0 B9R0.2 CCCCCCCC(=O)Cl SBB060013 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.2 CCCCCCCC(=O)O SBB060020 [0,0,0,0,0,0|1,0,1]=2 2 B9R0.2 CCCCCCCC(C)=O SBB061540 [0,0,0,0,0,0|0,0,2]=2 3 B9R0.2 CCCCCCCC(C)O SBB008521 [0,0,0,0,0,0|0,0,0]=0 4 B9R0.2 CCCCCCCC(N)=O SBB061055 [0,0,0,0,0,0|1,0,2]=3 5 B9R0.2 CCCCCCCN(C)C SBB061364 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.2 CCCCCCNC(N)=S SBB028342 [0,0,0,0,0,0|2,1,1]=4 7 B9R0.2 CCCCCCOC(C)=O SBB060306 [0,0,0,0,0,0|1,0,2]=3 8 B9R0.2 CCCCSCCC(=O)O SBB001705 [0,0,0,0,0,0|2,0,1]=3 9 B9R0.2 CCOCCOCC(C)O SBB061150 [0,0,0,0,0,0|2,0,0]=2 10 B9R0.2 COCCOCCN(C)C SBB056705 [0,0,0,0,0,0|4,0,0]=4 11 B9R0.2 NCCCCCCC(=O)O SBB072673 [0,0,0,0,0,0|2,0,1]=3 12 B9R0.2 O=C(O)CCCCCCO SBB059715 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.2 [NH2+]=C(N)SCCCCCC SBB060417 [0,0,0,0,0,0|3,0,1]=4 14 B8R0.4 C#CCCCCCCO SBB062745 [1,0,0,0,0,0|0,0,2]=3 15 B8R0.4 C=CCCCCCCC SBB060474 [1,0,0,0,0,0|0,0,2]=3 16 B8R0.4 CC#CCNCCCC SBB010247 [1,0,0,0,0,0|1,0,2]=4 17 B8R0.4 CCCCC#CCCO SBB009106 [1,0,0,0,0,0|0,0,2]=3 18 B8R0.4 CCCCCC#CCO SBB009105 [1,0,0,0,0,0|0,0,2]=3 19 B8R0.4 CCCCCCCC#N SBB060053 [1,0,0,0,0,0|1,0,1]=3 20 B8R0.4 CCCCCCCC=O SBB059871 [1,0,0,0,0,0|0,0,2]=3 21 B8R0.4 CCCCCCCCBr SBB059937 [1,0,0,0,0,0|1,0,0]=2 22 B8R0.4 CCCCCCCCCl SBB059955 [1,0,0,0,0,0|1,0,0]=2 23 B8R0.4 CCCCCCCCN SBB059986 [1,0,0,0,0,0|1,0,0]=2 24 B8R0.4 CCCCCCCCO SBB059902 [1,0,0,0,0,0|0,0,0]=1 25 B8R0.4 CCCCCCCNC SBB059820 [1,0,0,0,0,0|1,0,0]=2 26 B8R0.4 CCCCCCN=C=O SBB058614 [1,0,0,0,0,0|1,0,2]=4 27 B8R0.4 CCCCCCN=C=S SBB061289 [1,0,0,0,0,0|1,1,1]=4 28 B8R0.4 CCCCCCNC=O SBB061175 [1,0,0,0,0,0|1,0,2]=4 29 B8R0.4 CCCCCCOC=O SBB060302 [1,0,0,0,0,0|1,0,2]=4 30 B8R0.4 CCCCCCSCC SBB061179 [1,0,0,0,0,0|1,0,0]=2 31 B8R0.4 CCCCCNCCO SBB059826 [1,0,0,0,0,0|1,0,0]=2 32 B8R0.4 CCCCNCCC#N SBB017631 [1,0,0,0,0,0|2,0,1]=4 33 B8R0.4 CCCCNCCCC SBB059755 [1,0,0,0,0,0|1,0,0]=2 34 B8R0.4 CCCCNCCOC SBB056732 [1,0,0,0,0,0|2,0,0]=3 35 