0 B7R0.1 C#CCCNCCO DA-28477 [0,0,0,0,0,0|1,1,2]=4 1 B7R0.1 CCCCCC#CI DA-29305 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.1 CCCOCCCN DA-43561 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.1 CCNCCOCC DA-26270 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.1 CCOCC#CCO DA-39467 [0,0,0,0,0,0|1,1,2]=4 5 B7R0.1 COCOCCC#N DA-25587 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.1 COCOCCC=O DA-25586 [0,0,0,0,0,0|2,1,1]=4 7 B6R0.6 C(COCCI)O DA-28616 [1,0,0,0,0,0|2,1,0]=4 8 B6R0.6 CCCOCC=O DA-25689 [1,0,0,0,0,0|1,1,1]=4 9 B6R0.6 CCC[Sn+2]CCC DA-34908 [1,0,0,0,0,0|1,0,0]=2 10 B6R0.6 CCNCCOC DA-42706 [1,0,0,0,0,0|2,0,0]=3 11 B6R0.6 CCOCCNC DA-26269 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.4 C(CCC#CI)CCO DA-35631 [0,1,0,0,0,0|0,1,2]=4 13 B8R0.4 C(CCCI)CCCI DA-30138 [0,1,0,0,0,0|1,0,0]=2 14 B8R0.4 CNCCCCCC=C DA-47831 [0,1,0,0,0,0|1,0,1]=3 15 B8R0.6 CCCCCC(=O)CBr DA-29678 [0,1,0,0,0,0|1,0,1]=3 16 B8R0.6 COC(=O)CCCCN DA-32363 [0,1,0,0,0,0|2,0,1]=4 17 B8R0.6 COC(=O)CCCCO DA-32302 [0,1,0,0,0,0|1,1,1]=4 18 B8R0.7 CC(C)CCCCCBr DA-29605 [0,1,0,0,0,0|1,0,0]=2 19 B8R0.7 CC(C)CCCCCO DA-36043 [0,1,0,0,0,0|0,1,0]=2 20 B8R0.7 CC(C)NCCCNC DA-43930 [0,1,0,0,0,0|3,0,0]=4 21 B8R1.2 C1CC(CSC1)C=O DA-41962 [0,0,0,1,0,0|1,1,1]=4 22 B8R1.2 C1CSCCC1CN DA-31834 [0,0,0,1,0,0|2,0,0]=3 23 B8R1.5 CC1=CCCCC1Br DA-42500 [0,0,0,1,0,0|1,0,2]=4 24 B8R1.5 CC1COCCC1=O DA-46235 [0,0,0,1,0,0|1,1,1]=4 25 B8R1.8 C1CCC(C1)CCCl DA-32115 [0,0,0,1,0,0|1,0,0]=2 26 B8R1.8 COCC1CCNC1 DA-24872 [0,0,0,1,0,0|3,0,0]=4 27 B8R1.10 C1CC(C1)NCCN DA-47821 [0,0,0,1,0,0|2,0,0]=3 28 B8R1.11 CCC1C(CCN1)N DA-26252 [0,0,0,1,0,0|2,0,0]=3 29 B8R1.13 CCCC1CCC1=O DA-25683 [0,0,0,1,0,0|0,1,1]=3 30 B8R1.22 CC1CCNCCO1 DA-35898 [0,0,0,1,0,0|1,1,0]=3 31 B8R1.36 C1CC1CNCCO DA-41973 [0,0,0,1,0,0|1,1,0]=3 32 B5R0.2 C(CCBr)CN DA-21372 [2,0,0,0,0,0|2,0,0]=4 33 B5R0.2 CNCCCBr DA-25561 [2,0,0,0,0,0|2,0,0]=4 34 B5R0.2 CNCCCBr DA-42177 [2,0,0,0,0,0|2,0,0]=4 35 B5R0.2 CNCCSC DA-39999 [2,0,0,0,0,0|2,0,0]=4 36 B7R0.4 CC(C)CCCCCl DA-29531 [1,1,0,0,0,0|1,0,0]=3 37 B7R0.4 CC(C)NCCOC DA-48104 [1,1,0,0,0,0|2,0,0]=4 38 B7R0.4 CCCNCC(C)C DA-42549 [1,1,0,0,0,0|1,0,0]=3 