0 B6R1.2 CC1=[C-]CC=C1 Y1619 [0,0,0,0,0,0|2,0,2]=4 1 B6R1.2 CC1C=COC1 8769AA [0,0,0,0,0,0|3,0,1]=4 2 B6R1.2 ClC1CCNC1 X3739 [0,0,0,0,0,0|4,0,0]=4 3 B6R1.2 N=C1SCCS1 S757 [0,0,0,0,0,0|1,0,1]=2 4 B6R1.2 NC1=NCCS1 D810 [0,0,0,0,0,0|2,0,1]=3 5 B6R1.2 NC1CCCC1 0142AP [0,0,0,0,0,0|3,0,0]=3 6 B6R1.2 NN1CCCC1 9623AB [0,0,0,0,0,0|4,0,0]=4 7 B6R1.2 OC1CCCO1 5572AJ [0,0,0,0,0,0|2,1,0]=3 8 B5R1.1 C1CCOC1 V2332 [1,0,0,0,0,0|1,1,0]=3 9 B5R1.1 C1CNNC1 4465AJ [1,0,0,0,0,0|3,0,0]=4 10 B5R1.1 C1CNOC1 4176AJ [1,0,0,0,0,0|2,1,0]=4 11 B7R1.1 CO[C@@H]1CCNC1 Z2120 [0,1,0,0,0,0|3,0,0]=4 12 B7R1.1 CO[C@H]1CCNC1 Z2151 [0,1,0,0,0,0|3,0,0]=4 13 B7R1.1 CSC1=NCCS1 X2628 [0,1,0,0,0,0|1,0,1]=3 14 B7R1.1 ClCC1CCCN1 1258AJ [0,1,0,0,0,0|2,0,0]=3 15 B7R1.1 Cl[Mg]C1CCCC1 Z3121 [0,1,0,0,0,0|3,0,0]=4 16 B7R1.1 N#CC1CCCN1 Y9476 [0,1,0,0,0,0|2,0,1]=4 17 B7R1.2 CC1C=CC(C)N1 Y9566 [0,1,0,0,0,0|2,0,1]=4 18 B7R1.2 CC1CCC(=O)C1 7470AF [0,1,0,0,0,0|2,0,1]=4 19 B7R1.2 CC1CCC(C)N1 Y8778 [0,1,0,0,0,0|2,0,0]=3 20 B7R1.2 C[C@@H]1CC[C@@H](C)N1 8295AH [0,1,0,0,0,0|2,0,0]=3 21 B7R1.2 C[C@@H]1CC[C@@H](C)N1 8559AH [0,1,0,0,0,0|2,0,0]=3 22 B7R1.2 C[C@H]1CC[C@H](C)N1 8586AH [0,1,0,0,0,0|2,0,0]=3 23 B7R1.2 N[C@@H]1CC[C@@H](O)C1 6258AC [0,1,0,0,0,0|3,0,0]=4 24 B7R1.4 CC1=C(S)CCO1 R544 [0,1,0,0,0,0|1,1,1]=4 25 B7R1.4 C[C@@H]1CCC[C@H]1O S086 [0,1,0,0,0,0|2,0,0]=3 26 B7R1.4 N[C@@H]1CCC[C@H]1N X3520 [0,1,0,0,0,0|3,0,0]=4 27 B7R1.4 N[C@@H]1CCC[C@H]1O 0541AC [0,1,0,0,0,0|3,0,0]=4 28 B7R1.14 CC1(C)CCNC1 2277AL [0,1,0,0,0,0|3,0,0]=4 29 B5R0.1 CC#C[C@H](C)O S982 [0,0,1,0,0,0|1,1,1]=4 30 B5R0.1 CC(Cl)CCBr 7250AF [0,0,1,0,0,0|3,0,0]=4 31 B5R0.1 CCCC(C)I 7327AF [0,0,1,0,0,0|2,0,0]=3 32 B5R0.1 CCO[PH](C)=O 8330AA [0,0,1,0,0,0|1,2,0]=4 33 B5R0.2 CCCSC#N I565 [0,0,1,0,0,0|2,0,1]=4 34 B5R0.2 FCCCCF 1855AE [0,0,1,0,0,0|3,0,0]=4 35 B5R0.2 NCCCCCl 5846AB [0,0,1,0,0,0|3,0,0]=4 36 B5R0.3 CC[C@H](C)C#N 1254AL [0,0,1,0,0,0|3,0,0]=4 37 B7R2.11 