0 B8R0.4 C#CCCCCCCO SBB062745 [0,0,0,0,0,0|0,0,2]=2 1 B8R0.4 C=CCCCCCCC SBB060474 [0,0,0,0,0,0|1,0,1]=2 2 B8R0.4 CC#CCNCCCC SBB010247 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.4 CCCCC#CCCO SBB009106 [0,0,0,0,0,0|0,0,2]=2 4 B8R0.4 CCCCCC#CCO SBB009105 [0,0,0,0,0,0|0,0,2]=2 5 B8R0.4 CCCCCCCC#N SBB060053 [0,0,0,0,0,0|1,0,1]=2 6 B8R0.4 CCCCCCCC=O SBB059871 [0,0,0,0,0,0|0,0,2]=2 7 B8R0.4 CCCCCCCCBr SBB059937 [0,0,0,0,0,0|1,0,0]=1 8 B8R0.4 CCCCCCCCCl SBB059955 [0,0,0,0,0,0|1,0,0]=1 9 B8R0.4 CCCCCCCCN SBB059986 [0,0,0,0,0,0|1,0,0]=1 10 B8R0.4 CCCCCCCCO SBB059902 [0,0,0,0,0,0|0,0,0]=0 11 B8R0.4 CCCCCCCNC SBB059820 [0,0,0,0,0,0|2,0,0]=2 12 B8R0.4 CCCCCCN=C=O SBB058614 [0,0,0,0,0,0|1,0,2]=3 13 B8R0.4 CCCCCCN=C=S SBB061289 [0,0,0,0,0,0|1,1,1]=3 14 B8R0.4 CCCCCCNC=O SBB061175 [0,0,0,0,0,0|1,0,2]=3 15 B8R0.4 CCCCCCOC=O SBB060302 [0,0,0,0,0,0|1,0,2]=3 16 B8R0.4 CCCCCCSCC SBB061179 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.4 CCCCCNCCO SBB059826 [0,0,0,0,0,0|1,0,0]=1 18 B8R0.4 CCCCC\C=C\C=O SBB068337 [0,0,0,0,0,0|0,0,4]=4 19 B8R0.4 CCCCNCCC#N SBB017631 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.4 CCCCNCCCC SBB059755 [0,0,0,0,0,0|2,0,0]=2 21 B8R0.4 CCCCNCCOC SBB056732 [0,0,0,0,0,0|3,0,0]=3 22 B8R0.4 CCCCOCCC#N SBB058573 [0,0,0,0,0,0|2,0,1]=3 23 B8R0.4 CCCCOCCCC SBB060059 [0,0,0,0,0,0|2,0,0]=2 24 B8R0.4 CCCCOCCCN SBB061718 [0,0,0,0,0,0|2,0,0]=2 25 B8R0.4 CCCCSCCCC SBB060667 [0,0,0,0,0,0|2,0,0]=2 26 B8R0.4 CCOCCCN=C=S SBB030512 [0,0,0,0,0,0|2,1,1]=4 27 B8R0.4 CCOCCOCCCl SBB060378 [0,0,0,0,0,0|3,0,0]=3 28 B8R0.4 CCOCCOCCO SBB060178 [0,0,0,0,0,0|2,0,0]=2 29 B8R0.4 CCSCCOCCO SBB061065 [0,0,0,0,0,0|2,0,0]=2 30 B8R0.4 COCCNCCC#N SBB116774 [0,0,0,0,0,0|3,0,1]=4 31 B8R0.4 COCCNCCOC SBB059845 [0,0,0,0,0,0|4,0,0]=4 32 B8R0.4 COCCOCCCN SBB061669 [0,0,0,0,0,0|3,0,0]=3 33 B8R0.4 C\C=C\CSCCCC SBB061594 [0,0,0,0,0,0|2,0,2]=4 34 B8R0.4 ClCCOCOCCCl SBB060138 [0,0,0,0,0,0|4,0,0]=4 35 B8R0.4 N#CCCCCCC#N SBB068424 [0,0,0,0,0,0|2,0,2]=4 36 B8R0.4 N#CCCCCCCBr SBB068343 [0,0,0,0,0,0|2,0,1]=3 37 B8R0.4 NCCCCCCCN SBB058724 [0,0,0,0,0,0|2,0,0]=2 38 B8R0.4 NCCCNCCCN SBB059777 [0,0,0,0,0,0|3,0,0]=3 39 B8R0.4 OCCCCCCCBr SBB061558 [0,0,0,0,0,0|1,0,0]=1 40 B7R0.1 BrCCCCCCBr SBB060205 [1,0,0,0,0,0|2,0,0]=3 41 B7R0.1 C#CCNCCCC SBB300093 [1,0,0,0,0,0|1,0,2]=4 42 B7R0.1 C=CCCCCCC SBB059884 [1,0,0,0,0,0|0,0,2]=3 43 B7R0.1 C=CCSCCCC SBB058522 [1,0,0,0,0,0|1,0,2]=4 44 B7R0.1 CCCC#CCCO SBB008799 [1,0,0,0,0,0|0,0,2]=3 45 B7R0.1 CCCCC#CCO SBB008796 [1,0,0,0,0,0|0,0,2]=3 46 B7R0.1 CCCCCCC#N SBB060052 [1,0,0,0,0,0|1,0,1]=3 47 B7R0.1 CCCCCCCBr SBB059936 [1,0,0,0,0,0|1,0,0]=2 48 B7R0.1 CCCCCCCCl SBB059954 [1,0,0,0,0,0|1,0,0]=2 49 B7R0.1 CCCCCCCN SBB059985 [1,0,0,0,0,0|1,0,0]=2 50 B7R0.1 CCCCCCOC SBB061157 [1,0,0,0,0,0|1,0,0]=2 51 B7R0.1 CCCCCN=C=S SBB085742 [1,0,0,0,0,0|1,1,1]=4 52 B7R0.1 CCCCCOC=O SBB060301 [1,0,0,0,0,0|1,0,2]=4 53 B7R0.1 CCCCCSC#N SBB060089 [1,0,0,0,0,0|2,0,1]=4 54 B7R0.1 CCCCNCCC SBB059822 [1,0,0,0,0,0|1,0,0]=2 55 B7R0.1 CCCCOCCBr SBB007731 [1,0,0,0,0,0|2,0,0]=3 56 B7R0.1 CCCCOCCCl SBB059964 [1,0,0,0,0,0|2,0,0]=3 57 B7R0.1 CCCCOCCO SBB059918 [1,0,0,0,0,0|1,0,0]=2 58 B7R0.1 CCCCSCCN SBB072659 [1,0,0,0,0,0|2,0,0]=3 59 B7R0.1 CCCCSCCO SBB013616 [1,0,0,0,0,0|1,0,0]=2 60 B7R0.1 CCCCSCCS SBB057435 [1,0,0,0,0,0|1,1,0]=3 61 B7R0.1 CCCNCCC#N SBB059761 [1,0,0,0,0,0|2,0,1]=4 62 B7R0.1 CCCOCCCN SBB056585 [1,0,0,0,0,0|2,0,0]=3 63 B7R0.1 CCCSSCCC SBB058501 [1,0,0,0,0,0|2,0,0]=3 64 B7R0.1 CCNCCCCO SBB052126 [1,0,0,0,0,0|1,0,0]=2 65 B7R0.1 CCNCCNCC SBB072869 [1,0,0,0,0,0|2,0,0]=3 