0 B6R0.6 BrCCOCCBr SBB054744 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.6 C#CCCCC#C SBB008772 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.6 C#CCCCCC SBB067441 [0,0,0,0,0,0|1,0,1]=2 3 B6R0.6 C#CCCCCO SBB015110 [0,0,0,0,0,0|0,0,2]=2 4 B6R0.6 C#CCOCCO SBB067658 [0,0,0,0,0,0|1,0,2]=3 5 B6R0.6 C=CCCCCBr SBB054740 [0,0,0,0,0,0|1,0,2]=3 6 B6R0.6 C=CCCCCC SBB059882 [0,0,0,0,0,0|1,0,1]=2 7 B6R0.6 C=CCOCCO SBB060194 [0,0,0,0,0,0|1,0,2]=3 8 B6R0.6 CCCCCC#N SBB060051 [0,0,0,0,0,0|1,0,1]=2 9 B6R0.6 CCCCCCBr SBB059934 [0,0,0,0,0,0|1,0,0]=1 10 B6R0.6 CCCCCCCl SBB059952 [0,0,0,0,0,0|1,0,0]=1 11 B6R0.6 CCCCCCN SBB059984 [0,0,0,0,0,0|1,0,0]=1 12 B6R0.6 CCCCCCO SBB059899 [0,0,0,0,0,0|0,0,0]=0 13 B6R0.6 CCCCCOC SBB061300 [0,0,0,0,0,0|2,0,0]=2 14 B6R0.6 CCCCN=C=S SBB060985 [0,0,0,0,0,0|1,1,1]=3 15 B6R0.6 CCCCNC=O SBB060026 [0,0,0,0,0,0|1,0,2]=3 16 B6R0.6 CCCCOC=O SBB060300 [0,0,0,0,0,0|1,0,2]=3 17 B6R0.6 CCCCSC#N SBB056760 [0,0,0,0,0,0|2,0,1]=3 18 B6R0.6 CCCCSCC SBB061178 [0,0,0,0,0,0|2,0,0]=2 19 B6R0.6 CCCNCCC SBB059762 [0,0,0,0,0,0|2,0,0]=2 20 B6R0.6 CCCOCCO SBB061379 [0,0,0,0,0,0|1,0,0]=1 21 B6R0.6 CCCSCCC SBB061017 [0,0,0,0,0,0|2,0,0]=2 22 B6R0.6 CCCSCCO SBB058605 [0,0,0,0,0,0|1,0,0]=1 23 B6R0.6 CCC\C=C\C=O SBB067097 [0,0,0,0,0,0|0,0,4]=4 24 B6R0.6 CCNCCC#N SBB006528 [0,0,0,0,0,0|2,0,1]=3 25 B6R0.6 CCOCCC#N SBB067181 [0,0,0,0,0,0|2,0,1]=3 26 B6R0.6 CCOCCCN SBB028180 [0,0,0,0,0,0|2,0,0]=2 27 B6R0.6 CC\C=C/CCO SBB007739 [0,0,0,0,0,0|0,0,2]=2 28 B6R0.6 COCCN=C=S SBB013663 [0,0,0,0,0,0|2,1,1]=4 29 B6R0.6 ClCCOCCCl SBB059969 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.6 N#CCCCC#N SBB068303 [0,0,0,0,0,0|2,0,2]=4 31 B6R0.6 N#CCCCCCl SBB061418 [0,0,0,0,0,0|2,0,1]=3 32 B6R0.6 NCCCCCN SBB079706 [0,0,0,0,0,0|2,0,0]=2 33 B6R0.6 NCCNCCN SBB059776 [0,0,0,0,0,0|3,0,0]=3 34 B6R0.6 NCCNCCO SBB028183 [0,0,0,0,0,0|2,0,0]=2 35 B6R0.6 NCCOCCO SBB060906 [0,0,0,0,0,0|2,0,0]=2 36 B6R0.6 NCCSCCO SBB056468 [0,0,0,0,0,0|2,0,0]=2 37 B6R0.6 O=C=NCCCCl SBB068362 [0,0,0,0,0,0|2,0,2]=4 38 B6R0.6 OCCNCCO SBB059779 [0,0,0,0,0,0|2,0,0]=2 39 B6R0.6 OCCOCCCl SBB060189 [0,0,0,0,0,0|2,0,0]=2 40 B6R0.6 OCCSCCO SBB060117 [0,0,0,0,0,0|2,0,0]=2 41 B6R0.6 SCCOCCS SBB058846 [0,0,0,0,0,0|2,1,0]=3 42 B5R0.2 BrCCCCBr SBB060204 [1,0,0,0,0,0|2,0,0]=3 43 B5R0.2 CC#CCCO SBB009118 [1,0,0,0,0,0|0,0,2]=3 44 B5R0.2 CCC#CCO SBB009120 [1,0,0,0,0,0|0,0,2]=3 45 B5R0.2 CCCCCBr SBB059933 [1,0,0,0,0,0|1,0,0]=2 46 B5R0.2 CCCCCCl SBB059951 [1,0,0,0,0,0|1,0,0]=2 47 B5R0.2 CCCN=C=S SBB060984 [1,0,0,0,0,0|1,1,1]=4 48 B5R0.2 CCNNCC SBB069584 [1,0,0,0,0,0|2,0,0]=3 49 B5R0.2 CCOCCBr SBB008332 [1,0,0,0,0,0|2,0,0]=3 50 B5R0.2 CCOCCCl SBB061015 [1,0,0,0,0,0|2,0,0]=3 51 B5R0.2 CCOCCN SBB072161 [1,0,0,0,0,0|2,0,0]=3 52 B5R0.2 CCSCCN SBB017894 [1,0,0,0,0,0|2,0,0]=3 53 B5R0.2 CNCCCN SBB059823 [1,0,0,0,0,0|2,0,0]=3 54 B5R0.2 CSCCCO SBB056451 [1,0,0,0,0,0|1,0,0]=2 55 B5R0.2 FCCCCBr SBB087044 [1,0,0,0,0,0|2,0,0]=3 56 B5R0.2 N#CCCCBr SBB054746 [1,0,0,0,0,0|2,0,1]=4 57 B5R0.2 N#CCCCCl SBB061739 [1,0,0,0,0,0|2,0,1]=4 58 B5R0.2 NCCCCN SBB059998 [1,0,0,0,0,0|2,0,0]=3 59 B5R0.2 OCCCCCl SBB002444 [1,0,0,0,0,0|1,0,0]=2 60 B7R0.1 BrCCCCCCBr SBB060205 [0,1,0,0,0,0|1,0,0]=2 61 B7R0.1 C#CCNCCCC SBB300093 [0,1,0,0,0,0|1,0,1]=3 62 B7R0.1 C=CCCCCCC SBB059884 [0,1,0,0,0,0|1,0,0]=2 63 B7R0.1 C=CCSCCCC SBB058522 [0,1,0,0,0,0|1,0,1]=3 64 B7R0.1 CCCC#CCCO SBB008799 [0,1,0,0,0,0|0,0,1]=2 65 B7R0.1 CCCCC#CCO SBB008796 [0,1,0,0,0,0|0,0,1]=2 66 B7R0.1 CCCCCCC#N SBB060052 [0,1,0,0,0,0|1,0,0]=2 67 B7R0.1 CCCCCCCBr SBB059936 [0,1,0,0,0,0|1,0,0]=2 68 B7R0.1 CCCCCCCCl SBB059954 [0,1,0,0,0,0|1,0,0]=2 69 B7R0.1 CCCCCCCN SBB059985 [0,1,0,0,0,0|1,0,0]=2 70 B7R0.1 CCCCCCOC SBB061157 [0,1,0,0,0,0|0,0,0]=1 71 B7R0.1 CCCCCN=C=S SBB085742 [0,1,0,0,0,0|0,1,1]=3 72 B7R0.1 CCCCCOC=O SBB060301 [0,1,0,0,0,0|0,0,2]=3 73 B7R0.1 CCCCCSC#N SBB060089 [0,1,0,0,0,0|1,0,1]=3 74 B7R0.1 CCCCNCCC SBB059822 [0,1,0,0,0,0|1,0,0]=2 75 B7R0.1 CCCCOCCBr SBB007731 [0,1,0,0,0,0|1,0,0]=2 76 B7R0.1 CCCCOCCCl SBB059964 [0,1,0,0,0,0|1,0,0]=2 77 B7R0.1 CCCCOCCO SBB059918 [0,1,0,0,0,0|0,0,0]=1 78 B7R0.1 CCCCSCCN SBB072659 [0,1,0,0,0,0|1,0,0]=2 79 B7R0.1 CCCCSCCO SBB013616 [0,1,0,0,0,0|0,0,0]=1 80 B7R0.1 CCCCSCCS SBB057435 [0,1,0,0,0,0|0,1,0]=2 81 B7R0.1 CCCNCCC#N SBB059761 [0,1,0,0,0,0|1,0,1]=3 82 B7R0.1 CCCOCCCN SBB056585 [0,1,0,0,0,0|1,0,0]=2 83 B7R0.1 CCCSSCCC SBB058501 [0,1,0,0,0,0|2,0,0]=3 84 B7R0.1 CCNCCCCO SBB052126 [0,1,0,0,0,0|0,0,0]=1 85 B7R0.1 CCNCCNCC SBB072869 [0,1,0,0,0,0|2,0,0]=3 86 B7R0.1 COCCCN=C=S SBB085786 [0,1,0,0,0,0|1,1,1]=4 87 B7R0.1 COCCOCCCl SBB059966 [0,1,0,0,0,0|2,0,0]=3 88 B7R0.1 COCCOCCO SBB059920 [0,1,0,0,0,0|1,0,0]=2 89 B7R0.1 COCCOCCS SBB061387 [0,1,0,0,0,0|1,1,0]=3 90 B7R0.1 COCCSCCO SBB061070 [0,1,0,0,0,0|1,0,0]=2 91 B7R0.1 CSCCCN=C=S SBB066566 [0,1,0,0,0,0|1,1,1]=4 92 B7R0.1 C\C=C\CCCCC SBB059885 [0,1,0,0,0,0|1,0,1]=3 93 B7R0.1 ClCCCCCCCl SBB060213 [0,1,0,0,0,0|1,0,0]=2 94 B7R0.1 N#CCCCCC#N SBB060888 [0,1,0,0,0,0|1,0,2]=4 95 B7R0.1 N#CCCCCCBr SBB058579 [0,1,0,0,0,0|1,0,1]=3 96 B7R0.1 N#CCCSCCO SBB069588 [0,1,0,0,0,0|1,0,1]=3 97 B7R0.1 NCCCCCCN SBB059999 [0,1,0,0,0,0|1,0,0]=2 98 B7R0.1 NCCCNCCN SBB052120 [0,1,0,0,0,0|2,0,0]=3 99 B7R0.1 NCCCNCCO SBB059810 [0,1,0,0,0,0|1,0,0]=2 100 B7R0.1 NCCSSCCN SBB003325 [0,1,0,0,0,0|3,0,0]=4 101 B7R0.1 OCCCCCCBr SBB054752 [0,1,0,0,0,0|0,0,0]=1 102 B7R0.1 OCCCCCCCl SBB060188 [0,1,0,0,0,0|0,0,0]=1 103 B7R0.1 OCCCCCCN SBB006584 [0,1,0,0,0,0|0,0,0]=1 104 B7R0.1 OCCCCCCO SBB059915 [0,1,0,0,0,0|0,0,0]=1 105 B7R0.1 OCCCCCCS SBB058615 [0,1,0,0,0,0|0,0,0]=1 106 B7R0.3 C=C(CC)CCCC SBB060475 [0,1,0,0,0,0|1,0,1]=3 107 B7R0.3 C=CC(O)CCCC SBB008778 [0,1,0,0,0,0|1,0,1]=3 108 B7R0.3 CC(CN)CCCN SBB058625 [0,1,0,0,0,0|2,0,0]=3 109 B7R0.3 CCC(=O)OCCCl SBB060315 [0,1,0,0,0,0|2,0,1]=4 110 B7R0.3 CCC(C)CN=C=S SBB085743 [0,1,0,0,0,0|1,1,1]=4 111 B7R0.3 CCCCC(=O)NN SBB028196 [0,1,0,0,0,0|2,0,1]=4 112 B7R0.3 CCCCC(Cl)CCl SBB060394 [0,1,0,0,0,0|1,0,0]=2 113 B7R0.3 CCCNC(=O)CCl SBB016586 [0,1,0,0,0,0|2,0,1]=4 114 B7R0.3 CCCOC(=O)CCl SBB060962 [0,1,0,0,0,0|2,0,1]=4 115 B7R0.3 CCCOC(=O)CS SBB061003 [0,1,0,0,0,0|1,1,1]=4 116 B7R0.3 CCN(C)CCCO SBB046555 [0,1,0,0,0,0|1,0,0]=2 117 B7R0.3 CCNCC(O)CC SBB072921 [0,1,0,0,0,0|2,0,0]=3 118 B7R0.3 CCOCC(O)CN SBB017905 [0,1,0,0,0,0|2,0,0]=3 119 B7R0.3 COC(=N)CCCCl SBB056505 [0,1,0,0,0,0|2,0,1]=4 120 B7R0.3 NNC(=O)CCCO SBB028199 [0,1,0,0,0,0|2,0,1]=4 121 B7R0.3 OC[C@H](CCSC)N SBB006701 [0,1,0,0,0,0|1,0,0]=2 122 B7R0.4 C#CCCCC(=O)O SBB009090 [0,1,0,0,0,0|0,0,3]=4 123 B7R0.4 CC(C)CCCCBr SBB008833 [0,1,0,0,0,0|1,0,0]=2 124 B7R0.4 CC(C)OCCC#N SBB080430 [0,1,0,0,0,0|2,0,1]=4 125 B7R0.4 CC(C)OCCCN SBB061717 [0,1,0,0,0,0|2,0,0]=3 126 B7R0.4 CC(Cl)COCCCl SBB056511 [0,1,0,0,0,0|2,0,0]=3 127 B7R0.4 CCCC#CC(=O)O SBB009091 [0,1,0,0,0,0|0,0,3]=4 128 B7R0.4 CCCCCC(=O)Cl SBB060011 [0,1,0,0,0,0|0,0,2]=3 129 B7R0.4 CCCCCC(=O)O SBB053586 [0,1,0,0,0,0|0,0,1]=2 130 B7R0.4 CCCCCC(C)=O SBB061125 [0,1,0,0,0,0|0,0,2]=3 131 B7R0.4 CCCCCC(N)=O SBB061056 [0,1,0,0,0,0|0,0,2]=3 132 B7R0.4 CCCCNC(N)=S SBB028242 [0,1,0,0,0,0|1,1,1]=4 133 B7R0.4 CCCCOC(Cl)Cl SBB060510 [0,1,0,0,0,0|2,0,0]=3 134 B7R0.4 CCCCOC(N)=O SBB060819 [0,1,0,0,0,0|1,0,2]=4 135 B7R0.4 CCCOCC(C)O SBB061007 [0,1,0,0,0,0|1,0,0]=2 136 B7R0.4 CCC\C=C\C(=O)O SBB009088 [0,1,0,0,0,0|0,0,3]=4 137 B7R0.4 CCOCCC(=O)O SBB053607 [0,1,0,0,0,0|1,0,1]=3 138 B7R0.4 CN(C)CCCC#N SBB072052 [0,1,0,0,0,0|2,0,1]=4 139 B7R0.4 CN(C)CCCCN SBB008514 [0,1,0,0,0,0|2,0,0]=3 140 B7R0.4 CNCCCN(C)C SBB052125 [0,1,0,0,0,0|3,0,0]=4 141 B7R0.4 COCCNC(C)C SBB302570 [0,1,0,0,0,0|3,0,0]=4 142 B7R0.4 NCCCCC(=O)O SBB061559 [0,1,0,0,0,0|1,0,1]=3 143 B7R0.4 O=C(O)CCCCBr SBB061343 [0,1,0,0,0,0|1,0,1]=3 144 B7R0.4 O=C(O)CCCCCl SBB061215 [0,1,0,0,0,0|1,0,1]=3 145 B7R0.4 OC(=O)C\C=C/CC SBB006610 [0,1,0,0,0,0|0,0,3]=4 146 B7R0.4 [NH2+]=C(N)SCCCC SBB060794 [0,1,0,0,0,0|2,0,1]=4 147 B7R0.7 CCCC(=O)CCC SBB060386 [0,1,0,0,0,0|1,0,1]=3 148 B7R0.7 CCCC(N)CCC SBB018801 [0,1,0,0,0,0|1,0,0]=2 149 B7R0.7 CCCC(O)CCC SBB061327 [0,1,0,0,0,0|1,0,0]=2 150 B7R0.7 CCCN(C)CCC SBB061592 [0,1,0,0,0,0|2,0,0]=3 151 B7R0.7 CCNC(C)CCO SBB046562 [0,1,0,0,0,0|1,0,0]=2 152 B7R0.7 CCOC(=O)CCBr SBB070739 [0,1,0,0,0,0|2,0,1]=4 153 B7R0.7 CCOC(=O)CCN SBB004038 [0,1,0,0,0,0|2,0,1]=4 154 B7R0.7 CCOC(C)OCC SBB058503 [0,1,0,0,0,0|3,0,0]=4 155 B7R1.1 BrCC1CCCC1 SBB054968 [0,0,0,1,0,0|1,0,0]=2 156 B7R1.1 BrCC1CCCO1 SBB003909 [0,0,0,1,0,0|1,0,0]=2 157 B7R1.1 BrCC1OCCO1 SBB070708 [0,0,0,1,0,0|2,0,0]=3 158 B7R1.1 ClCC1CCCN1 SBB018633 [0,0,0,1,0,0|2,0,0]=3 159 B7R1.1 ClCC1CCCO1 SBB008957 [0,0,0,1,0,0|1,0,0]=2 160 B7R1.1 N#CC1CCCC1 SBB008886 [0,0,0,1,0,0|1,0,1]=3 161 B7R1.1 N#CN1CCCC1 SBB059310 [0,0,0,1,0,0|2,0,1]=4 162 B7R1.1 NCC1CCCO1 SBB028168 [0,0,0,1,0,0|1,0,0]=2 163 B7R1.1 NNC1CCCC1 SBB301621 [0,0,0,1,0,0|2,0,0]=3 164 B7R1.1 O=CC1CCCC1 SBB069481 [0,0,0,1,0,0|0,0,2]=3 165 B7R1.1 O=CC1CCOC1 SBB052278 [0,0,0,1,0,0|1,0,2]=4 166 B7R1.1 OCC1CCCC1 SBB008516 [0,0,0,1,0,0|0,0,0]=1 167 B7R1.1 OCC1CCCO1 SBB058567 [0,0,0,1,0,0|1,0,0]=2 168 B7R1.1 OCC1CCNC1 SBB046413 [0,0,0,1,0,0|1,0,0]=2 169 B7R1.1 OCC1OCCO1 SBB059646 [0,0,0,1,0,0|2,0,0]=3 170 B7R1.1 OC[C@H]1CCCN1 SBB027252 [0,0,0,1,0,0|1,0,0]=2 171 B7R1.1 ON=C1CCCC1 SBB060393 [0,0,0,1,0,0|1,0,1]=3 172 B7R1.3 BrC1C=CCCC1 SBB007864 [0,0,0,1,0,0|1,0,2]=4 173 B7R1.3 BrC1CCCCC1 SBB059944 [0,0,0,1,0,0|1,0,0]=2 174 B7R1.3 BrC1CCNCC1 SBB054613 [0,0,0,1,0,0|2,0,0]=3 175 B7R1.3 CC1CC=CCC1 SBB060473 [0,0,0,1,0,0|1,0,2]=4 176 B7R1.3 CC1CCCCC1 SBB061163 [0,0,0,1,0,0|1,0,0]=2 177 B7R1.3 CC1SCCCS1 SBB056211 [0,0,0,1,0,0|1,1,0]=3 178 B7R1.3 CN1CCCCC1 SBB060237 [0,0,0,1,0,0|2,0,0]=3 179 B7R1.3 CN1CCOCC1 SBB061013 [0,0,0,1,0,0|3,0,0]=4 180 B7R1.3 ClC1CCOCC1 SBB070678 [0,0,0,1,0,0|2,0,0]=3 181 B7R1.3 FC1CCCNC1 SBB070684 [0,0,0,1,0,0|2,0,0]=3 182 B7R1.3 FC1CCNCC1 SBB070685 [0,0,0,1,0,0|2,0,0]=3 183 B7R1.3 N1CCC(C)CC1 SBB027302 [0,0,0,1,0,0|2,0,0]=3 184 B7R1.3 N1CCCC(C)C1 SBB027301 [0,0,0,1,0,0|2,0,0]=3 185 B7R1.3 N1CCCC(O)C1 SBB004193 [0,0,0,1,0,0|1,0,0]=2 186 B7R1.3 N1CCCCC1C SBB027300 [0,0,0,1,0,0|1,0,0]=2 187 B7R1.3 N1CCN(C)CC1 SBB027304 [0,0,0,1,0,0|3,0,0]=4 188 B7R1.3 N1CCNC(C)C1 SBB027299 [0,0,0,1,0,0|2,0,0]=3 189 B7R1.3 NC1CCCCC1 SBB040492 [0,0,0,1,0,0|1,0,0]=2 190 B7R1.3 NC1CCCNC1 SBB052004 [0,0,0,1,0,0|2,0,0]=3 191 B7R1.3 NC1CCCOC1 SBB012974 [0,0,0,1,0,0|2,0,0]=3 192 B7R1.3 NC1CCNCC1 SBB028166 [0,0,0,1,0,0|2,0,0]=3 193 B7R1.3 NC1CCOCC1 SBB014873 [0,0,0,1,0,0|2,0,0]=3 194 B7R1.3 NC1CCOCC1 SBB069906 [0,0,0,1,0,0|2,0,0]=3 195 B7R1.3 NN1CCCCC1 SBB067336 [0,0,0,1,0,0|2,0,0]=3 196 B7R1.3 NN1CCOCC1 SBB004363 [0,0,0,1,0,0|3,0,0]=4 197 B7R1.3 N[C@@H]1CCCNC1 SBB069744 [0,0,0,1,0,0|2,0,0]=3 198 B7R1.3 N[C@H]1CCCNC1 SBB017596 [0,0,0,1,0,0|2,0,0]=3 199 B7R1.3 O=C1CCCCC1 SBB060074 [0,0,0,1,0,0|0,0,2]=3 200 B7R1.3 O=C1CCCCO1 SBB060349 [0,0,0,1,0,0|1,0,1]=3 201 B7R1.3 O=C1CCOCC1 SBB049627 [0,0,0,1,0,0|1,0,2]=4 202 B7R1.3 O=C1CCSCC1 SBB048121 [0,0,0,1,0,0|1,0,2]=4 203 B7R1.3 OC1CCCCC1 SBB060483 [0,0,0,1,0,0|0,0,0]=1 204 B7R1.3 OC1CCCCO1 SBB055947 [0,0,0,1,0,0|1,0,0]=2 205 B7R1.3 OC1CCCNC1 SBB027351 [0,0,0,1,0,0|1,0,0]=2 206 B7R1.3 OC1CCNCC1 SBB027346 [0,0,0,1,0,0|1,0,0]=2 207 B7R1.3 OC1CCOCC1 SBB055945 [0,0,0,1,0,0|1,0,0]=2 208 B7R1.4 BrC1CCCC1Br SBB060684 [0,0,0,1,0,0|2,0,0]=3 