B8R0.4 CCCCOCCC#N SBB058573 [1,0,0,0,0,0|2,0,1]=4 36 B8R0.4 CCCCOCCCC SBB060059 [1,0,0,0,0,0|1,0,0]=2 37 B8R0.4 CCCCOCCCN SBB061718 [1,0,0,0,0,0|2,0,0]=3 38 B8R0.4 CCCCSCCCC SBB060667 [1,0,0,0,0,0|1,0,0]=2 39 B8R0.4 CCOCCOCCCl SBB060378 [1,0,0,0,0,0|3,0,0]=4 40 B8R0.4 CCOCCOCCO SBB060178 [1,0,0,0,0,0|2,0,0]=3 41 B8R0.4 CCSCCOCCO SBB061065 [1,0,0,0,0,0|2,0,0]=3 42 B8R0.4 COCCNCCOC SBB059845 [1,0,0,0,0,0|3,0,0]=4 43 B8R0.4 COCCOCCCN SBB061669 [1,0,0,0,0,0|3,0,0]=4 44 B8R0.4 C\C=C\CSCCCC SBB061594 [1,0,0,0,0,0|1,0,2]=4 45 B8R0.4 N#CCCCCCCBr SBB068343 [1,0,0,0,0,0|2,0,1]=4 46 B8R0.4 NCCCCCCCN SBB058724 [1,0,0,0,0,0|2,0,0]=3 47 B8R0.4 NCCCNCCCN SBB059777 [1,0,0,0,0,0|3,0,0]=4 48 B8R0.4 OCCCCCCCBr SBB061558 [1,0,0,0,0,0|1,0,0]=2 49 B8R0.7 C=C(C)CSCCCC SBB061593 [1,0,0,0,0,0|2,0,1]=4 50 B8R0.7 CC(C)CCCCCBr SBB054753 [1,0,0,0,0,0|2,0,0]=3 51 B8R0.7 CC(C)CNCCCO SBB301242 [1,0,0,0,0,0|3,0,0]=4 52 B8R0.7 CCCCCCC(=O)Cl SBB060012 [1,0,0,0,0,0|1,0,2]=4 53 B8R0.7 CCCCCCC(=O)O SBB053587 [1,0,0,0,0,0|1,0,1]=3 54 B8R0.7 CCCCCCC(C)=O SBB060387 [1,0,0,0,0,0|0,0,2]=3 55 B8R0.7 CCCCCCC(C)Br SBB060198 [1,0,0,0,0,0|1,0,0]=2 56 B8R0.7 CCCCCCC(C)N SBB028238 [1,0,0,0,0,0|1,0,0]=2 57 B8R0.7 CCCCCCC(C)O SBB059903 [1,0,0,0,0,0|0,0,0]=1 58 B8R0.7 CCCCCCN(C)C SBB059990 [1,0,0,0,0,0|2,0,0]=3 59 B8R0.7 CCCCCOC(C)=O SBB060027 [1,0,0,0,0,0|1,0,2]=4 60 B8R0.7 CCCCNCC(C)C SBB059764 [1,0,0,0,0,0|2,0,0]=3 61 B8R0.7 CCCCNCC(C)O SBB059782 [1,0,0,0,0,0|1,0,0]=2 62 B8R0.7 CCCCSCC(=O)O SBB061205 [1,0,0,0,0,0|2,0,1]=4 63 B8R0.7 CN(C)CCCCCN SBB008565 [1,0,0,0,0,0|3,0,0]=4 64 B8R0.7 NCCCCCC(=O)O SBB015068 [1,0,0,0,0,0|2,0,1]=4 65 B8R0.7 O=C(O)CCCCCBr SBB065783 [1,0,0,0,0,0|2,0,1]=4 66 B8R0.7 [NH2+](CCCC)CC(C)C SBB061643 [1,0,0,0,0,0|2,0,0]=3 67 B10R0.3 CC(C)CCCC(C)CC=O SBB060756 [0,1,0,0,0,0|2,0,1]=4 68 B10R0.3 CC(C)CCC[C@H](C)CCO SBB007911 [0,1,0,0,0,0|2,0,0]=3 69 B10R0.3 CCCC(=O)OCCC(C)C SBB061109 [0,1,0,0,0,0|2,0,1]=4 70 B10R0.3 CCCC(S)CCOC(C)=O SBB056433 [0,1,0,0,0,0|1,0,2]=4 