66 B7R0.1 COCCOCCCl SBB059966 [1,0,0,0,0,0|3,0,0]=4 67 B7R0.1 COCCOCCO SBB059920 [1,0,0,0,0,0|2,0,0]=3 68 B7R0.1 COCCOCCS SBB061387 [1,0,0,0,0,0|2,1,0]=4 69 B7R0.1 COCCSCCO SBB061070 [1,0,0,0,0,0|2,0,0]=3 70 B7R0.1 C\C=C\CCCCC SBB059885 [1,0,0,0,0,0|0,0,2]=3 71 B7R0.1 ClCCCCCCCl SBB060213 [1,0,0,0,0,0|2,0,0]=3 72 B7R0.1 N#CCCCCCBr SBB058579 [1,0,0,0,0,0|2,0,1]=4 73 B7R0.1 N#CCCSCCO SBB069588 [1,0,0,0,0,0|2,0,1]=4 74 B7R0.1 NCCCCCCN SBB059999 [1,0,0,0,0,0|2,0,0]=3 75 B7R0.1 NCCCNCCN SBB052120 [1,0,0,0,0,0|3,0,0]=4 76 B7R0.1 NCCCNCCO SBB059810 [1,0,0,0,0,0|2,0,0]=3 77 B7R0.1 OCCCCCCBr SBB054752 [1,0,0,0,0,0|1,0,0]=2 78 B7R0.1 OCCCCCCCl SBB060188 [1,0,0,0,0,0|1,0,0]=2 79 B7R0.1 OCCCCCCN SBB006584 [1,0,0,0,0,0|1,0,0]=2 80 B7R0.1 OCCCCCCO SBB059915 [1,0,0,0,0,0|1,0,0]=2 81 B7R0.1 OCCCCCCS SBB058615 [1,0,0,0,0,0|1,0,0]=2 82 B9R0.2 CCCCCCCC(=O)Cl SBB060013 [0,1,0,0,0,0|0,0,2]=3 83 B9R0.2 CCCCCCCC(=O)O SBB060020 [0,1,0,0,0,0|0,0,1]=2 84 B9R0.2 CCCCCCCC(C)=O SBB061540 [0,1,0,0,0,0|0,0,2]=3 85 B9R0.2 CCCCCCCC(C)O SBB008521 [0,1,0,0,0,0|0,0,0]=1 86 B9R0.2 CCCCCCCC(N)=O SBB061055 [0,1,0,0,0,0|0,0,2]=3 87 B9R0.2 CCCCCCCN(C)C SBB061364 [0,1,0,0,0,0|2,0,0]=3 88 B9R0.2 CCCCCCNC(N)=S SBB028342 [0,1,0,0,0,0|1,1,1]=4 89 B9R0.2 CCCCCCOC(C)=O SBB060306 [0,1,0,0,0,0|1,0,2]=4 90 B9R0.2 CCCCSCCC(=O)O SBB001705 [0,1,0,0,0,0|1,0,1]=3 91 B9R0.2 CCOCCOCC(C)O SBB061150 [0,1,0,0,0,0|2,0,0]=3 92 B9R0.2 NCCCCCCC(=O)O SBB072673 [0,1,0,0,0,0|1,0,1]=3 93 B9R0.2 O=C(O)CCCCCCO SBB059715 [0,1,0,0,0,0|1,0,1]=3 94 B9R0.2 [NH2+]=C(N)SCCCCCC SBB060417 [0,1,0,0,0,0|2,0,1]=4 95 B9R0.5 CCCCCC(=O)CCC SBB005828 [0,1,0,0,0,0|1,0,1]=3 96 B9R0.5 CCCCCC(=O)OCC SBB060316 [0,1,0,0,0,0|2,0,1]=4 97 B9R0.5 CCCCOC(=O)CCC SBB061107 [0,1,0,0,0,0|2,0,1]=4 98 B9R0.5 CCOC(=O)CCCCBr SBB070781 [0,1,0,0,0,0|2,0,1]=4 99 B9R0.18 CCCCC(=O)CCCC SBB060073 [0,1,0,0,0,0|1,0,1]=3 100 B9R0.18 CCCCC(=O)OCCC SBB061228 [0,1,0,0,0,0|2,0,1]=4 101 B9R0.18 CCCCN(C)CCCC SBB061560 [0,1,0,0,0,0|2,0,0]=3 102 B9R0.18 CCCCS(=O)CCCC SBB060669 [0,1,0,0,0,0|2,0,0]=3 103 B9R0.45 BrCCCCCCCCBr SBB060805 [0,1,0,0,0,0|1,0,0]=2 104 B9R0.45 C#CCCCCCCC#C SBB008879 [0,1,0,0,0,0|1,0,2]=4 105 B9R0.45 C#CCCCCCCCC SBB008883 [0,1,0,0,0,0|1,0,0]=2 106 B9R0.45 C(=O)\C=C\CCCCCC SBB006609 [0,1,0,0,0,0|0,0,3]=4 107 B9R0.45 C=CCCCCCCCC SBB058674 [0,1,0,0,0,0|1,0,0]=2 108 B9R0.45 CCCCCC#CCCO SBB009142 [0,1,0,0,0,0|0,0,1]=2 109 B9R0.45 CCCCCCC#CCO SBB009144 [0,1,0,0,0,0|0,0,1]=2 110 B9R0.45 CCCCCCCCC=O SBB059872 [0,1,0,0,0,0|0,0,1]=2 111 B9R0.45 CCCCCCCCCBr SBB059939 [0,1,0,0,0,0|1,0,0]=2 112 B9R0.45 CCCCCCCCCCl SBB059956 [0,1,0,0,0,0|1,0,0]=2 113 B9R0.45 CCCCCCCCCN SBB059987 [0,1,0,0,0,0|1,0,0]=2 114 B9R0.45 CCCCCCCCCO SBB059907 [0,1,0,0,0,0|0,0,0]=1 115 B9R0.45 CCCCCCCCOC SBB061156 [0,1,0,0,0,0|0,0,0]=1 116 B9R0.45 CCCCCCCOC=O SBB060303 [0,1,0,0,0,0|0,0,2]=3 117 B9R0.45 CCCCCCNCCN SBB058822 [0,1,0,0,0,0|1,0,0]=2 118 B9R0.45 CCCCCCNCCO SBB007879 [0,1,0,0,0,0|0,0,0]=1 119 B9R0.45 CCCCCCOCCCl SBB060218 [0,1,0,0,0,0|1,0,0]=2 120 B9R0.45 CCCCCCOCCO SBB060173 [0,1,0,0,0,0|0,0,0]=1 121 B9R0.45 CCCCCCSCCO SBB060444 [0,1,0,0,0,0|0,0,0]=1 122 B9R0.45 CCCCCNCCCC SBB059765 [0,1,0,0,0,0|1,0,0]=2 123 B9R0.45 CCCCCOCCC#N SBB061167 [0,1,0,0,0,0|1,0,1]=3 124 B9R0.45 CCCCNCCOCC SBB056553 [0,1,0,0,0,0|2,0,0]=3 125 B9R0.45 CCCCSSCCCC SBB060118 [0,1,0,0,0,0|2,0,0]=3 126 B9R0.45 CCCNCCOCCO SBB059816 [0,1,0,0,0,0|1,0,0]=2 127 B9R0.45 CCCOCCOCCCl SBB061386 [0,1,0,0,0,0|2,0,0]=3 128 B9R0.45 CCSCCCCSCC SBB061079 [0,1,0,0,0,0|2,0,0]=3 129 B9R0.45 ClCCCCCCCCCl SBB008751 [0,1,0,0,0,0|1,0,0]=2 130 B9R0.45 ClCCOCCOCCCl SBB059970 [0,1,0,0,0,0|3,0,0]=4 131 B9R0.45 N#CCCCCCCC#N SBB058840 [0,1,0,0,0,0|1,0,2]=4 132 B9R0.45 NCCCCCCCCN SBB058725 [0,1,0,0,0,0|1,0,0]=2 133 B9R0.45 NCCNCCNCCN SBB058767 [0,1,0,0,0,0|3,0,0]=4 134 B9R0.45 NCCOCCOCCN SBB061504 [0,1,0,0,0,0|3,0,0]=4 135 B9R0.45 OCCCCCCCCO SBB060739 [0,1,0,0,0,0|0,0,0]=1 136 B9R0.45 OCCNCCOCCO SBB059840 [0,1,0,0,0,0|2,0,0]=3 137 B9R0.45 OCCOCCOCCCl SBB059927 [0,1,0,0,0,0|2,0,0]=3 138 B9R0.45 OCCSCCSCCO SBB059254 [0,1,0,0,0,0|2,0,0]=3 139 B9R0.45 SCCOCCOCCS SBB059255 [0,1,0,0,0,0|2,1,0]=4 140 B9R0.45 [NH2+](CCCC)CCCCC SBB061636 [0,1,0,0,0,0|1,0,0]=2 141 B9R0.46 CCCCCCC(=O)CC SBB007744 [0,1,0,0,0,0|1,0,1]=3 142 B9R0.46 CCCCCCC(=O)NN SBB021011 [0,1,0,0,0,0|2,0,1]=4 143 B9R0.46 CCCCCCC(=O)OC SBB060317 [0,1,0,0,0,0|2,0,1]=4 144 B9R0.46 CCCCCCC(Cl)CCl SBB059980 [0,1,0,0,0,0|1,0,0]=2 145 B9R0.46 CCCCCNC(=O)CCl SBB017391 [0,1,0,0,0,0|2,0,1]=4 146 B9R0.46 CCCCCOC(=O)CC SBB058817 [0,1,0,0,0,0|2,0,1]=4 147 B9R0.46 CCCCCOC(=O)CCl SBB060707 [0,1,0,0,0,0|2,0,1]=4 148 B9R0.46 CCCCCOC(=O)CS SBB061204 [0,1,0,0,0,0|1,1,1]=4 149 B9R0.46 CCCCOCC(O)CC SBB061149 [0,1,0,0,0,0|2,0,0]=3 150 B9R0.46 CCCCOCC(O)CCl SBB059972 [0,1,0,0,0,0|2,0,0]=3 151 B9R0.46 CCCCOCC(O)CO SBB060185 [0,1,0,0,0,0|1,0,0]=2 152 B9R0.46 COC(=O)CCCCCN SBB003739 [0,1,0,0,0,0|2,0,1]=4 153 B9R0.46 COCCOCC(O)CCl SBB061083 [0,1,0,0,0,0|3,0,0]=4 154 B9R0.46 NNC(=O)CCCCCO SBB072600 [0,1,0,0,0,0|2,0,1]=4 155 B9R1.5 CN1CCCCCC1=O SBB056535 [0,0,0,1,0,0|1,0,2]=4 156 B9R1.8 BrCCC1CCCCN1 SBB018737 [0,0,0,1,0,0|2,0,0]=3 157 B9R1.8 BrCCC1OCCCO1 SBB054748 [0,0,0,1,0,0|2,0,0]=3 158 B9R1.8 BrCCN1CCNCC1 SBB071600 [0,0,0,1,0,0|3,0,0]=4 159 B9R1.8 C(=O)NC1CCCCC1 SBB007682 [0,0,0,1,0,0|1,0,2]=4 160 B9R1.8 CCCC1CCCCN1 SBB017578 [0,0,0,1,0,0|1,0,0]=2 161 B9R1.8 CCCC1CCCCN1 SBB050937 [0,0,0,1,0,0|1,0,0]=2 162 B9R1.8 CCCC1OCCCO1 SBB060994 [0,0,0,1,0,0|1,0,0]=2 163 B9R1.8 CCCN1CCCCC1 SBB061042 [0,0,0,1,0,0|2,0,0]=3 164 B9R1.8 CCCN1CCNCC1 SBB056132 [0,0,0,1,0,0|3,0,0]=4 165 B9R1.8 CCCN1CCOCC1 SBB061033 [0,0,0,1,0,0|3,0,0]=4 166 B9R1.8 CCOC1CCNCC1 SBB027269 [0,0,0,1,0,0|3,0,0]=4 167 B9R1.8 CCOC1CCNCC1 SBB080379 [0,0,0,1,0,0|3,0,0]=4 168 B9R1.8 CNCC1COCCO1 SBB002649 [0,0,0,1,0,0|2,0,0]=3 169 B9R1.8 COCC1CCCNC1 SBB050890 [0,0,0,1,0,0|3,0,0]=4 170 B9R1.8 ClCCN1CCCCC1 SBB056102 [0,0,0,1,0,0|2,0,0]=3 171 B9R1.8 ClCCN1CCOCC1 SBB004079 [0,0,0,1,0,0|3,0,0]=4 172 B9R1.8 N#CCC1CCCCO1 SBB071717 [0,0,0,1,0,0|1,0,1]=3 173 B9R1.8 N#CCC1CCCOC1 SBB027169 [0,0,0,1,0,0|2,0,1]=4 174 B9R1.8 N#CCN1CCCCC1 SBB017050 [0,0,0,1,0,0|2,0,1]=4 175 B9R1.8 N1CCN(CCC)CC1 SBB005871 [0,0,0,1,0,0|3,0,0]=4 176 B9R1.8 NCCC1=CCCCC1 SBB058805 [0,0,0,1,0,0|1,0,2]=4 177 B9R1.8 NCCC1CCCCC1 SBB051424 [0,0,0,1,0,0|1,0,0]=2 178 B9R1.8 NCCC1CCCCO1 SBB072556 [0,0,0,1,0,0|1,0,0]=2 179 B9R1.8 NCCC1CCCOC1 SBB050548 [0,0,0,1,0,0|2,0,0]=3 180 B9R1.8 NCCN1CCCCC1 SBB058602 [0,0,0,1,0,0|2,0,0]=3 181 B9R1.8 NCCN1CCNCC1 SBB004229 [0,0,0,1,0,0|3,0,0]=4 182 B9R1.8 NCCN1CCOCC1 SBB028239 [0,0,0,1,0,0|3,0,0]=4 183 B9R1.8 O=C=NC1CCCCC1 SBB060893 [0,0,0,1,0,0|1,0,2]=4 184 B9R1.8 OCCC1CCCCN1 SBB027305 [0,0,0,1,0,0|1,0,0]=2 185 B9R1.8 OCCC1CCNCC1 SBB027320 [0,0,0,1,0,0|1,0,0]=2 186 B9R1.8 OCCN1CCCCC1 SBB040888 [0,0,0,1,0,0|1,0,0]=2 187 B9R1.8 OCCN1CCNCC1 SBB004225 [0,0,0,1,0,0|2,0,0]=3 188 B9R1.8 OCCN1CCOCC1 SBB004221 [0,0,0,1,0,0|2,0,0]=3 189 B9R1.8 S=C=NC1CCCCC1 SBB014110 [0,0,0,1,0,0|1,1,1]=4 190 B9R1.12 CCCCN1CCCC1 SBB061041 [0,0,0,1,0,0|2,0,0]=3 191 B9R1.12 CCCNC1CCCC1 SBB080044 [0,0,0,1,0,0|2,0,0]=3 192 B9R1.12 