209 B7R1.4 CN1CCCC1=O SBB060297 [0,0,0,1,0,0|1,0,2]=4 210 B7R1.4 ClC1CCCC1Cl SBB060212 [0,0,0,1,0,0|2,0,0]=3 211 B7R1.4 N[C@@H]1CSC[C@H]1O SBB014689 [0,0,0,1,0,0|2,0,0]=3 212 B7R1.4 OC1CCCC1Cl SBB060196 [0,0,0,1,0,0|1,0,0]=2 213 B7R1.4 O[C@H]1CCC[C@H]1O SBB008502 [0,0,0,1,0,0|1,0,0]=2 214 B7R1.6 N#CCC1CCC1 SBB071683 [0,0,0,1,0,0|1,0,1]=3 215 B7R1.7 CCCCC1CO1 SBB017137 [0,0,0,1,0,0|0,0,0]=1 216 B7R1.24 C1=CCCCCC1 SBB059889 [0,0,0,1,0,0|1,0,1]=3 217 B7R1.24 C1CCCCCC1 SBB060406 [0,0,0,1,0,0|1,0,0]=2 218 B7R1.24 C1CNCCNC1 SBB004367 [0,0,0,1,0,0|2,0,0]=3 219 B7R1.24 C1CNCCOC1 SBB049498 [0,0,0,1,0,0|1,0,0]=2 220 B7R1.24 N1CCCCCC1 SBB027297 [0,0,0,1,0,0|1,0,0]=2 221 B4R0.2 BrCCCBr SBB060203 [2,0,0,0,0,0|2,0,0]=4 222 B4R0.2 CCCCBr SBB059930 [2,0,0,0,0,0|1,0,0]=3 223 B4R0.2 CNCCI SBB071605 [2,0,0,0,0,0|2,0,0]=4 224 B4R0.2 COCCBr SBB007906 [2,0,0,0,0,0|2,0,0]=4 225 B4R0.2 C\C=C\CC SBB059879 [2,0,0,0,0,0|0,0,2]=4 226 B4R0.2 ClCCCBr SBB058669 [2,0,0,0,0,0|2,0,0]=4 227 B4R0.2 ClCCCCl SBB040918 [2,0,0,0,0,0|2,0,0]=4 228 B4R0.2 OCCCBr SBB054750 [2,0,0,0,0,0|1,0,0]=3 229 B4R0.2 [NH2+](CC)CC SBB059849 [2,0,0,0,0,0|1,0,0]=3 230 B6R0.1 C#CC(O)CCC SBB067434 [1,1,0,0,0,0|0,0,2]=4 231 B6R0.1 CCC(O)COC SBB072708 [1,1,0,0,0,0|1,0,0]=3 232 B6R0.1 CCCC(=O)CC SBB061496 [1,1,0,0,0,0|0,0,1]=3 233 B6R0.1 CCCC(=O)OC SBB061104 [1,1,0,0,0,0|1,0,1]=4 234 B6R0.1 CCCC(C)CO SBB061282 [1,1,0,0,0,0|0,0,0]=2 235 B6R0.1 CCCC(O)CC SBB061363 [1,1,0,0,0,0|0,0,0]=2 236 B6R0.1 CCC\C(N)=N/O SBB028173 [1,1,0,0,0,0|1,0,1]=4 237 B6R0.1 CCNC(C)CO SBB046531 [1,1,0,0,0,0|1,0,0]=3 238 B6R0.1 CCOC(=O)CC SBB060312 [1,1,0,0,0,0|1,0,1]=4 239 B6R0.1 CNC(C)CCO SBB046542 [1,1,0,0,0,0|1,0,0]=3 240 B6R0.1 CNCC(C)OC SBB049894 [1,1,0,0,0,0|2,0,0]=4 241 B6R0.1 COCC(O)CN SBB051203 [1,1,0,0,0,0|2,0,0]=4 242 B6R0.1 OC(CBr)CCBr SBB007842 [1,1,0,0,0,0|2,0,0]=4 243 B6R0.4 CC(=O)NCCO SBB007954 [1,1,0,0,0,0|1,0,1]=4 244 B6R0.4 CC(C)NCCN SBB048119 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.4 CC(C)NCCO SBB056428 [1,1,0,0,0,0|1,0,0]=3 246 B6R0.4 CC(C)OCCN SBB301616 [1,1,0,0,0,0|2,0,0]=4 247 B6R0.4 CCC#CC(C)O SBB067141 [1,1,0,0,0,0|0,0,2]=4 248 B6R0.4 CCCCC(=O)O SBB053585 [1,1,0,0,0,0|0,0,1]=3 249 B6R0.4 CCCCC(C)=O SBB061262 [1,1,0,0,0,0|0,0,1]=3 250 B6R0.4 CCCCC(C)O SBB061290 [1,1,0,0,0,0|0,0,0]=2 251 B6R0.4 CCCCC(N)=O SBB028169 [1,1,0,0,0,0|0,0,2]=4 252 B6R0.4 CCCCN(C)C SBB060243 [1,1,0,0,0,0|1,0,0]=3 253 B6R0.4 CCCOC(C)=O SBB060305 [1,1,0,0,0,0|1,0,1]=4 254 B6R0.4 CCOCC(=O)O SBB069120 [1,1,0,0,0,0|1,0,1]=4 255 B6R0.4 CCOCC(C)O SBB061006 [1,1,0,0,0,0|1,0,0]=3 256 B6R0.4 CCSCC(=O)O SBB047288 [1,1,0,0,0,0|1,0,1]=4 257 B6R0.4 CN(C)CCCN SBB028177 [1,1,0,0,0,0|2,0,0]=4 258 B6R0.4 NCCCC(=O)O SBB028179 [1,1,0,0,0,0|1,0,1]=4 259 B6R0.4 O=C(O)CCCBr SBB065986 [1,1,0,0,0,0|1,0,1]=4 260 B8R0.1 CCCC(=O)OCCCl SBB061294 [0,2,0,0,0,0|1,0,1]=4 261 B8R0.1 CCCCC(=O)OCC SBB061113 [0,2,0,0,0,0|1,0,1]=4 262 B8R0.1 CCCCC(O)CCC SBB059905 [0,2,0,0,0,0|1,0,0]=3 263 B8R0.1 CCCCS(=O)CCO SBB019077 [0,2,0,0,0,0|0,0,0]=2 264 B8R0.1 CCCOC(=O)CCC SBB061105 [0,2,0,0,0,0|1,0,1]=4 265 B8R0.1 CCOC(=O)CCCBr SBB070757 [0,2,0,0,0,0|1,0,1]=4 266 B8R0.1 CCOC(=O)CCCN SBB003878 [0,2,0,0,0,0|1,0,1]=4 267 B8R0.1 CCOC(=O)NCCO SBB079074 [0,2,0,0,0,0|1,0,1]=4 268 B8R0.1 O=C(CCS)OCCO SBB008479 [0,2,0,0,0,0|1,0,1]=4 269 B8R0.4 C#CCCCCCCO SBB062745 [0,2,0,0,0,0|0,0,0]=2 270 B8R0.4 C=CCCCCCCC SBB060474 [0,2,0,0,0,0|1,0,0]=3 271 B8R0.4 CC#CCNCCCC SBB010247 [0,2,0,0,0,0|1,0,1]=4 272 B8R0.4 CCCCC#CCCO SBB009106 [0,2,0,0,0,0|0,0,0]=2 273 B8R0.4 CCCCCC#CCO SBB009105 [0,2,0,0,0,0|0,0,0]=2 274 B8R0.4 CCCCCCCC#N SBB060053 [0,2,0,0,0,0|1,0,0]=3 275 B8R0.4 CCCCCCCC=O SBB059871 [0,2,0,0,0,0|0,0,1]=3 276 B8R0.4 CCCCCCCCBr SBB059937 [0,2,0,0,0,0|1,0,0]=3 