71 B10R0.4 CCCCCCCCB(O)O SBB071319 [0,1,0,0,0,0|2,0,0]=3 72 B10R0.4 CCCCCCCCC(=O)Cl SBB060014 [0,1,0,0,0,0|1,0,2]=4 73 B10R0.4 CCCCCCCCC(=O)O SBB058693 [0,1,0,0,0,0|1,0,1]=3 74 B10R0.4 CCCCCCCCC(N)=O SBB061053 [0,1,0,0,0,0|1,0,2]=4 75 B10R0.4 CCCCCCCCN(C)C SBB059991 [0,1,0,0,0,0|2,0,0]=3 76 B10R0.4 CCCCCCCNC(N)=S SBB017692 [0,1,0,0,0,0|1,1,1]=4 77 B10R0.4 CCCCCCCOC(C)=O SBB060307 [0,1,0,0,0,0|0,0,2]=3 78 B10R0.4 CCCCCCNCC(C)O SBB059797 [0,1,0,0,0,0|0,0,0]=1 79 B10R0.4 CCCCOCCOC(C)=O SBB061001 [0,1,0,0,0,0|1,0,2]=4 80 B10R0.4 CN(C)CCCNCCCN SBB072006 [0,1,0,0,0,0|3,0,0]=4 81 B10R0.4 OC(=O)CCCCCCCN SBB006735 [0,1,0,0,0,0|1,0,1]=3 82 B10R0.4 [NH2+]=C(N)SCCCCCCC SBB056871 [0,1,0,0,0,0|2,0,1]=4 83 B10R0.22 CCCCCCCP(=O)(O)O SBB057478 [0,1,0,0,0,0|2,0,0]=3 84 B10R0.74 CCCCCCCC(=O)NN SBB056838 [0,1,0,0,0,0|1,0,2]=4 85 B10R0.74 CCCCCCCC(=O)OC SBB060592 [0,1,0,0,0,0|0,0,2]=3 86 B10R0.74 CCCCCCCC(C)C=O SBB061221 [0,1,0,0,0,0|0,0,1]=2 87 B10R0.74 CCCCCCNC(=O)CCl SBB017392 [0,1,0,0,0,0|1,0,2]=4 88 B10R0.74 CCCCCCOC(=O)CCl SBB061569 [0,1,0,0,0,0|1,0,2]=4 89 B10R0.74 CCCCCCOC(=O)CS SBB061229 [0,1,0,0,0,0|1,0,2]=4 90 B10R0.74 CCOCCOCC(O)CCl SBB061084 [0,1,0,0,0,0|2,0,0]=3 91 B10R0.75 CCCCCCC(=O)N(C)C SBB008017 [0,1,0,0,0,0|2,0,1]=4 92 B10R0.75 CCCCCCC(N)C(=O)O SBB058628 [0,1,0,0,0,0|1,0,1]=3 93 B10R0.78 CCCCC(C)CCC(=O)O SBB065822 [0,1,0,0,0,0|1,0,1]=3 94 B10R1.10 CC1CCCN(CCN)C1 SBB007291 [0,0,0,1,0,0|3,0,0]=4 95 B10R1.10 CCCC1CCOC(C)S1 SBB058540 [0,0,0,1,0,0|1,1,0]=3 96 B10R1.10 CCCC1OCCC(C)O1 SBB060972 [0,0,0,1,0,0|1,0,0]=2 97 B10R1.10 CNCC1CCCN(C)C1 SBB086259 [0,0,0,1,0,0|3,0,0]=4 98 B10R1.18 CC(=O)CN1CCCCC1 SBB046418 [0,0,0,1,0,0|1,0,2]=4 99 B10R1.18 CC(=O)NC1CCCCC1 SBB058211 [0,0,0,1,0,0|1,0,2]=4 100 B10R1.18 CC(=O)OC1CCCCC1 SBB060309 [0,0,0,1,0,0|1,0,2]=4 101 B10R1.18 CC(C)CN1CCNCC1 SBB046806 [0,0,0,1,0,0|3,0,0]=4 102 B10R1.18 CC(C)NC1CCCCC1 SBB048030 [0,0,0,1,0,0|2,0,0]=3 103 B10R1.18 CC(N)CN1CCCCC1 SBB020278 [0,0,0,1,0,0|2,0,0]=3 104 