1.2 C[C@@H]1CCCN1 AB29488 [0,0,0,1,0,0|1,0,2]=4 17 B6R1.2 C[C@@H]1CCCN1 AB42774 [0,0,0,1,0,0|1,0,2]=4 18 B6R1.2 C[C@@H]1CCNC1 AB29518 [0,0,0,1,0,0|2,0,1]=4 19 B6R1.2 C[C@H]1CCCN1 AB29489 [0,0,0,1,0,0|1,0,2]=4 20 B6R1.2 C[C@H]1CCNC1 AB29522 [0,0,0,1,0,0|2,0,1]=4 21 B6R1.3 C1CC1CC#N PB18433 [0,0,0,1,0,0|2,0,1]=4 22 B6R1.3 C1CC1CC=O AB51242 [0,0,0,1,0,0|1,1,1]=4 23 B6R1.3 C1CC1CCN AB23437 [0,0,0,1,0,0|2,0,1]=4 24 B6R1.3 C1CC1CCN PB11093 [0,0,0,1,0,0|2,0,1]=4 25 B6R1.3 C1CC1CCO PB24555 [0,0,0,1,0,0|1,1,1]=4 26 B6R1.3 C1CC1CNN PB30981 [0,0,0,1,0,0|3,0,0]=4 27 B6R1.3 C1CC1CON AB21122 [0,0,0,1,0,0|3,0,0]=4 28 B6R1.3 C1CC1N=C=O AB10805 [0,0,0,1,0,0|0,1,0]=2 29 B6R1.3 C1CC1\C=C\Br AB76480 [0,0,0,1,0,0|2,0,1]=4 30 B6R1.10 CC1(CNC1)C PB36182 [0,0,0,1,0,0|3,0,0]=4 31 B6R1.10 CC1(COC1)C MB00151 [0,0,0,1,0,0|3,0,0]=4 32 B3R0.2 C[S+](C)C AB01061 [2,0,0,0,0,0|1,0,1]=4 33 B5R0.3 C[C@@H](CO)NC AB31545 [1,1,0,0,0,0|0,0,2]=4 34 B5R0.4 CC(C)(C)[N+]#[C-] AB32563 [1,1,0,0,0,0|0,0,2]=4 35 B5R0.5 B(C(C)C)(O)O AB08847 [1,1,0,0,0,0|1,1,0]=4 36 B5R0.5 CC(C)C(=N)N AB07702 [1,1,0,0,0,0|1,0,1]=4 37 B5R0.5 CC(C)C(=S)N AB32169 [1,1,0,0,0,0|0,0,1]=3 38 B5R0.2 C(CBr)N=C=O AB04619 [1,1,0,0,0,0|0,1,0]=3 39 B5R0.2 C(CCl)N=C=O AB00198 [1,1,0,0,0,0|0,1,0]=3 40 B7R0.7 CCOC(=O)N=C=S AB00381 [0,2,0,0,0,0|1,0,1]=4 41 B7R0.11 CCC(C)(C)N=C=O AB71532 [0,2,0,0,0,0|0,1,0]=3 42 B7R0.4 CC(C)CCN=C=O AB54602 [0,2,0,0,0,0|0,1,0]=3 43 B7R0.4 CN(C)CCN=C=O AB74241 [0,2,0,0,0,0|1,1,0]=4 44 B7R0.8 CC(C)(C)CN=C=O AB55247 [0,2,0,0,0,0|0,1,0]=3 45 B5R1.2 CC1CNC1 PB16157 [1,0,0,1,0,0|1,0,1]=4 46 B5R1.3 CNC1CC1 PB16260 [1,0,0,1,0,0|0,0,2]=4 47 B7R1.4 CC1C(=NC=N1)C AB09621 [0,1,0,1,0,0|1,0,1]=4 48 B7R1.6 C1CC(C1)N=C=O AB55242 [0,1,0,1,0,0|0,1,0]=3 49 B7R1.7 C1CC1CN=C=O AB71485 [0,1,0,1,0,0|0,1,0]=3