C1CC2CC1N2 3085AJ [0,0,0,1,0,0|2,0,0]=3 38 B5R1.2 CC1CCN1 2132AL [0,0,0,0,1,0|1,0,0]=2 39 B5R1.2 NC1CNC1 X8588 [0,0,0,0,1,0|3,0,0]=4 40 B7R1.3 CC1CC=CCC1 6594AL [0,0,0,0,0,1|2,0,1]=4 41 B7R1.3 C[C@@H]1CCCCN1 W3754 [0,0,0,0,0,1|2,0,0]=3 42 B7R1.3 C[C@@H]1CCCNC1 8114AA [0,0,0,0,0,1|2,0,0]=3 43 B7R1.3 NC1=NCCSC1 8863AE [0,0,0,0,0,1|2,0,1]=4 44 B7R1.3 NC1CCCCN1 6271AB [0,0,0,0,0,1|3,0,0]=4 45 B7R1.3 NC1CCSCC1 V4406 [0,0,0,0,0,1|3,0,0]=4 46 B7R1.3 N[C@@H]1CCCOC1 X8827 [0,0,0,0,0,1|2,1,0]=4 47 B7R1.3 N[C@H]1CCCOC1 X6276 [0,0,0,0,0,1|2,1,0]=4 48 B4R0.1 CC(C)NO C506 [1,0,1,0,0,0|2,0,0]=4 49 B4R0.1 CC(Cl)CCl Y6563 [1,0,1,0,0,0|2,0,0]=4 50 B4R0.1 CC(O)CN 8099AL [1,0,1,0,0,0|1,1,0]=4 51 B4R0.1 CC[C@H](C)N 4197AL [1,0,1,0,0,0|1,0,0]=3 52 B4R0.2 CCCC[NH3+] 7121AF [1,0,1,0,0,0|1,0,0]=3 53 B4R0.2 CCCC[O-] S459 [1,0,1,0,0,0|0,1,0]=3 54 B4R0.2 CCC[Mg]Cl 9030AJ [1,0,1,0,0,0|2,0,0]=4 55 B4R0.2 CCNCC Y1600 [1,0,1,0,0,0|1,0,0]=3 56 B4R0.2 CCSC#N 7036AF [1,0,1,0,0,0|1,0,1]=4 57 B4R0.2 FCCCF Y3147 [1,0,1,0,0,0|2,0,0]=4 58 B6R0.1 CCCC(Br)CBr R241 [0,1,1,0,0,0|2,0,0]=4 59 B6R0.1 CCCC(N)CC 7574AF [0,1,1,0,0,0|2,0,0]=4 60 B6R0.1 CCC[C@@H](C)CO N835 [0,1,1,0,0,0|1,1,0]=4 61 B6R0.1 CCOC(Br)CBr V0731 [0,1,1,0,0,0|1,1,0]=4 62 B6R0.2 CC(C)C[C@@H](C)O 7431AJ [0,1,1,0,0,0|1,1,0]=4 63 B6R0.4 CCC#CC(C)O I840 [0,1,1,0,0,0|1,1,0]=4 64 B6R0.4 CNCCC(C)C 5617AB [0,1,1,0,0,0|2,0,0]=4 65 B6R0.4 CNCC[C@H](C)N 9254AH [0,1,1,0,0,0|2,0,0]=4 66 B6R0.5 CCCC(C)(C)N 5068AE [0,1,1,0,0,0|2,0,0]=4 67 B6R0.6 CCCCCCF 7535AF [0,1,1,0,0,0|2,0,0]=4 68 B6R0.6 CCNCCC#N 7314AD [0,1,1,0,0,0|2,0,0]=4 69 B6R0.6 OCCOCCS 5680AL [0,1,1,0,0,0|0,1,0]=3 70 B6R1.4 O=C1CCC1Br 0705AD [0,1,0,0,1,0|2,0,0]=4 71 B6R1.4 O=C1CCC1Cl 7041AD [0,1,0,0,1,0|2,0,0]=4 72 B6R1.5 CN1CC(N)C1 6717AC [0,1,0,0,1,0|2,0,0]=4 73 B6R1.6 CNC1COC1 4219AF [0,1,0,0,1,0|2,0,0]=4 74 B6R1.6 [C-]#[N+]C1CCC1 2868AF [0,1,0,0,1,0|1,0,1]=4 75 B6R1.10 CC1(C)CCN1 Y6998 [0,1,0,0,1,0|1,0,0]=3 76 B6R1.10 C[Si]1(Cl)CCC1 1590AB [0,1,0,0,1,0|1,1,0]=4 77 B8R1.2 CC[C@H]1CCCCN1 1287AL [0,1,0,0,0,1|2,0,0]=4 78 B8R1.2 COC1CCCCO1 7544AE [0,1,0,0,0,1|1,1,0]=4 79 B8R1.2 CSC1=NCCSC1 0939AE [0,1,0,0,0,1|1,0,1]=4 80 B8R1.2 ClCC1CCCCC1 2451AB [0,1,0,0,0,1|2,0,0]=4 81 B8R1.2 ClCC1CCCCN1 2061AL [0,1,0,0,0,1|2,0,0]=4 82 B8R1.2 ClCC1CCNCC1 8572AB [0,1,0,0,0,1|2,0,0]=4 83 B8R1.2 ICC1CCCCN1 Z2411 [0,1,0,0,0,1|2,0,0]=4 84 B8R1.2 NCC1CNCCN1 9394AJ [0,1,0,0,0,1|2,0,0]=4 85 B8R1.2 OC[C@H]1CNCCN1 W3267 [0,1,0,0,0,1|2,0,0]=4 86 B8R1.3 CC1CCN(N)CC1 4385AJ [0,1,0,0,0,1|2,0,0]=4 87 B8R1.3 C[C@@H]1CC[C@@H](C)NC1 3626AB [0,1,0,0,0,1|2,0,0]=4 88 B8R1.4 C[C@@H]1CN(C)CCN1 8937AH [0,1,0,0,0,1|2,0,0]=4 89 B8R1.4 C[C@@H]1CNC[C@H](C)C1 3935AJ [0,1,0,0,0,1|2,0,0]=4 90 B8R1.5 CC1CCNCC1=O 2896AJ [0,1,0,0,0,1|2,0,0]=4 91 B8R1.5 CC1CNCCN1C 9603AH [0,1,0,0,0,1|2,0,0]=4 92 B8R1.5 C[C@@H]1CCCC[C@H]1N M973 [0,1,0,0,0,1|2,0,0]=4 93 B8R1.5 C[C@@H]1COCC[C@@H]1N 0693AC [0,1,0,0,0,1|1,1,0]=4 94 B8R1.5 C[C@H]1CCCC[C@H]1N 3932AJ [0,1,0,0,0,1|2,0,0]=4 95 B8R1.72 CC1(C)CCCCN1 1327AJ [0,1,0,0,0,1|2,0,0]=4 96 B8R1.72 CC1(N)CCCOC1 2359AJ [0,1,0,0,0,1|1,1,0]=4 97 B8R1.1 CCC1OCC(C)O1 3360AE [0,2,0,0,0,0|0,2,0]=4 98 B8R1.7 CC(=O)C1CCCN1 1442AJ [0,2,0,0,0,0|2,0,0]=4 99 B8R1.7 C[C@@H](N)C1CCCC1 8945AH [0,2,0,0,0,0|2,0,0]=4 100 B8R1.8 CCCC1CCCC1 7958AF [0,2,0,0,0,0|2,0,0]=4 101 B8R1.8 NOCC1CCCC1 3261AC [0,2,0,0,0,0|2,0,0]=4 102 B8R1.52 CC1(C=O)OCCO1 5076AB [0,2,0,0,0,0|0,2,0]=4 103 B6R1.3 CCCC1CN1 Y8874 [0,0,1,1,0,0|2,0,0]=4 104 B6R1.11 CC(N)C1CC1 8215AA [0,0,1,1,0,0|2,0,0]=4 105 B6R1.1 C1CCNCC1 X3730 [0,0,1,1,0,0|2,0,0]=4 106 B6R1.1 C1CNCCN1 7642AH [0,0,1,1,0,0|2,0,0]=4 107 B6R1.1 C1CNCCN1 W0060 [0,0,1,1,0,0|2,0,0]=4 108 B8R2.23 C1NCC2CC1S2 Y3051 [0,0,0,1,0,1|1,0,0]=3 109 B8R2.34 [C@H]12CN[C@H](CN1)C2 8423AH [0,0,0,1,0,1|2,0,0]=4 110 B8R2.34 [C@H]12CO[C@H](CN1)C2 Y7693 [0,0,0,1,0,1|1,1,0]=4