B10R1.18 CC(N)CN1CCOCC1 SBB017919 [0,0,0,1,0,0|3,0,0]=4 105 B10R1.18 CC(O)CN1CCCCC1 SBB056526 [0,0,0,1,0,0|1,0,0]=2 106 B10R1.18 CC(O)CN1CCOCC1 SBB056514 [0,0,0,1,0,0|2,0,0]=3 107 B10R1.18 CN(C)CC1CCCNC1 SBB085432 [0,0,0,1,0,0|3,0,0]=4 108 B10R1.18 O=C(O)CC1CCCCC1 SBB058720 [0,0,0,1,0,0|1,0,1]=3 109 B10R1.18 O=C(O)CC1CCCCN1 SBB010294 [0,0,0,1,0,0|2,0,1]=4 110 B10R1.18 O=C(O)CC1CCCCO1 SBB002787 [0,0,0,1,0,0|2,0,1]=4 111 B10R1.18 O=C(O)CC1CCCOC1 SBB027192 [0,0,0,1,0,0|2,0,1]=4 112 B10R1.18 O=C(O)CN1CCCCC1 SBB014040 [0,0,0,1,0,0|2,0,1]=4 113 B10R1.39 CCN1CCCC1C(=O)O SBB046601 [0,0,0,1,0,0|2,0,1]=4 114 B10R1.61 CN1CCCCC1C(=O)O SBB018690 [0,0,0,1,0,0|2,0,1]=4 115 B10R1.66 CC(=O)CCC1CCCO1 SBB017110 [0,0,0,1,0,0|1,0,2]=4 116 B10R1.66 CC(C)NCC1CCCO1 SBB007165 [0,0,0,1,0,0|3,0,0]=4 117 B10R1.66 CC(O)CCC1CCCO1 SBB001585 [0,0,0,1,0,0|1,0,0]=2 118 B10R1.66 O=C(Cl)CCC1CCCC1 SBB058619 [0,0,0,1,0,0|1,0,2]=4 119 B10R1.66 O=C(O)CCC1CCCC1 SBB040565 [0,0,0,1,0,0|1,0,1]=3 120 B10R1.66 O=C(O)CCC1CCCO1 SBB014220 [0,0,0,1,0,0|2,0,1]=4 121 B10R1.66 O=C(O)CCN1CCCC1 SBB046363 [0,0,0,1,0,0|2,0,1]=4 122 B10R1.78 O=C1CCCCCCCN1 SBB058438 [0,0,0,1,0,0|1,0,2]=4 123 B10R1.348 O=C(O)C1CCCCCC1 SBB008467 [0,0,0,1,0,0|1,0,1]=3 124 B7R0.1 BrCCCCCCBr SBB060205 [2,0,0,0,0,0|2,0,0]=4 125 B7R0.1 C=CCCCCCC SBB059884 [2,0,0,0,0,0|0,0,2]=4 126 B7R0.1 CCCC#CCCO SBB008799 [2,0,0,0,0,0|0,0,2]=4 127 B7R0.1 CCCCC#CCO SBB008796 [2,0,0,0,0,0|0,0,2]=4 128 B7R0.1 CCCCCCC#N SBB060052 [2,0,0,0,0,0|1,0,1]=4 129 B7R0.1 CCCCCCCBr SBB059936 [2,0,0,0,0,0|1,0,0]=3 130 B7R0.1 CCCCCCCCl SBB059954 [2,0,0,0,0,0|1,0,0]=3 131 B7R0.1 CCCCCCCN SBB059985 [2,0,0,0,0,0|1,0,0]=3 132 B7R0.1 CCCCCCOC SBB061157 [2,0,0,0,0,0|1,0,0]=3 133 B7R0.1 CCCCNCCC SBB059822 [2,0,0,0,0,0|1,0,0]=3 134 B7R0.1 CCCCOCCBr SBB007731 [2,0,0,0,0,0|2,0,0]=4 135 B7R0.1 CCCCOCCCl SBB059964 [2,0,0,0,0,0|2,0,0]=4 136 B7R0.1 CCCCOCCO SBB059918 [2,0,0,0,0,0|1,0,0]=3 137 B7R0.1 CCCCSCCN SBB072659 [2,0,0,0,0,0|2,0,0]=4 138 B7R0.1 CCCCSCCO