CCNCC1CCCO1 SBB080022 [0,0,0,1,0,0|1,0,0]=2 193 B9R1.12 N#CCCN1CCCC1 SBB047435 [0,0,0,1,0,0|2,0,1]=4 194 B9R1.12 NCCCC1CCOC1 SBB012984 [0,0,0,1,0,0|2,0,0]=3 195 B9R1.12 NCCCN1CCCC1 SBB005799 [0,0,0,1,0,0|2,0,0]=3 196 B9R1.12 S=C=NCC1CCCO1 SBB017396 [0,0,0,1,0,0|2,0,1]=4 197 B9R1.14 CCN1CCCC1CN SBB048031 [0,0,0,1,0,0|2,0,0]=3 198 B9R1.14 CCN1CCCC1CO SBB108758 [0,0,0,1,0,0|1,0,0]=2 199 B9R1.15 CCC1CCCOC1=O SBB061552 [0,0,0,1,0,0|1,0,2]=4 200 B9R1.15 CN1CCCCC1CBr SBB018986 [0,0,0,1,0,0|2,0,0]=3 201 B9R1.15 CN1CCCCC1CCl SBB054961 [0,0,0,1,0,0|2,0,0]=3 202 B9R1.15 CN1CCCCC1CN SBB085728 [0,0,0,1,0,0|2,0,0]=3 203 B9R1.15 CN1CCCCC1CO SBB062716 [0,0,0,1,0,0|1,0,0]=2 204 B9R1.15 CN[C@H]1CCCC[C@@H]1O SBB302548 [0,0,0,1,0,0|1,0,0]=2 205 B9R1.15 CN[C@H]1CCCC[C@H]1O SBB302547 [0,0,0,1,0,0|1,0,0]=2 206 B9R1.15 O=C1CCCCC1CO SBB054864 [0,0,0,1,0,0|1,0,1]=3 207 B9R1.33 CN1CCCC1CCO SBB056164 [0,0,0,1,0,0|1,0,0]=2 208 B9R1.33 NN1CCC[C@@H]1COC SBB017518 [0,0,0,1,0,0|3,0,0]=4 209 B9R1.33 NN1CCC[C@H]1COC SBB017520 [0,0,0,1,0,0|3,0,0]=4 210 B9R1.50 NC1CCCCCCC1 SBB004245 [0,0,0,1,0,0|1,0,0]=2 211 B9R1.50 O=C1CCCCCCC1 SBB008888 [0,0,0,1,0,0|0,0,2]=3 212 B9R1.50 OC1CCCCCCC1 SBB058905 [0,0,0,1,0,0|0,0,0]=1 213 B9R1.83 CCCCCCC1CO1 SBB017138 [0,0,0,1,0,0|0,0,0]=1 214 B9R1.83 CCCCOCC1CO1 SBB060096 [0,0,0,1,0,0|1,0,0]=2 215 B9R1.89 CCN1CCCCCC1 SBB056278 [0,0,0,1,0,0|2,0,0]=3 216 B9R1.89 CCN1CCCNCC1 SBB056277 [0,0,0,1,0,0|3,0,0]=4 217 B9R1.89 N#CC1CCCCCC1 SBB008917 [0,0,0,1,0,0|1,0,1]=3 218 B9R1.89 O=CC1CCCCCC1 SBB059644 [0,0,0,1,0,0|0,0,2]=3 219 B6R0.6 C#CCCCCC SBB067441 [2,0,0,0,0,0|0,0,2]=4 220 B6R0.6 C#CCCCCO SBB015110 [2,0,0,0,0,0|0,0,2]=4 221 B6R0.6 C=CCCCCC SBB059882 [2,0,0,0,0,0|0,0,2]=4 222 B6R0.6 CCCCCC#N SBB060051 [2,0,0,0,0,0|1,0,1]=4 223 B6R0.6 CCCCCCBr SBB059934 [2,0,0,0,0,0|1,0,0]=3 224 B6R0.6 CCCCCCCl SBB059952 [2,0,0,0,0,0|1,0,0]=3 225 B6R0.6 CCCCCCN SBB059984 [2,0,0,0,0,0|1,0,0]=3 226 B6R0.6 CCCCCCO SBB059899 [2,0,0,0,0,0|0,0,0]=2 227 B6R0.6 CCCCCOC SBB061300 [2,0,0,0,0,0|1,0,0]=3 228 B6R0.6 CCCCSCC SBB061178 [2,0,0,0,0,0|1,0,0]=3 229 B6R0.6 CCCNCCC SBB059762 [2,0,0,0,0,0|1,0,0]=3 230 B6R0.6 CCCOCCO SBB061379 [2,0,0,0,0,0|1,0,0]=3 231 B6R0.6 CCCSCCC SBB061017 [2,0,0,0,0,0|1,0,0]=3 232 B6R0.6 CCCSCCO SBB058605 [2,0,0,0,0,0|1,0,0]=3 233 B6R0.6 CCOCCCN SBB028180 [2,0,0,0,0,0|2,0,0]=4 234 B6R0.6 CC\C=C/CCO SBB007739 [2,0,0,0,0,0|0,0,2]=4 235 B6R0.6 NCCCCCN SBB079706 [2,0,0,0,0,0|2,0,0]=4 236 B6R0.6 NCCNCCO SBB028183 [2,0,0,0,0,0|2,0,0]=4 237 B6R0.6 NCCOCCO SBB060906 [2,0,0,0,0,0|2,0,0]=4 238 B6R0.6 NCCSCCO SBB056468 [2,0,0,0,0,0|2,0,0]=4 239 B6R0.6 OCCNCCO SBB059779 [2,0,0,0,0,0|2,0,0]=4 240 B6R0.6 OCCOCCCl SBB060189 [2,0,0,0,0,0|2,0,0]=4 241 B6R0.6 OCCSCCO SBB060117 [2,0,0,0,0,0|2,0,0]=4 242 B8R0.1 CCCCC(=O)OCC SBB061113 [1,1,0,0,0,0|1,0,1]=4 243 B8R0.1 CCCCC(O)CCC SBB059905 [1,1,0,0,0,0|0,0,0]=2 244 B8R0.1 CCCCS(=O)CCO SBB019077 [1,1,0,0,0,0|1,0,0]=3 245 B8R0.1 CCCOC(=O)CCC SBB061105 [1,1,0,0,0,0|1,0,1]=4 246 B8R0.6 C#CC(O)CCCCC SBB009107 [1,1,0,0,0,0|0,0,2]=4 247 B8R0.6 CCCCCC(=O)CC SBB060388 [1,1,0,0,0,0|0,0,1]=3 248 B8R0.6 CCCCCC(=O)NO SBB008093 [1,1,0,0,0,0|1,0,1]=4 249 B8R0.6 CCCCCC(=O)OC SBB060591 [1,1,0,0,0,0|1,0,1]=4 250 B8R0.6 CCCCCC(Br)CBr SBB060499 [1,1,0,0,0,0|1,0,0]=3 251 B8R0.6 CCCCCC(O)CC SBB059904 [1,1,0,0,0,0|0,0,0]=2 252 B8R0.6 CCCCOC(=O)CC SBB060578 [1,1,0,0,0,0|1,0,1]=4 253 B8R0.6 OCCCCC(O)CO SBB061014 [1,1,0,0,0,0|1,0,0]=3 254 B8R0.6 OCCOCC(O)CCl SBB061082 [1,1,0,0,0,0|2,0,0]=4 255 B8R0.7 C=C(C)CSCCCC SBB061593 [1,1,0,0,0,0|1,0,1]=4 256 B8R0.7 