39 B7R0.4 CN(C)CCCCCl DA-39529 [1,1,0,0,0,0|2,0,0]=4 40 B7R0.7 CNCC(COC)O DA-29261 [1,1,0,0,0,0|2,0,0]=4 41 B9R0.5 CCCCCC(CCCl)O DA-29557 [0,2,0,0,0,0|1,0,0]=3 42 B9R0.5 CCOC(=O)CCCCN DA-33789 [0,2,0,0,0,0|1,0,1]=4 43 B9R0.45 CNCCCCCCC=C DA-41277 [0,2,0,0,0,0|1,0,0]=3 44 B9R0.46 COC(=O)CCCCCN DA-42938 [0,2,0,0,0,0|1,0,1]=4 45 B9R0.38 CC(C)(CCCCCBr)O DA-35788 [0,2,0,0,0,0|1,0,0]=3 46 B7R1.1 CNC1CCCC1 DA-41441 [1,0,0,1,0,0|1,0,0]=3 47 B7R1.1 COC1CCCC1 DA-34934 [1,0,0,1,0,0|1,0,0]=3 48 B7R1.3 CC1CCOCC1 DA-42393 [1,0,0,1,0,0|1,0,0]=3 49 B7R1.4 CC1CNCC1N DA-39111 [1,0,0,1,0,0|2,0,0]=4 50 B7R1.6 CNCC1COC1 DA-45244 [1,0,0,1,0,0|2,0,0]=4 51 B7R1.7 C1CC1CCC=O DA-34928 [1,0,0,1,0,0|0,1,1]=4 52 B7R1.7 C1CC1CCCO DA-34927 [1,0,0,1,0,0|0,1,0]=3 53 B7R1.7 CCNCC1CC1 DA-42986 [1,0,0,1,0,0|1,0,0]=3 54 B7R1.8 CC1COC1CI DA-27675 [1,0,0,1,0,0|2,0,0]=4 55 B9R1.2 C1CC(CC(=O)C1)CCl DA-24944 [0,1,0,1,0,0|1,0,1]=4 56 B9R1.2 C1CC(CC(C1)N)CO DA-24180 [0,1,0,1,0,0|0,1,0]=3 57 B9R1.2 CC1CC(CCN1)CN DA-46885 [0,1,0,1,0,0|2,0,0]=4 58 B9R1.2 CN1CCCC(C1)CI DA-24891 [0,1,0,1,0,0|2,0,0]=4 59 B9R1.2 COC1CCCC(C1)O DA-23430 [0,1,0,1,0,0|1,1,0]=4 60 B9R1.8 C1CC(COC1)CC=O DA-48094 [0,1,0,1,0,0|0,1,1]=4 61 B9R1.8 C1CC(COC1)CCBr DA-25391 [0,1,0,1,0,0|1,0,0]=3 62 B9R1.8 C1CC(COC1)CCO DA-48093 [0,1,0,1,0,0|0,1,0]=3 63 B9R1.8 C1CCC(=CC1)CCBr DA-31452 [0,1,0,1,0,0|1,0,1]=4 64 B9R1.8 C1CCN(CC1)CCI DA-31383 [0,1,0,1,0,0|1,0,0]=3 65 B9R1.8 C1CCOC(C1)CC=O DA-41105 [0,1,0,1,0,0|0,1,1]=4 66 B9R1.8 C1COCCC1CNN DA-31819 [0,1,0,1,0,0|2,0,0]=4 67 B9R1.8 C1CSCCC1CCO DA-25634 [0,1,0,1,0,0|0,1,0]=3 68 B9R1.9 C1C(CN1CCCN)O DA-31257 [0,1,0,1,0,0|2,0,0]=4 69 B9R1.12 C1CCN(C1)CCCBr DA-31223 [0,1,0,1,0,0|1,0,0]=3 70 B9R1.12 C1CNCC1OCCO DA-28381 [0,1,0,1,0,0|1,1,0]=4 71 B9R1.12 C1COCC1CCCBr DA-25276 [0,1,0,1,0,0|1,0,0]=3 72 B9R1.12 C1COCC1CCCO DA-48092 [0,1,0,1,0,0|0,1,0]=3 73 B9R1.12 CNCCC1CCCC1 DA-40697 [0,1,0,1,0,0|1,0,0]=3 74 B9R1.12 COCCC1CCCN1 DA-28602 [0,1,0,1,0,0|1,0,0]=3 75 B9R1.15 C1CCC(=O)C(C1)CO DA-28975 [0,1,0,1,0,0|0,1,1]=4 76 B9R1.15 C1CNCC(C1O)CO DA-24899 [0,1,0,1,0,0|1,1,0]=4 77 B9R1.15 CC1CCCCC1CO DA-25805 [0,1,0,1,0,0|0,1,0]=3 78 B9R1.15 CN1CCOCC1CO