SBB013616 [2,0,0,0,0,0|1,0,0]=3 139 B7R0.1 CCCCSCCS SBB057435 [2,0,0,0,0,0|1,1,0]=4 140 B7R0.1 CCCOCCCN SBB056585 [2,0,0,0,0,0|2,0,0]=4 141 B7R0.1 CCCSSCCC SBB058501 [2,0,0,0,0,0|2,0,0]=4 142 B7R0.1 CCNCCCCO SBB052126 [2,0,0,0,0,0|1,0,0]=3 143 B7R0.1 CCNCCNCC SBB072869 [2,0,0,0,0,0|2,0,0]=4 144 B7R0.1 COCCOCCO SBB059920 [2,0,0,0,0,0|2,0,0]=4 145 B7R0.1 COCCSCCO SBB061070 [2,0,0,0,0,0|2,0,0]=4 146 B7R0.1 C\C=C\CCCCC SBB059885 [2,0,0,0,0,0|0,0,2]=4 147 B7R0.1 ClCCCCCCCl SBB060213 [2,0,0,0,0,0|2,0,0]=4 148 B7R0.1 NCCCCCCN SBB059999 [2,0,0,0,0,0|2,0,0]=4 149 B7R0.1 NCCCNCCO SBB059810 [2,0,0,0,0,0|2,0,0]=4 150 B7R0.1 OCCCCCCBr SBB054752 [2,0,0,0,0,0|1,0,0]=3 151 B7R0.1 OCCCCCCCl SBB060188 [2,0,0,0,0,0|1,0,0]=3 152 B7R0.1 OCCCCCCN SBB006584 [2,0,0,0,0,0|1,0,0]=3 153 B7R0.1 OCCCCCCO SBB059915 [2,0,0,0,0,0|1,0,0]=3 154 B7R0.1 OCCCCCCS SBB058615 [2,0,0,0,0,0|1,0,0]=3 155 B7R0.4 CC(C)CCCCBr SBB008833 [2,0,0,0,0,0|2,0,0]=4 156 B7R0.4 CCCCCC(=O)O SBB053586 [2,0,0,0,0,0|1,0,1]=4 157 B7R0.4 CCCCCC(C)=O SBB061125 [2,0,0,0,0,0|0,0,2]=4 158 B7R0.4 CCCOCC(C)O SBB061007 [2,0,0,0,0,0|1,0,0]=3 159 B9R0.5 CCCCCC(=O)CCC SBB005828 [1,1,0,0,0,0|0,0,1]=3 160 B9R0.5 CCCCCC(=O)OCC SBB060316 [1,1,0,0,0,0|1,0,1]=4 161 B9R0.5 CCCCOC(=O)CCC SBB061107 [1,1,0,0,0,0|1,0,1]=4 162 B9R0.18 CCCCC(=O)CCCC SBB060073 [1,1,0,0,0,0|0,0,1]=3 163 B9R0.18 CCCCC(=O)OCCC SBB061228 [1,1,0,0,0,0|1,0,1]=4 164 B9R0.18 CCCCN(C)CCCC SBB061560 [1,1,0,0,0,0|1,0,0]=3 165 B9R0.18 CCCCS(=O)CCCC SBB060669 [1,1,0,0,0,0|1,0,0]=3 166 B9R0.45 BrCCCCCCCCBr SBB060805 [1,1,0,0,0,0|1,0,0]=3 167 B9R0.45 C#CCCCCCCCC SBB008883 [1,1,0,0,0,0|0,0,1]=3 168 B9R0.45 C=CCCCCCCCC SBB058674 [1,1,0,0,0,0|0,0,1]=3 169 B9R0.45 CCCCCC#CCCO SBB009142 [1,1,0,0,0,0|0,0,1]=3 170 B9R0.45 CCCCCCC#CCO SBB009144 [1,1,0,0,0,0|0,0,1]=3 171 B9R0.45 CCCCCCCCC=O SBB059872 [1,1,0,0,0,0|0,0,1]=3 172 B9R0.45 CCCCCCCCCBr SBB059939 [1,1,0,0,0,0|0,0,0]=2 173 B9R0.45 CCCCCCCCCCl SBB059956 [1,1,0,0,0,0|0,0,0]=2 174 B9R0.45 CCCCCCCCCN