CC(C)CCCCCBr SBB054753 [1,1,0,0,0,0|1,0,0]=3 257 B8R0.7 CC(C)CNCCCO SBB301242 [1,1,0,0,0,0|1,0,0]=3 258 B8R0.7 CCCCCCC(=O)Cl SBB060012 [1,1,0,0,0,0|0,0,2]=4 259 B8R0.7 CCCCCCC(=O)O SBB053587 [1,1,0,0,0,0|0,0,1]=3 260 B8R0.7 CCCCCCC(C)=O SBB060387 [1,1,0,0,0,0|0,0,1]=3 261 B8R0.7 CCCCCCC(C)Br SBB060198 [1,1,0,0,0,0|0,0,0]=2 262 B8R0.7 CCCCCCC(C)N SBB028238 [1,1,0,0,0,0|0,0,0]=2 263 B8R0.7 CCCCCCC(C)O SBB059903 [1,1,0,0,0,0|0,0,0]=2 264 B8R0.7 CCCCCCN(C)C SBB059990 [1,1,0,0,0,0|1,0,0]=3 265 B8R0.7 CCCCCOC(C)=O SBB060027 [1,1,0,0,0,0|1,0,1]=4 266 B8R0.7 CCCCNCC(C)C SBB059764 [1,1,0,0,0,0|1,0,0]=3 267 B8R0.7 CCCCNCC(C)O SBB059782 [1,1,0,0,0,0|1,0,0]=3 268 B8R0.7 CCCCSCC(=O)O SBB061205 [1,1,0,0,0,0|1,0,1]=4 269 B8R0.7 CN(C)CCCCCN SBB008565 [1,1,0,0,0,0|2,0,0]=4 270 B8R0.7 CN(C)CCOCCO SBB056528 [1,1,0,0,0,0|2,0,0]=4 271 B8R0.7 NCCCCCC(=O)O SBB015068 [1,1,0,0,0,0|1,0,1]=4 272 B8R0.7 O=C(O)CCCCCBr SBB065783 [1,1,0,0,0,0|1,0,1]=4 273 B8R0.7 [NH2+](CCCC)CC(C)C SBB061643 [1,1,0,0,0,0|1,0,0]=3 274 B10R0.3 CC(C)=CCCC(C)CCO SBB012357 [0,2,0,0,0,0|0,0,2]=4 275 B10R0.3 CC(C)CCCC(C)CC=O SBB060756 [0,2,0,0,0,0|0,0,2]=4 276 B10R0.3 CC(C)CCC[C@H](C)CCO SBB007911 [0,2,0,0,0,0|0,0,0]=2 277 B10R0.4 CCCCCCCCB(O)O SBB071319 [0,2,0,0,0,0|0,0,0]=2 278 B10R0.4 CCCCCCCCC(=O)Cl SBB060014 [0,2,0,0,0,0|0,0,1]=3 279 B10R0.4 CCCCCCCCC(=O)O SBB058693 [0,2,0,0,0,0|0,0,0]=2 280 B10R0.4 CCCCCCCCC(N)=O SBB061053 [0,2,0,0,0,0|0,0,1]=3 281 B10R0.4 CCCCCCCCN(C)C SBB059991 [0,2,0,0,0,0|1,0,0]=3 282 B10R0.4 CCCCCCCNC(N)=S SBB017692 [0,2,0,0,0,0|0,1,1]=4 283 B10R0.4 CCCCCCCOC(C)=O SBB060307 [0,2,0,0,0,0|0,0,2]=4 284 B10R0.4 CCCCCCNCC(C)O SBB059797 [0,2,0,0,0,0|0,0,0]=2 285 B10R0.4 CN(C)CCCNCCCN SBB072006 [0,2,0,0,0,0|2,0,0]=4 286 B10R0.4 OC(=O)CCCCCCCN SBB006735 [0,2,0,0,0,0|0,0,1]=3 287 B10R0.4 [NH2+]=C(N)SCCCCCCC SBB056871 [0,2,0,0,0,0|1,0,1]=4 288 B10R0.22 CC(C)(C)OCCOCCO SBB060484 [0,2,0,0,0,0|2,0,0]=4 289 B10R0.22 CCCCCCCP(=O)(O)O SBB057478 [0,2,0,0,0,0|1,0,0]=3 290 B10R0.74 CCCCCCCC(=O)NN SBB056838 [0,2,0,0,0,0|0,0,2]=4 291 B10R0.74 CCCCCCCC(=O)OC SBB060592 [0,2,0,0,0,0|0,0,1]=3 292 B10R0.74 CCCCCCCC(C)C=O SBB061221 [0,2,0,0,0,0|0,0,1]=3 293 B10R0.74 CCCCCCNC(=O)CCl SBB017392 [0,2,0,0,0,0|1,0,1]=4 294 B10R0.74 CCCCCCOC(=O)CCl SBB061569 [0,2,0,0,0,0|1,0,1]=4 295 B10R0.74 CCCCCCOC(=O)CS SBB061229 [0,2,0,0,0,0|0,1,1]=4 296 B10R0.74 CCOCCOCC(O)CCl SBB061084 [0,2,0,0,0,0|2,0,0]=4 297 B10R0.75 CCCCCCC(N)C(=O)O SBB058628 [0,2,0,0,0,0|0,0,1]=3 298 B10R0.78 CCCCC(C)CCC(=O)O SBB065822 [0,2,0,0,0,0|0,0,1]=3 299 B10R0.1 CCCCCCC(=O)OCC SBB061117 [0,2,0,0,0,0|1,0,1]=4 300 B10R0.1 CCCCCOC(=O)CCC SBB060758 [0,2,0,0,0,0|1,0,1]=4 301 B10R0.1 CCOC(=O)CCCCCBr SBB006556 [0,2,0,0,0,0|1,0,1]=4 302 B10R0.24 CCCCCC(CO)CCC SBB043960 [0,2,0,0,0,0|1,0,0]=3 303 B10R0.91 CCCCCC(=O)OCCCl SBB061275 [0,2,0,0,0,0|1,0,1]=4 304 B10R0.156 CCCCCS(=O)(=O)CCCl SBB013613 [0,2,0,0,0,0|2,0,0]=4 305 B10R0.16 CCCCN(C#N)CCCC SBB059312 [0,2,0,0,0,0|2,0,0]=4 306 B10R0.116 CCCCS(=O)(=O)CCCC SBB060123 [0,2,0,0,0,0|2,0,0]=4 307 B10R0.71 C=CCCCCCCCCBr SBB059351 [0,2,0,0,0,0|1,0,0]=3 308 B10R0.71 C=CCCCCCCCCC SBB009051 [0,2,0,0,0,0|1,0,0]=3 309 B10R0.71 CCCCC#CCCCCO SBB008895 [0,2,0,0,0,0|0,0,0]=2 310 B10R0.71 CCCCCCC#CCCO SBB008896 [0,2,0,0,0,0|0,0,0]=2 311 B10R0.71 CCCCCCCC#CCO SBB008898 [0,2,0,0,0,0|0,0,0]=2 312 B10R0.71 CCCCCCCCCC=O SBB058676 [0,2,0,0,0,0|0,0,1]=3 313 B10R0.71 CCCCCCCCCCBr SBB008838 [0,2,0,0,0,0|1,0,0]=3 314 B10R0.71 CCCCCCCCCCCl SBB059957 [0,2,0,0,0,0|1,0,0]=3 315 B10R0.71 CCCCCCCCCCF SBB087464 [0,2,0,0,0,0|1,0,0]=3 