DA-39116 [0,1,0,1,0,0|1,1,0]=4 79 B9R1.49 C1CC(CCC(=O)C1)O DA-23103 [0,1,0,1,0,0|0,1,1]=4 80 B9R1.75 COCC(CC1CC1)N DA-29453 [0,1,0,1,0,0|2,0,0]=4 81 B9R1.100 CCCNC(C)C1CC1 DA-48362 [0,1,0,1,0,0|2,0,0]=4 82 B9R1.100 CNCCC(C1CC1)O DA-29455 [0,1,0,1,0,0|2,0,0]=4 83 B9R1.134 CC1(CCCC1)CC=O DA-29141 [0,1,0,1,0,0|0,1,1]=4 84 B9R1.134 CC1(CCCC1)CCO DA-28774 [0,1,0,1,0,0|0,1,0]=3 85 B9R1.17 COCCNC1CCC1 DA-47912 [0,1,0,1,0,0|1,1,0]=4 86 B9R1.89 C1CCCC(CC1)NN DA-34947 [0,1,0,1,0,0|1,0,0]=3 87 B9R1.1 COC1CCC(CC1)N DA-23098 [0,1,0,1,0,0|2,0,0]=4 88 B9R1.1 COC1CCC(CO1)O DA-42912 [0,1,0,1,0,0|1,1,0]=4 89 B9R1.11 C1CCC(C1)C(=O)CCl DA-26686 [0,1,0,1,0,0|1,0,1]=4 90 B9R1.11 CC(CN)N1CCCC1 DA-27589 [0,1,0,1,0,0|2,0,0]=4 91 B9R1.21 C1CC(NC1CO)CO DA-27173 [0,1,0,1,0,0|1,1,0]=4 92 B9R1.21 C1CC(OC1CO)CO DA-42665 [0,1,0,1,0,0|1,1,0]=4 93 B9R1.21 CCC1CCC(C1)CBr DA-44154 [0,1,0,1,0,0|1,0,0]=3 94 B9R1.21 CCC1CCC(C1)CO DA-42789 [0,1,0,1,0,0|0,1,0]=3 95 B9R1.99 CCCCCC1(CO1)C DA-25924 [0,1,0,1,0,0|0,1,0]=3 96 B9R1.118 C1CCC(CC1)(CO)F DA-31703 [0,1,0,1,0,0|0,1,0]=3 97 B9R1.118 C1CNCCC1(CO)F DA-39396 [0,1,0,1,0,0|1,1,0]=4 98 B9R1.118 C1COCCC1(CN)F DA-39387 [0,1,0,1,0,0|2,0,0]=4 99 B9R1.118 C1COCCC1(CO)F DA-40892 [0,1,0,1,0,0|1,1,0]=4 100 B9R1.118 CC1(CCCCC1)CO DA-29142 [0,1,0,1,0,0|0,1,0]=3 101 B9R1.118 CC1(CCCCN1)CO DA-25922 [0,1,0,1,0,0|1,1,0]=4 102 B9R1.118 CCC1(CCNCC1)O DA-39428 [0,1,0,1,0,0|2,0,0]=4 103 B9R1.13 C1CCC(C1)CC(=O)Cl DA-34937 [0,1,0,1,0,0|0,1,1]=4 104 B9R1.13 C1CCC(C1)CC(=O)O DA-34939 [0,1,0,1,0,0|0,1,1]=4 105 B9R1.13 CC(C)CC1N=CCS1 DA-27207 [0,1,0,1,0,0|1,0,1]=4 106 B9R1.40 CC1(CCCCC1Br)O DA-41535 [0,1,0,1,0,0|1,0,0]=3 107 B9R1.84 C1CC(C1)CCC(=O)O DA-34953 [0,1,0,1,0,0|0,1,1]=4 108 B9R2.47 C1C(CC2C1C2)CO DA-35032 [0,0,0,2,0,0|0,1,0]=3 109 B9R2.174 C1CC12CCNCC2 DA-36566 [0,0,0,2,0,0|2,0,0]=4 110 B9R2.174 C1CCNC2(C1)CC2 DA-21300 [0,0,0,2,0,0|1,0,0]=3 111 B9R2.2 C1CC(NC1)C2CC2 DA-26301 [0,0,0,2,0,0|1,0,0]=3 112 B9R2.2 C1COCC1C2CO2 DA-44970 [0,0,0,2,0,0|1,1,0]=4 113 B9R2.173 C1CC2(CNC2)OC1 DA-37049 [0,0,0,2,0,0|1,1,0]=4 114 B9R2.5 C1CC12CNCC2O DA-37975 [0,0,0,2,0,0|1,1,0]=4 115 B9R2.69 C1CC1CNC2CC2 DA-43253 [0,0,0,2,0,0|2,0,0]=4