277 B8R0.4 CCCCCCCCCl SBB059955 [0,2,0,0,0,0|1,0,0]=3 278 B8R0.4 CCCCCCCCN SBB059986 [0,2,0,0,0,0|1,0,0]=3 279 B8R0.4 CCCCCCCCO SBB059902 [0,2,0,0,0,0|0,0,0]=2 280 B8R0.4 CCCCCCCNC SBB059820 [0,2,0,0,0,0|1,0,0]=3 281 B8R0.4 CCCCCCN=C=O SBB058614 [0,2,0,0,0,0|0,0,1]=3 282 B8R0.4 CCCCCCN=C=S SBB061289 [0,2,0,0,0,0|0,1,0]=3 283 B8R0.4 CCCCCCNC=O SBB061175 [0,2,0,0,0,0|0,0,1]=3 284 B8R0.4 CCCCCCOC=O SBB060302 [0,2,0,0,0,0|0,0,0]=2 285 B8R0.4 CCCCCCSCC SBB061179 [0,2,0,0,0,0|0,1,0]=3 286 B8R0.4 CCCCCNCCO SBB059826 [0,2,0,0,0,0|0,0,0]=2 287 B8R0.4 CCCCC\C=C\C=O SBB068337 [0,2,0,0,0,0|0,0,2]=4 288 B8R0.4 CCCCNCCC#N SBB017631 [0,2,0,0,0,0|1,0,0]=3 289 B8R0.4 CCCCNCCCC SBB059755 [0,2,0,0,0,0|1,0,0]=3 290 B8R0.4 CCCCNCCOC SBB056732 [0,2,0,0,0,0|0,0,0]=2 291 B8R0.4 CCCCOCCC#N SBB058573 [0,2,0,0,0,0|1,0,0]=3 292 B8R0.4 CCCCOCCCC SBB060059 [0,2,0,0,0,0|1,0,0]=3 293 B8R0.4 CCCCOCCCN SBB061718 [0,2,0,0,0,0|1,0,0]=3 294 B8R0.4 CCCCSCCCC SBB060667 [0,2,0,0,0,0|1,0,0]=3 295 B8R0.4 CCOCCCN=C=S SBB030512 [0,2,0,0,0,0|0,1,1]=4 296 B8R0.4 CCOCCOCCCl SBB060378 [0,2,0,0,0,0|1,0,0]=3 297 B8R0.4 CCOCCOCCO SBB060178 [0,2,0,0,0,0|0,0,0]=2 298 B8R0.4 CCSCCOCCO SBB061065 [0,2,0,0,0,0|0,0,0]=2 299 B8R0.4 COCCNCCC#N SBB116774 [0,2,0,0,0,0|1,0,1]=4 300 B8R0.4 COCCNCCOC SBB059845 [0,2,0,0,0,0|1,0,0]=3 301 B8R0.4 COCCOCCCN SBB061669 [0,2,0,0,0,0|1,0,0]=3 302 B8R0.4 C\C=C\CSCCCC SBB061594 [0,2,0,0,0,0|1,0,1]=4 303 B8R0.4 ClCCOCOCCCl SBB060138 [0,2,0,0,0,0|2,0,0]=4 304 B8R0.4 N#CCCCCCC#N SBB068424 [0,2,0,0,0,0|1,0,1]=4 305 B8R0.4 N#CCCCCCCBr SBB068343 [0,2,0,0,0,0|1,0,0]=3 306 B8R0.4 NCCCCCCCN SBB058724 [0,2,0,0,0,0|1,0,0]=3 307 B8R0.4 NCCCNCCCN SBB059777 [0,2,0,0,0,0|1,0,0]=3 308 B8R0.4 OCCCCCCCBr SBB061558 [0,2,0,0,0,0|0,0,0]=2 309 B8R0.6 C#CC(O)CCCCC SBB009107 [0,2,0,0,0,0|0,0,0]=2 310 B8R0.6 CCC(C)NCCC#N SBB116741 [0,2,0,0,0,0|1,0,1]=4 311 B8R0.6 CCCCCC(=O)CC SBB060388 [0,2,0,0,0,0|1,0,0]=3 312 B8R0.6 CCCCCC(=O)NN SBB021010 [0,2,0,0,0,0|0,0,2]=4 313 B8R0.6 CCCCCC(=O)NO SBB008093 [0,2,0,0,0,0|0,0,1]=3 314 B8R0.6 CCCCCC(=O)OC SBB060591 [0,2,0,0,0,0|0,0,1]=3 315 B8R0.6 CCCCCC(Br)CBr SBB060499 [0,2,0,0,0,0|1,0,0]=3 316 B8R0.6 CCCCCC(O)CC SBB059904 [0,2,0,0,0,0|0,0,0]=2 317 B8R0.6 CCCCNC(=O)CCl SBB010319 [0,2,0,0,0,0|1,0,1]=4 318 B8R0.6 CCCCOC(=O)CC SBB060578 [0,2,0,0,0,0|1,0,1]=4 319 B8R0.6 CCCCOC(=O)CCl SBB060760 [0,2,0,0,0,0|1,0,1]=4 320 B8R0.6 CCCCOC(=O)CF SBB085867 [0,2,0,0,0,0|1,0,1]=4 321 B8R0.6 CCCCOC(=O)CS SBB061004 [0,2,0,0,0,0|0,1,1]=4 322 B8R0.6 COC(=O)CCCCBr SBB070759 [0,2,0,0,0,0|1,0,1]=4 323 B8R0.6 OC(CCl)COCCCl SBB056672 [0,2,0,0,0,0|2,0,0]=4 324 B8R0.6 OCCCCC(O)CO SBB061014 [0,2,0,0,0,0|0,0,0]=2 325 B8R0.6 OCCOCC(O)CCl SBB061082 [0,2,0,0,0,0|1,0,0]=3 326 B8R0.7 C#CCCCCC(=O)O SBB008797 [0,2,0,0,0,0|0,0,2]=4 327 B8R0.7 C=C(C)CSCCCC SBB061593 [0,2,0,0,0,0|1,0,1]=4 328 B8R0.7 CC(=O)OCCCCCl SBB059334 [0,2,0,0,0,0|1,0,1]=4 329 B8R0.7 CC(C)CCCCCBr SBB054753 [0,2,0,0,0,0|1,0,0]=3 330 B8R0.7 CC(C)CNCCCO SBB301242 [0,2,0,0,0,0|0,0,0]=2 331 B8R0.7 CC(C)COCCC#N SBB061192 [0,2,0,0,0,0|1,0,1]=4 332 B8R0.7 CCCCCCC(=O)Cl SBB060012 [0,2,0,0,0,0|0,0,1]=3 333 B8R0.7 CCCCCCC(=O)O SBB053587 [0,2,0,0,0,0|0,0,0]=2 334 B8R0.7 CCCCCCC(C)=O SBB060387 [0,2,0,0,0,0|0,0,1]=3 335 B8R0.7 CCCCCCC(C)Br SBB060198 [0,2,0,0,0,0|1,0,0]=3 336 B8R0.7 CCCCCCC(C)N SBB028238 [0,2,0,0,0,0|1,0,0]=3 337 B8R0.7 CCCCCCC(C)O SBB059903 [0,2,0,0,0,0|0,0,0]=2 338 B8R0.7 CCCCCCN(C)C SBB059990 [0,2,0,0,0,0|1,0,0]=3 339 B8R0.7 CCCCCOC(C)=O SBB060027 [0,2,0,0,0,0|0,0,2]=4 340 B8R0.7 CCCCNCC(C)C SBB059764 [0,2,0,0,0,0|1,0,0]=3 341 B8R0.7 CCCCNCC(C)O SBB059782 [0,2,0,0,0,0|0,0,0]=2 342 B8R0.7 CCCCSCC(=O)O SBB061205 [0,2,0,0,0,0|0,0,1]=3 343 B8R0.7 CCCNCCC(N)=O SBB116773 [0,2,0,0,0,0|0,0,2]=4 344 B8R0.7 