316 B10R0.71 CCCCCCCCCCO SBB059908 [0,2,0,0,0,0|0,0,0]=2 317 B10R0.71 CCCCCCCCCNC SBB059836 [0,2,0,0,0,0|1,0,0]=3 318 B10R0.71 CCCCCCCCN=C=O SBB068604 [0,2,0,0,0,0|0,0,1]=3 319 B10R0.71 CCCCCCCCN=C=S SBB058874 [0,2,0,0,0,0|0,1,0]=3 320 B10R0.71 CCCCCCCCNC=O SBB061176 [0,2,0,0,0,0|0,0,1]=3 321 B10R0.71 CCCCCCCCOCC SBB061155 [0,2,0,0,0,0|0,0,0]=2 322 B10R0.71 CCCCCCCOCCCl SBB060219 [0,2,0,0,0,0|1,0,0]=3 323 B10R0.71 CCCCCCCOCCO SBB060174 [0,2,0,0,0,0|0,0,0]=2 324 B10R0.71 CCCCCCCSCCO SBB019264 [0,2,0,0,0,0|0,0,0]=2 325 B10R0.71 CCCCCCNCCCC SBB059766 [0,2,0,0,0,0|1,0,0]=3 326 B10R0.71 CCCCCSCCCCC SBB060112 [0,2,0,0,0,0|1,0,0]=3 327 B10R0.71 CCCCNCCOCCO SBB059813 [0,2,0,0,0,0|0,0,0]=2 328 B10R0.71 CCCCOCCOCCCl SBB059967 [0,2,0,0,0,0|1,0,0]=3 329 B10R0.71 CCCCOCCOCCO SBB059921 [0,2,0,0,0,0|0,0,0]=2 330 B10R0.71 CCCCOCCSCCO SBB061080 [0,2,0,0,0,0|0,0,0]=2 331 B10R0.71 CCCCSCCOCCO SBB056691 [0,2,0,0,0,0|0,0,0]=2 332 B10R0.71 CCCC\C=C\CCCCO SBB008885 [0,2,0,0,0,0|0,0,0]=2 333 B10R0.71 CCSCCOCCSCC SBB057386 [0,2,0,0,0,0|2,0,0]=4 334 B10R0.71 COCCOCCOCCCl SBB061088 [0,2,0,0,0,0|2,0,0]=4 335 B10R0.71 COCCOCCOCCO SBB060942 [0,2,0,0,0,0|1,0,0]=3 336 B10R0.71 ClCCCCOCCCCCl SBB070766 [0,2,0,0,0,0|1,0,0]=3 337 B10R0.71 N#CCCCCCCCC#N SBB069581 [0,2,0,0,0,0|1,0,1]=4 338 B10R0.71 NCCCCCCCCCN SBB058794 [0,2,0,0,0,0|1,0,0]=3 339 B10R0.71 OCCCCCCCCCO SBB008482 [0,2,0,0,0,0|0,0,0]=2 340 B10R0.71 OCCSCCCSCCO SBB056734 [0,2,0,0,0,0|1,0,0]=3 341 B10R0.71 SCCCCCCCCCS SBB066560 [0,2,0,0,0,0|0,1,0]=3 342 B10R0.71 [NH2+](CCCC)CCCCCC SBB061637 [0,2,0,0,0,0|1,0,0]=3 343 B8R1.2 BrCC1CCCCO1 SBB054944 [1,0,0,1,0,0|1,0,0]=3 344 B8R1.2 BrCC1CCCNC1 SBB019055 [1,0,0,1,0,0|2,0,0]=4 345 B8R1.2 BrCC1CCOCC1 SBB054945 [1,0,0,1,0,0|2,0,0]=4 346 B8R1.2 C1(CCl)OCCCO1 SBB085954 [1,0,0,1,0,0|2,0,0]=4 347 B8R1.2 CCC1CCCCC1 SBB061162 [1,0,0,1,0,0|0,0,0]=2 348 B8R1.2 CCC1CCNCC1 SBB046379 [1,0,0,1,0,0|1,0,0]=3 349 B8R1.2 CCN1CCCCC1 SBB061409 [1,0,0,1,0,0|1,0,0]=3 350 B8R1.2 CCN1CCOCC1 SBB060634 [1,0,0,1,0,0|2,0,0]=4 351 B8R1.2 COC1CCNCC1 SBB019028 [1,0,0,1,0,0|2,0,0]=4 352 B8R1.2 ClCC1CCCCO1 SBB040653 [1,0,0,1,0,0|1,0,0]=3 353 B8R1.2 ClCC1COCCO1 SBB046611 [1,0,0,1,0,0|2,0,0]=4 354 B8R1.2 N#CC1CCCCC1 SBB008404 [1,0,0,1,0,0|1,0,1]=4 355 B8R1.2 N(C)C1CCCCC1 SBB004314 [1,0,0,1,0,0|1,0,0]=3 356 B8R1.2 N1CCCCC1CC SBB004312 [1,0,0,1,0,0|1,0,0]=3 357 B8R1.2 N1CCN(CC)CC1 SBB006719 [1,0,0,1,0,0|2,0,0]=4 358 B8R1.2 NCC1CCCCC1 SBB028193 [1,0,0,1,0,0|1,0,0]=3 359 B8R1.2 NCC1CCCCN1 SBB069774 [1,0,0,1,0,0|2,0,0]=4 360 B8R1.2 NCC1CCCCO1 SBB085471 [1,0,0,1,0,0|1,0,0]=3 361 B8R1.2 NCC1CCCOC1 SBB013821 [1,0,0,1,0,0|2,0,0]=4 362 B8R1.2 NCC1CCNCC1 SBB004305 [1,0,0,1,0,0|2,0,0]=4 363 B8R1.2 NCC1CCOCC1 SBB014254 [1,0,0,1,0,0|2,0,0]=4 364 B8R1.2 NCC1COCCO1 SBB014104 [1,0,0,1,0,0|2,0,0]=4 365 B8R1.2 OCC1CC=CCC1 SBB054865 [1,0,0,1,0,0|0,0,2]=4 366 B8R1.2 OCC1CCCCC1 SBB061328 [1,0,0,1,0,0|0,0,0]=2 367 B8R1.2 OCC1CCCCN1 SBB058544 [1,0,0,1,0,0|1,0,0]=3 368 B8R1.2 OCC1CCCCO1 SBB008943 [1,0,0,1,0,0|1,0,0]=3 369 B8R1.2 OCC1CCCOC1 SBB014200 [1,0,0,1,0,0|1,0,0]=3 370 B8R1.2 OCC1CCNCC1 SBB054833 [1,0,0,1,0,0|1,0,0]=3 371 B8R1.2 ON=C1CCCCC1 SBB058381 [1,0,0,1,0,0|1,0,1]=4 372 B8R1.5 BrC1CCCC[C@@H]1Br SBB060495 [1,0,0,1,0,0|2,0,0]=4 373 B8R1.5 CC1=C(C)CCCC1 SBB060472 [1,0,0,1,0,0|0,0,2]=4 374 B8R1.5 CC1CCCCC1=O SBB058517 [1,0,0,1,0,0|0,0,2]=4 375 B8R1.5 CC1CCCCC1N SBB061724 [1,0,0,1,0,0|1,0,0]=3 376 B8R1.5 CC1CCCCN1C SBB060747 [1,0,0,1,0,0|1,0,0]=3 377 B8R1.5 CC1CCCNC1C SBB027556 [1,0,0,1,0,0|1,0,0]=3 378 B8R1.5 CC1CNCCC1O SBB300760 [1,0,0,1,0,0|1,0,0]=3 379 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl SBB007831 [1,0,0,1,0,0|2,0,0]=4 380 B8R1.5 FC1CCCCC1Br SBB089745 [1,0,0,1,0,0|2,0,0]=4 381 B8R1.5 N[C@@H]1CCCC[C@H]1N SBB007639 [1,0,0,1,0,0|2,0,0]=4 382 B8R1.5 O[C@@H]1CCCC[C@H]1O SBB007679 [1,0,0,1,0,0|1,0,0]=3 383 B8R1.5 O[C@H]1CCCC[C@H]1O SBB007678 [1,0,0,1,0,0|1,0,0]=3 384 B8R1.8 BrCCC1OCCO1 SBB070738 [1,0,0,1,0,0|2,0,0]=4 385 B8R1.8 C=CCC1CCCC1 SBB008872 [1,0,0,1,0,0|0,0,2]=4 386 B8R1.8 CCCC1OCCO1 SBB060981 [1,0,0,1,0,0|1,0,0]=3 387 B8R1.8 CCCC1OCCS1 SBB056724 [1,0,0,1,0,0|1,0,0]=3 388 B8R1.8 COC[C@@H]1CCCN1 SBB006442 [1,0,0,1,0,0|2,0,0]=4 389 B8R1.8 ClCCN1CCCC1 SBB070714 [1,0,0,1,0,0|2,0,0]=4 390 B8R1.8 N#CCC1CCCO1 SBB018702 [1,0,0,1,0,0|1,0,1]=4 391 B8R1.8 NCCC1CCCC1 SBB072011 [1,0,0,1,0,0|1,0,0]=3 392 B8R1.8 NCCN1CCCC1 SBB004304 [1,0,0,1,0,0|2,0,0]=4 393 B8R1.8 OCCC1CCCC1 SBB008459 [1,0,0,1,0,0|0,0,0]=2 394 B8R1.8 OCCN1CCCC1 SBB060257 [1,0,0,1,0,0|1,0,0]=3 395 B8R1.8 OCCN1CCOC1 SBB008304 [1,0,0,1,0,0|2,0,0]=4 396 B8R1.11 CN1CCCC1CO SBB108833 [1,0,0,1,0,0|1,0,0]=3 397 B8R1.12 NC[C@@H]1CC[C@H]1CN SBB052512 [1,0,0,1,0,0|2,0,0]=4 398 B8R1.22 CN1CCCNCC1 SBB056191 [1,0,0,1,0,0|2,0,0]=4 399 B8R1.22 NC1CCCCCC1 SBB004311 [1,0,0,1,0,0|1,0,0]=3 400 B8R1.22 O=C1CCCCCC1 SBB060075 [1,0,0,1,0,0|0,0,2]=4 401 B8R1.22 OC1CCCCCC1 SBB061138 [1,0,0,1,0,0|0,0,0]=2 402 B8R1.36 CCCNCC1CC1 SBB042821 [1,0,0,1,0,0|1,0,0]=3 403 B8R1.49 C1=CCCCCCC1 SBB059890 [1,0,0,1,0,0|0,0,2]=4 404 B8R1.49 C1CCCNCCC1 SBB059854 [1,0,0,1,0,0|1,0,0]=3 405 B10R1.10 CC1CCCN(CCN)C1 SBB007291 [0,1,0,1,0,0|2,0,0]=4 406 B10R1.10 CCCC1CCOC(C)S1 SBB058540 [0,1,0,1,0,0|1,1,0]=4 407 B10R1.10 CCCC1OCCC(C)O1 SBB060972 [0,1,0,1,0,0|1,0,0]=3 408 B10R1.18 CC(C)NC1CCCCC1 SBB048030 [0,1,0,1,0,0|2,0,0]=4 409 B10R1.18 CC(N)CN1CCCCC1 SBB020278 [0,1,0,1,0,0|2,0,0]=4 410 B10R1.18 CC(O)CN1CCCCC1 SBB056526 [0,1,0,1,0,0|1,0,0]=3 411 B10R1.18 CC(O)CN1CCOCC1 SBB056514 [0,1,0,1,0,0|2,0,0]=4 412 B10R1.18 O=C(O)CC1CCCCC1 SBB058720 [0,1,0,1,0,0|0,0,1]=3 413 B10R1.18 O=C(O)CC1CCCCN1 SBB010294 [0,1,0,1,0,0|1,0,1]=4 414 B10R1.18 O=C(O)CC1CCCCO1 SBB002787 [0,1,0,1,0,0|1,0,1]=4 415 B10R1.18 O=C(O)CC1CCCOC1 SBB027192 [0,1,0,1,0,0|1,0,1]=4 416 B10R1.18 O=C(O)CN1CCCCC1 SBB014040 [0,1,0,1,0,0|1,0,1]=4 417 B10R1.39 CCN1CCCC1C(=O)O SBB046601 [0,1,0,1,0,0|1,0,1]=4 418 B10R1.61 CN1CCCCC1C(=O)O SBB018690 [0,1,0,1,0,0|1,0,1]=4 419 B10R1.66 CC(=O)CCC1CCCO1 SBB017110 [0,1,0,1,0,0|0,0,1]=3 420 B10R1.66 CC(C)NCC1CCCO1 SBB007165 [0,1,0,1,0,0|1,0,0]=3 421 B10R1.66 CC(O)CCC1CCCO1 SBB001585 [0,1,0,1,0,0|0,0,0]=2 422 B10R1.66 O=C(Cl)CCC1CCCC1 SBB058619 [0,1,0,1,0,0|0,0,2]=4 423 B10R1.66 O=C(O)CCC1CCCC1 SBB040565 [0,1,0,1,0,0|0,0,1]=3 424 B10R1.66 O=C(O)CCC1CCCO1 SBB014220 [0,1,0,1,0,0|1,0,1]=4 425 B10R1.66 O=C(O)CCN1CCCC1 SBB046363 [0,1,0,1,0,0|1,0,1]=4 426 B10R1.78 O=C1CCCCCCCN1 SBB058438 [0,1,0,1,0,0|0,0,2]=4 427 B10R1.348 O=C(O)C1CCCCCC1 SBB008467 [0,1,0,1,0,0|0,0,1]=3 428 B10R1.11 CN(CCN)C1CCCC1 SBB301908 [0,1,0,1,0,0|2,0,0]=4 429 B10R1.19 O=C1CCCCCN1CO SBB001697 [0,1,0,1,0,0|1,0,1]=4 430 B10R1.21 CCCCCC1OCCO1 SBB060997 [0,1,0,1,0,0|0,0,0]=2 431 B10R1.21 CCCCNC1CCCC1 SBB080103 [0,1,0,1,0,0|1,0,0]=3 432 B10R1.21 CCCNCC1CCCO1 SBB010297 [0,1,0,1,0,0|0,0,0]=2 433 B10R1.21 CCNCCN1CCCC1 SBB007481 [0,1,0,1,0,0|2,0,0]=4 434 B10R1.21 N#CCCCN1CCCC1 SBB047992 [0,1,0,1,0,0|1,0,1]=4 435 B10R1.21 NCCCCN1CCCC1 SBB010289 [0,1,0,1,0,0|1,0,0]=3 436 B10R1.29 O=C1CCCN1CCCO SBB056162 [0,1,0,1,0,0|1,0,1]=4 437 B10R1.85 CCCC1OCCCCO1 SBB060980 [0,1,0,1,0,0|0,0,0]=2 438 B10R1.85 ClCCN1CCCCCC1 SBB054974 [0,1,0,1,0,0|1,0,0]=3 439 B10R1.85 N#CCN1CCCCCC1 SBB047153 [0,1,0,1,0,0|1,0,1]=4 440 B10R1.85 NCCN1CCCCCC1 SBB046553 [0,1,0,1,0,0|1,0,0]=3 441 B10R1.85 OCCN1CCCCCC1 SBB005844 [0,1,0,1,0,0|0,0,0]=2 442 B10R1.85 OCCN1CCCNCC1 SBB056234 [0,1,0,1,0,0|1,0,0]=3 443 B10R1.138 CCCC(=O)OC[C@H]1CO1 SBB086343 [0,1,0,1,0,0|1,0,1]=4 444 B10R1.377 C=CCC1(O)CCCCC1 SBB051433 [0,1,0,1,0,0|1,0,1]=4 445 B10R1.377 NCCC1(O)CCCCC1 SBB303067 [0,1,0,1,0,0|1,0,0]=3 446 B10R1.4 CC1CCCCN1CCN SBB017916 [0,1,0,1,0,0|1,0,0]=3 447 B10R1.17 BrCCOC1CCCCO1 SBB070782 [0,1,0,1,0,0|1,0,0]=3 448 B10R1.17 C#CCNC1CCCCC1 SBB010271 [0,1,0,1,0,0|1,0,1]=4 449 B10R1.17 CCCCN1CCCCC1 SBB061043 [0,1,0,1,0,0|1,0,0]=3 450 B10R1.17 CCCCN1CCNCC1 SBB005884 [0,1,0,1,0,0|2,0,0]=4 451 B10R1.17 CCCCN1CCOCC1 SBB061034 [0,1,0,1,0,0|2,0,0]=4 452 B10R1.17 CCCOC1CCNCC1 SBB027294 [0,1,0,1,0,0|2,0,0]=4 453 B10R1.17 COCCN1CCNCC1 SBB017920 [0,1,0,1,0,0|2,0,0]=4 454 B10R1.17 ClCCCN1CCCCC1 SBB056101 [0,1,0,1,0,0|1,0,0]=3 455 B10R1.17 ClCCCN1CCOCC1 SBB054958 [0,1,0,1,0,0|2,0,0]=4 456 B10R1.17 ClCCCN1CCOCC1 SBB054959 [0,1,0,1,0,0|2,0,0]=4 457 B10R1.17 N#CCCN1CCCCC1 SBB030489 [0,1,0,1,0,0|1,0,1]=4 458 B10R1.17 N(CC=C)C1CCCCC1 SBB004174 [0,1,0,1,0,0|1,0,1]=4 459 B10R1.17 NCCCN1CCCCC1 SBB010073 [0,1,0,1,0,0|1,0,0]=3 460 B10R1.17 NCCCN1CCOCC1 SBB028271 [0,1,0,1,0,0|2,0,0]=4 461 B10R1.17 OCCCC1CCCCC1 SBB058808 [0,1,0,1,0,0|0,0,0]=2 462 B10R1.17 OCCCN1CCCCC1 SBB072687 [0,1,0,1,0,0|0,0,0]=2 463 B10R1.17 OCCNC1CCCCC1 SBB007725 [0,1,0,1,0,0|0,0,0]=2 464 B10R1.161 COC1=CCCCCCC1 SBB008525 [0,1,0,1,0,0|0,0,2]=4 465 B10R1.161 O=CC1CCCCCCC1 SBB059655 [0,1,0,1,0,0|0,0,1]=3 466 B10R1.161 OCC1CCCCCCC1 SBB051438 [0,1,0,1,0,0|0,0,0]=2 467 B10R1.1 CC1CCN(CCN)CC1 SBB007290 [0,1,0,1,0,0|2,0,0]=4 468 B10R1.1 CCCC1CCC(=O)CC1 SBB008421 [0,1,0,1,0,0|1,0,1]=4 469 B10R1.1 CCCC1CCC(O)CC1 SBB055278 [0,1,0,1,0,0|1,0,0]=3 470 B10R1.1 CCCN1CCC(N)CC1 SBB021243 [0,1,0,1,0,0|2,0,0]=4 471 B10R1.1 CN1CCC(CCN)CC1 SBB025006 [0,1,0,1,0,0|2,0,0]=4 472 B10R1.1 CN1CCN(CCO)CC1 SBB056116 [0,1,0,1,0,0|2,0,0]=4 473 B10R1.1 NCCN1CCC(O)CC1 SBB012802 [0,1,0,1,0,0|2,0,0]=4 474 B10R1.15 CC(CN)N1CCCCC1 SBB027443 [0,1,0,1,0,0|2,0,0]=4 475 B10R1.15 CC(CO)N1CCOCC1 SBB046593 [0,1,0,1,0,0|2,0,0]=4 476 B10R1.15 CCC(C)C1CCCCC1 SBB061319 [0,1,0,1,0,0|1,0,0]=3 477 B10R1.15 N\C(=N\O)C1CCCCC1 SBB079156 [0,1,0,1,0,0|1,0,1]=4 478 B10R1.27 CC(CO)CN1CCCC1 SBB046540 [0,1,0,1,0,0|1,0,0]=3 479 B10R1.27 CCC(O)CN1CCCC1 SBB061152 [0,1,0,1,0,0|2,0,0]=4 480 B10R1.27 COC(=O)CC1CCCO1 SBB014349 [0,1,0,1,0,0|1,0,1]=4 481 B10R1.172 CCN1CCCC(CN)C1 SBB012843 [0,1,0,1,0,0|2,0,0]=4 482 B10R1.232 C#CC1(O)CCCCCC1 SBB002536 [0,1,0,1,0,0|1,0,1]=4 483 B10R2.178 NC1CCC2CO[C@@H]1O2 SBB018990 [0,0,0,2,0,0|2,0,0]=4 484 B10R2.7 C1CC2CNCCN2C1 SBB006990 [0,0,0,2,0,0|2,0,0]=4 485 B10R2.7 [C@H]12CCCC[C@H]1CNC2 SBB014742 [0,0,0,2,0,0|1,0,0]=3 486 B10R2.62 C12CCN(CC1)CC2N SBB052040 [0,0,0,2,0,0|2,0,0]=4 487 B10R2.62 NC1CN2CCC1CC2 SBB000378 [0,0,0,2,0,0|2,0,0]=4 488 B10R2.62 NC1CN2CCC1CC2 SBB004248 [0,0,0,2,0,0|2,0,0]=4 489 B10R2.62 N[C@@H]1CN2CCC1CC2 SBB052036 [0,0,0,2,0,0|2,0,0]=4 490 B10R2.62 N[C@H]1CN2CCC1CC2 SBB052035 [0,0,0,2,0,0|2,0,0]=4 491 B10R2.409 C1CC2CCC1CNC2 SBB012882 [0,0,0,2,0,0|2,0,0]=4 492 B10R2.99 CCC1CC2CCC1C2 SBB060621 [0,0,0,2,0,0|1,0,0]=3 493 B10R2.99 NCC1CC2CCC1C2 SBB010246 [0,0,0,2,0,0|1,0,0]=3 494 B10R2.99 OCC1CC2CCC1C2 SBB008210 [0,0,0,2,0,0|0,0,0]=2 495 B10R2.99 O\N=C1/CC2CCC1C2 SBB038199 [0,0,0,2,0,0|1,0,1]=4 496 B10R2.483 C1CCC2(C1)OCCO2 SBB060849 [0,0,0,2,0,0|1,0,0]=3