CN(C)CCCCC#N SBB072265 [0,2,0,0,0,0|1,0,1]=4 345 B8R0.7 CN(C)CCCCCN SBB008565 [0,2,0,0,0,0|1,0,0]=3 346 B8R0.7 CN(C)CCOCCO SBB056528 [0,2,0,0,0,0|1,0,0]=3 347 B8R0.7 COCCNCC(F)F SBB046643 [0,2,0,0,0,0|2,0,0]=4 348 B8R0.7 COCCOCC(=O)O SBB008497 [0,2,0,0,0,0|1,0,1]=4 349 B8R0.7 NC(=O)CCNCCO SBB116776 [0,2,0,0,0,0|1,0,1]=4 350 B8R0.7 NCCCCCC(=O)O SBB015068 [0,2,0,0,0,0|0,0,1]=3 351 B8R0.7 O=C(O)CCCCCBr SBB065783 [0,2,0,0,0,0|0,0,1]=3 352 B8R0.7 O=C(O)CCNCCO SBB079386 [0,2,0,0,0,0|1,0,1]=4 353 B8R0.7 [NH2+](CCCC)CC(C)C SBB061643 [0,2,0,0,0,0|1,0,0]=3 354 B8R0.3 C#CC(O)C(C)CCC SBB009074 [0,2,0,0,0,0|1,0,1]=4 355 B8R0.3 CCN(C)C(C)CCN SBB046528 [0,2,0,0,0,0|2,0,0]=4 356 B8R0.3 O=CC[C@H](O)[C@H](O)CO SBB067136 [0,2,0,0,0,0|1,0,1]=4 357 B8R0.8 CC(O)C(=O)NCCO SBB008212 [0,2,0,0,0,0|1,0,1]=4 358 B8R0.8 CCCCC(Br)C(=O)O SBB069524 [0,2,0,0,0,0|0,0,1]=3 359 B8R0.8 CCCCC(C)C(=O)O SBB072714 [0,2,0,0,0,0|0,0,1]=3 360 B8R0.8 CCCCC(N)C(C)=O SBB014561 [0,2,0,0,0,0|0,0,2]=4 361 B8R0.8 CCCC[C@H](N)C(=O)O SBB065920 [0,2,0,0,0,0|0,0,1]=3 362 B8R0.8 NCCCC(N)C(=O)O SBB047988 [0,2,0,0,0,0|1,0,1]=4 363 B8R0.8 OC(=O)C(C)CCCCl SBB004068 [0,2,0,0,0,0|1,0,1]=4 364 B8R0.8 OC(=O)[C@@H](CCSC)N SBB006710 [0,2,0,0,0,0|1,0,1]=4 365 B8R0.8 [NH3+]CCCC(N)C(=O)O SBB061681 [0,2,0,0,0,0|1,0,1]=4 366 B8R0.9 CC(C)OCC(O)CN SBB010264 [0,2,0,0,0,0|2,0,0]=4 367 B8R0.9 CCC(=O)CCC(=O)O SBB072628 [0,2,0,0,0,0|0,0,2]=4 368 B8R0.11 CCCCC(C=O)CC SBB060148 [0,2,0,0,0,0|1,0,0]=3 369 B8R0.11 CCCCC(CC)CBr SBB059938 [0,2,0,0,0,0|1,0,0]=3 370 B8R0.11 CCCCC(CC)CCl SBB005809 [0,2,0,0,0,0|1,0,0]=3 371 B8R0.11 CCCCC(CC)CI SBB061182 [0,2,0,0,0,0|1,0,0]=3 372 B8R0.11 CCCCC(CC)CO SBB059906 [0,2,0,0,0,0|0,0,0]=2 373 B8R0.11 CCCCC(CO)CO SBB059212 [0,2,0,0,0,0|0,0,0]=2 374 B8R0.11 CCN(CC)CCCN SBB058841 [0,2,0,0,0,0|2,0,0]=4 375 B8R0.11 NCC(CC)CCCC SBB006745 [0,2,0,0,0,0|1,0,0]=3 376 B8R0.19 CCC(C)NC(C)CC SBB059801 [0,2,0,0,0,0|2,0,0]=4 377 B8R0.19 CCN(C)CC(C)CN SBB046527 [0,2,0,0,0,0|2,0,0]=4 378 B8R0.25 C#CC(C)(O)CCCC SBB002537 [0,2,0,0,0,0|1,0,1]=4 379 B8R0.25 CC(C)(CO)CCCN SBB007685 [0,2,0,0,0,0|1,0,0]=3 380 B8R0.25 CCC(C)(C)OCCO SBB061089 [0,2,0,0,0,0|1,0,0]=3 381 B8R0.25 CCCCC(C)(O)CC SBB061166 [0,2,0,0,0,0|1,0,0]=3 382 B8R0.5 CCCC(C)CC(=O)O SBB061321 [0,2,0,0,0,0|0,0,1]=3 383 B8R0.21 OCCOCC(F)(F)F SBB056421 [0,2,0,0,0,0|2,0,0]=4 384 B8R0.28 CC(C)=CCCC(C)O SBB008067 [0,2,0,0,0,0|0,0,2]=4 385 B8R0.28 CC(C)CCCC(=O)O SBB072713 [0,2,0,0,0,0|0,0,1]=3 386 B8R0.28 CC(C)CNCC(C)C SBB058770 [0,2,0,0,0,0|2,0,0]=4 387 B8R0.28 CC(C)COCC(C)C SBB061320 [0,2,0,0,0,0|2,0,0]=4 388 B8R0.28 CC(C)COCC(C)O SBB061009 [0,2,0,0,0,0|1,0,0]=3 389 B8R0.28 CC(C)CSCC(C)C SBB061180 [0,2,0,0,0,0|2,0,0]=4 390 B8R0.28 CC(O)CNCC(C)O SBB058768 [0,2,0,0,0,0|1,0,0]=3 391 B8R0.28 OC(=O)CCCN(C)C SBB005767 [0,2,0,0,0,0|1,0,1]=4 392 B8R0.28 [NH+](C)(C)CCCC(=O)O SBB058463 [0,2,0,0,0,0|1,0,1]=4 393 B8R0.22 C(=O)N(CCC)CCC SBB008026 [0,2,0,0,0,0|2,0,0]=4 394 B8R0.22 CCCC(C=O)CCC SBB052355 [0,2,0,0,0,0|1,0,0]=3 395 B8R0.22 CCN(CCO)CCO SBB058753 [0,2,0,0,0,0|2,0,0]=4 396 B6R1.1 C1=COCCC1 SBB060381 [1,0,0,1,0,0|0,0,2]=4 397 B6R1.1 C1CSCCN1 SBB056209 [1,0,0,1,0,0|1,1,0]=4 398 B6R1.1 C1CSCCO1 SBB060674 [1,0,0,1,0,0|1,0,0]=3 399 B6R1.1 C1CSCSC1 SBB061220 [1,0,0,1,0,0|1,1,0]=4 400 B6R1.1 C1OCOCO1 SBB060143 [1,0,0,1,0,0|2,0,0]=4 401 B6R1.2 BrC1CCCC1 SBB040823 [1,0,0,1,0,0|1,0,0]=3 402 B6R1.2 F[C@H]1CCNC1 SBB085616 [1,0,0,1,0,0|2,0,0]=4 403 B6R1.2 N1CCC(N)C1 SBB027337 [1,0,0,1,0,0|2,0,0]=4 404 B6R1.2 NC1CCCC1 SBB040467 [1,0,0,1,0,0|1,0,0]=3 405 B6R1.2 NC1CCNC1 SBB003982 [1,0,0,1,0,0|2,0,0]=4 406 B6R1.2 NN1CCCC1 SBB066760 [1,0,0,1,0,0|2,0,0]=4 407 B6R1.2 O=C1CCCC1 SBB040835 [1,0,0,1,0,0|0,0,2]=4 408 B6R1.2 OC1CCNC1 SBB056152 [1,0,0,1,0,0|1,0,0]=3 409 B6R1.2 O[C@H]1CCNC1 SBB004272 [1,0,0,1,0,0|1,0,0]=3 410 B6R1.2 O[C@H]1CCNC1 SBB027336 [1,0,0,1,0,0|1,0,0]=3 411 B6R1.2 O[C@H]1CCOC1 SBB062959 [1,0,0,1,0,0|1,0,0]=3 412 B6R1.6 BrCC1CCC1 SBB054975 [1,0,0,1,0,0|1,0,0]=3 413 B6R1.6 NCC1CCC1 SBB108847 [1,0,0,1,0,0|1,0,0]=3 414 B8R1.2 BrCC1CCCCO1 SBB054944 [0,1,0,1,0,0|0,0,0]=2 415 B8R1.2 BrCC1CCCNC1 SBB019055 [0,1,0,1,0,0|1,0,0]=3 416 B8R1.2 BrCC1CCOCC1 SBB054945 [0,1,0,1,0,0|1,0,0]=3 417 B8R1.2 C(=O)N1CCCCC1 SBB004316 [0,1,0,1,0,0|0,0,2]=4 418 B8R1.2 C1(CCl)OCCCO1 SBB085954 [0,1,0,1,0,0|1,0,0]=3 419 B8R1.2 CCC1CCCCC1 SBB061162 [0,1,0,1,0,0|1,0,0]=3 420 B8R1.2 CCC1CCNCC1 SBB046379 [0,1,0,1,0,0|1,0,0]=3 421 B8R1.2 CCN1CCCCC1 SBB061409 [0,1,0,1,0,0|1,0,0]=3 422 B8R1.2 CCN1CCOCC1 SBB060634 [0,1,0,1,0,0|2,0,0]=4 423 B8R1.2 COC1C=CCCC1 SBB060461 [0,1,0,1,0,0|0,0,2]=4 424 B8R1.2 COC1CCNCC1 SBB019028 [0,1,0,1,0,0|1,0,0]=3 425 B8R1.2 ClCC1CCCCO1 SBB040653 [0,1,0,1,0,0|0,0,0]=2 426 B8R1.2 ClCC1COCCO1 SBB046611 [0,1,0,1,0,0|1,0,0]=3 427 B8R1.2 N#CC1CCCCC1 SBB008404 [0,1,0,1,0,0|1,0,0]=3 428 B8R1.2 N#CC1CCNCC1 SBB062695 [0,1,0,1,0,0|1,0,1]=4 429 B8R1.2 N#CC1CCOCC1 SBB019014 [0,1,0,1,0,0|1,0,1]=4 430 B8R1.2 N(C)C1CCCCC1 SBB004314 [0,1,0,1,0,0|1,0,0]=3 431 B8R1.2 N1CCCCC1CC SBB004312 [0,1,0,1,0,0|1,0,0]=3 432 B8R1.2 N1CCN(CC)CC1 SBB006719 [0,1,0,1,0,0|2,0,0]=4 433 B8R1.2 NCC1CCCCC1 SBB028193 [0,1,0,1,0,0|1,0,0]=3 434 B8R1.2 NCC1CCCCN1 SBB069774 [0,1,0,1,0,0|1,0,0]=3 435 B8R1.2 NCC1CCCCO1 SBB085471 [0,1,0,1,0,0|0,0,0]=2 436 B8R1.2 NCC1CCCOC1 SBB013821 [0,1,0,1,0,0|1,0,0]=3 437 B8R1.2 NCC1CCNCC1 SBB004305 [0,1,0,1,0,0|1,0,0]=3 438 B8R1.2 NCC1CCOCC1 SBB014254 [0,1,0,1,0,0|1,0,0]=3 439 B8R1.2 NCC1COCCO1 SBB014104 [0,1,0,1,0,0|1,0,0]=3 440 B8R1.2 O=CC1CCNCC1 SBB052337 [0,1,0,1,0,0|0,0,2]=4 441 B8R1.2 O=CC1CCOCC1 SBB052321 [0,1,0,1,0,0|0,0,2]=4 442 B8R1.2 OCC1CC=CCC1 SBB054865 [0,1,0,1,0,0|0,0,1]=3 443 B8R1.2 OCC1CCCCC1 SBB061328 [0,1,0,1,0,0|0,0,0]=2 444 B8R1.2 OCC1CCCCN1 SBB058544 [0,1,0,1,0,0|0,0,0]=2 445 B8R1.2 OCC1CCCCO1 SBB008943 [0,1,0,1,0,0|0,0,0]=2 446 B8R1.2 OCC1CCCOC1 SBB014200 [0,1,0,1,0,0|0,0,0]=2 447 B8R1.2 OCC1CCNCC1 SBB054833 [0,1,0,1,0,0|0,0,0]=2 448 B8R1.2 ON=C1CCCCC1 SBB058381 [0,1,0,1,0,0|0,0,1]=3 449 B8R1.5 BrC1CCCC[C@@H]1Br SBB060495 [0,1,0,1,0,0|1,0,0]=3 450 B8R1.5 CC1=C(C)CCCC1 SBB060472 [0,1,0,1,0,0|1,0,1]=4 451 B8R1.5 CC1CCCCC1=O SBB058517 [0,1,0,1,0,0|0,0,1]=3 452 B8R1.5 CC1CCCCC1N SBB061724 [0,1,0,1,0,0|1,0,0]=3 453 B8R1.5 CC1CCCCN1C SBB060747 [0,1,0,1,0,0|1,0,0]=3 454 B8R1.5 CC1CCCNC1C SBB027556 [0,1,0,1,0,0|1,0,0]=3 455 B8R1.5 CC1CNCCC1O SBB300760 [0,1,0,1,0,0|0,0,0]=2 456 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl SBB007831 [0,1,0,1,0,0|1,0,0]=3 457 B8R1.5 FC1CCCCC1Br SBB089745 [0,1,0,1,0,0|1,0,0]=3 458 B8R1.5 N[C@@H]1CCCC[C@H]1N SBB007639 [0,1,0,1,0,0|1,0,0]=3 459 B8R1.5 O=C1CCCCC1Cl SBB061548 [0,1,0,1,0,0|0,0,2]=4 460 B8R1.5 O[C@@H]1CCCC[C@H]1O SBB007679 [0,1,0,1,0,0|0,0,0]=2 461 B8R1.5 O[C@H]1CCCC[C@H]1O SBB007678 [0,1,0,1,0,0|0,0,0]=2 462 B8R1.8 BrCCC1OCCO1 SBB070738 [0,1,0,1,0,0|1,0,0]=3 463 B8R1.8 C=CCC1CCCC1 SBB008872 [0,1,0,1,0,0|1,0,0]=3 464 B8R1.8 CCCC1OCCO1 SBB060981 [0,1,0,1,0,0|0,0,0]=2 465 B8R1.8 CCCC1OCCS1 SBB056724 [0,1,0,1,0,0|0,0,0]=2 466 B8R1.8 COC[C@@H]1CCCN1 SBB006442 [0,1,0,1,0,0|1,0,0]=3 467 B8R1.8 ClCCN1CCCC1 SBB070714 [0,1,0,1,0,0|1,0,0]=3 468 B8R1.8 N#CCC1CCCO1 SBB018702 [0,1,0,1,0,0|0,0,1]=3 469 B8R1.8 N#CCN1CCCC1 SBB047434 [0,1,0,1,0,0|1,0,1]=4 470 B8R1.8 NCCC1CCCC1 SBB072011 [0,1,0,1,0,0|1,0,0]=3 471 B8R1.8 NCCN1CCCC1 SBB004304 [0,1,0,1,0,0|1,0,0]=3 472 B8R1.8 O=C=NC1CCCC1 SBB046723 [0,1,0,1,0,0|0,0,2]=4 473 B8R1.8 OCCC1CCCC1 SBB008459 [0,1,0,1,0,0|0,0,0]=2 474 B8R1.8 OCCN1CCCC1 SBB060257 [0,1,0,1,0,0|0,0,0]=2 475 B8R1.8 OCCN1CCOC1 SBB008304 [0,1,0,1,0,0|1,0,0]=3 476 B8R1.8 S=C=NC1CCCC1 SBB017610 [0,1,0,1,0,0|0,1,1]=4 477 B8R1.11 CN1CCCC1CO SBB108833 [0,1,0,1,0,0|0,0,0]=2 478 B8R1.12 NC[C@@H]1CC[C@H]1CN SBB052512 [0,1,0,1,0,0|1,0,0]=3 479 B8R1.22 CN1CCCNCC1 SBB056191 [0,1,0,1,0,0|2,0,0]=4 480 B8R1.22 NC1CCCCCC1 SBB004311 [0,1,0,1,0,0|1,0,0]=3 481 B8R1.22 O=C1CCCCCC1 SBB060075 [0,1,0,1,0,0|0,0,1]=3 482 B8R1.22 O=C1CCCCCN1 SBB058658 [0,1,0,1,0,0|0,0,2]=4 483 B8R1.22 O=S1OCCCCO1 SBB060665 [0,1,0,1,0,0|2,0,0]=4 484 B8R1.22 OC1CCCCCC1 SBB061138 [0,1,0,1,0,0|0,0,0]=2 485 B8R1.36 C#CCOCC1CO1 SBB056460 [0,1,0,1,0,0|0,0,2]=4 486 B8R1.36 CCCNCC1CC1 SBB042821 [0,1,0,1,0,0|1,0,0]=3 487 B8R1.49 C1=CCCCCCC1 SBB059890 [0,1,0,1,0,0|1,0,0]=3 488 B8R1.49 C1CCCNCCC1 SBB059854 [0,1,0,1,0,0|1,0,0]=3 489 B8R1.1 CCC1COC(=O)O1 SBB008625 [0,1,0,1,0,0|1,0,1]=4 490 B8R1.1 CN1CCC(CCl)C1 SBB012983 [0,1,0,1,0,0|2,0,0]=4 491 B8R1.1 N[C@@H]1C=C[C@H](CO)C1 SBB054869 [0,1,0,1,0,0|0,0,2]=4 492 B8R1.1 O=C1CCC(CCl)O1 SBB074378 [0,1,0,1,0,0|1,0,1]=4 493 B8R1.1 OCC1CC(O)CN1 SBB014445 [0,1,0,1,0,0|1,0,0]=3 494 B8R1.1 OC[C@@H]1CCC(=O)N1 SBB004302 [0,1,0,1,0,0|1,0,1]=4 495 B8R1.3 CC1CCC(C)CC1 SBB061451 [0,1,0,1,0,0|1,0,0]=3 496 B8R1.3 CC1CCC(O)CC1 SBB060479 [0,1,0,1,0,0|0,0,0]=2 497 B8R1.3 CN1CCC(Cl)CC1 SBB057204 [0,1,0,1,0,0|2,0,0]=4 498 B8R1.3 CN1CCC(N)CC1 SBB004306 [0,1,0,1,0,0|2,0,0]=4 499 B8R1.3 C[C@H]1CC[C@H](N)CC1 SBB069772 [0,1,0,1,0,0|1,0,0]=3 500 B8R1.3 N1CC(C)NCC1C SBB004303 [0,1,0,1,0,0|2,0,0]=4 501 B8R1.3 N[C@H]1CC[C@H](N)CC1 SBB008553 [0,1,0,1,0,0|1,0,0]=3 502 B8R1.3 N[C@H]1CC[C@H](O)CC1 SBB005825 [0,1,0,1,0,0|0,0,0]=2 503 B8R1.3 O=C1CCC(O)CC1 SBB056283 [0,1,0,1,0,0|0,0,1]=3 504 B8R1.3 OC1CCC(Cl)CC1 SBB007863 [0,1,0,1,0,0|0,0,0]=2 505 B8R1.3 OC1CCN(C)CC1 SBB004301 [0,1,0,1,0,0|1,0,0]=3 506 B8R1.3 OC1CSC(O)CS1 SBB057060 [0,1,0,1,0,0|2,0,0]=4 507 B8R1.52 C#CC1(O)CCCC1 SBB002132 [0,1,0,1,0,0|1,0,1]=4 508 B8R1.52 CC1(CBr)OCCO1 SBB047493 [0,1,0,1,0,0|2,0,0]=4 509 B8R1.52 CC1(CN)CCCO1 SBB015007 [0,1,0,1,0,0|1,0,0]=3 510 B8R1.4 CC1CCCC(C)C1 SBB061164 [0,1,0,1,0,0|1,0,0]=3 511 B8R1.4 CC1CCCC(C)N1 SBB004313 [0,1,0,1,0,0|1,0,0]=3 512 B8R1.4 CC1CCCC(O)C1 SBB061310 [0,1,0,1,0,0|0,0,0]=2 513 B8R1.4 CC1CCNC(C)C1 SBB004310 [0,1,0,1,0,0|1,0,0]=3 514 B8R1.4 CC1CNCC(C)C1 SBB027312 [0,1,0,1,0,0|2,0,0]=4 515 B8R1.4 CC1CNCC(C)O1 SBB040955 [0,1,0,1,0,0|1,0,0]=3 516 B8R1.4 CN1CCCC(N)C1 SBB047756 [0,1,0,1,0,0|2,0,0]=4 517 B8R1.4 C[C@H]1CNC[C@@H](C)N1 SBB056139 [0,1,0,1,0,0|2,0,0]=4 518 B8R1.7 CC(N)C1CCCO1 SBB020137 [0,1,0,1,0,0|0,0,0]=2 519 B8R1.7 N=C(N)C1CCCC1 SBB056275 [0,1,0,1,0,0|1,0,1]=4 520 B8R1.7 O=C(O)C1CCCC1 SBB065782 [0,1,0,1,0,0|0,0,1]=3 521 B8R1.7 O=C(O)C1CCCO1 SBB004298 [0,1,0,1,0,0|1,0,1]=4 522 B8R1.7 O=C(O)C1CCNC1 SBB053378 [0,1,0,1,0,0|1,0,1]=4 523 B8R1.7 O=C(O)C1CCNC1 SBB069272 [0,1,0,1,0,0|1,0,1]=4 524 B8R1.7 O=C(O)C1CCOC1 SBB053083 [0,1,0,1,0,0|1,0,1]=4 525 B8R1.7 O=C(O)[C@H]1CCCN1 SBB006712 [0,1,0,1,0,0|1,0,1]=4 526 B8R1.7 O=C(O)[C@H]1CCNC1 SBB065825 [0,1,0,1,0,0|1,0,1]=4 527 B8R1.34 O=C(O)CC1CCC1 SBB050298 [0,1,0,1,0,0|0,0,1]=3 528 B8R1.35 CC(C)NCC1CC1 SBB080386 [0,1,0,1,0,0|2,0,0]=4 529 B8R1.35 FC(F)CNC1CC1 SBB046644 [0,1,0,1,0,0|2,0,0]=4 530 B8R1.72 CC1(C)CCCNC1 SBB027276 [0,1,0,1,0,0|2,0,0]=4 531 B8R1.72 CC1(C)CCOCO1 SBB060068 [0,1,0,1,0,0|1,0,0]=3 532 B8R1.72 CC1(O)CCCCC1 SBB061165 [0,1,0,1,0,0|0,0,0]=2 533 B8R1.72 FC1(F)CCCNC1 SBB087232 [0,1,0,1,0,0|2,0,0]=4 534 B8R1.72 FC1(F)CCNCC1 SBB087231 [0,1,0,1,0,0|2,0,0]=4 535 B8R1.72 O=S1(=O)CCCCO1 SBB059317 [0,1,0,1,0,0|2,0,0]=4 536 B8R1.72 OC1(O)CCNCC1 SBB004037 [0,1,0,1,0,0|1,0,0]=3 537 B8R2.34 C1CC2CC1CN2 SBB013021 [0,0,0,2,0,0|1,0,0]=3 538 B8R2.34 C1OC2CNC1C2 SBB017544 [0,0,0,2,0,0|1,0,0]=3 539 B8R2.25 C1CCC2OC2C1 SBB061377 [0,0,0,2,0,0|0,0,0]=2