SBB059987 [1,1,0,0,0,0|0,0,0]=2 175 B9R0.45 CCCCCCCCCO SBB059907 [1,1,0,0,0,0|0,0,0]=2 176 B9R0.45 CCCCCCCCOC SBB061156 [1,1,0,0,0,0|0,0,0]=2 177 B9R0.45 CCCCCCCOC=O SBB060303 [1,1,0,0,0,0|0,0,2]=4 178 B9R0.45 CCCCCCNCCN SBB058822 [1,1,0,0,0,0|1,0,0]=3 179 B9R0.45 CCCCCCNCCO SBB007879 [1,1,0,0,0,0|0,0,0]=2 180 B9R0.45 CCCCCCOCCCl SBB060218 [1,1,0,0,0,0|1,0,0]=3 181 B9R0.45 CCCCCCOCCO SBB060173 [1,1,0,0,0,0|0,0,0]=2 182 B9R0.45 CCCCCCSCCO SBB060444 [1,1,0,0,0,0|0,0,0]=2 183 B9R0.45 CCCCCNCCCC SBB059765 [1,1,0,0,0,0|0,0,0]=2 184 B9R0.45 CCCCCOCCC#N SBB061167 [1,1,0,0,0,0|1,0,1]=4 185 B9R0.45 CCCCNCCOCC SBB056553 [1,1,0,0,0,0|1,0,0]=3 186 B9R0.45 CCCCSSCCCC SBB060118 [1,1,0,0,0,0|1,0,0]=3 187 B9R0.45 CCCNCCOCCO SBB059816 [1,1,0,0,0,0|1,0,0]=3 188 B9R0.45 CCCOCCOCCCl SBB061386 [1,1,0,0,0,0|2,0,0]=4 189 B9R0.45 CCSCCCCSCC SBB061079 [1,1,0,0,0,0|1,0,0]=3 190 B9R0.45 ClCCCCCCCCCl SBB008751 [1,1,0,0,0,0|1,0,0]=3 191 B9R0.45 NCCCCCCCCN SBB058725 [1,1,0,0,0,0|1,0,0]=3 192 B9R0.45 OCCCCCCCCO SBB060739 [1,1,0,0,0,0|0,0,0]=2 193 B9R0.45 OCCNCCOCCO SBB059840 [1,1,0,0,0,0|2,0,0]=4 194 B9R0.45 OCCOCCOCCCl SBB059927 [1,1,0,0,0,0|2,0,0]=4 195 B9R0.45 OCCSCCSCCO SBB059254 [1,1,0,0,0,0|2,0,0]=4 196 B9R0.45 [NH2+](CCCC)CCCCC SBB061636 [1,1,0,0,0,0|0,0,0]=2 197 B9R0.46 CCCCCCC(=O)CC SBB007744 [1,1,0,0,0,0|0,0,1]=3 198 B9R0.46 CCCCCCC(=O)OC SBB060317 [1,1,0,0,0,0|1,0,1]=4 199 B9R0.46 CCCCCCC(Cl)CCl SBB059980 [1,1,0,0,0,0|1,0,0]=3 200 B9R0.46 CCCCCOC(=O)CC SBB058817 [1,1,0,0,0,0|1,0,1]=4 201 B9R0.46 CCCCOCC(O)CC SBB061149 [1,1,0,0,0,0|1,0,0]=3 202 B9R0.46 CCCCOCC(O)CCl SBB059972 [1,1,0,0,0,0|2,0,0]=4 203 B9R0.46 CCCCOCC(O)CO SBB060185 [1,1,0,0,0,0|1,0,0]=3 204 B9R0.38 CCCCCCP(=O)(O)O SBB057477 [1,1,0,0,0,0|2,0,0]=4 205 B9R0.47 CCCCCC(Cl)C(C)Cl SBB060458 [1,1,0,0,0,0|1,0,0]=3 206 B9R0.47 CCCCOC(=O)C(C)O SBB061171 [1,1,0,0,0,0|1,0,1]=4 207 B9R0.55 CC(C)CCCCC(=O)O SBB065917 [1,1,0,0,0,0|1,0,1]=4 208 B11R0.30 CC(C)CCCCCCC(=O)O SBB088692 [0,2,0,0,0,0|1,0,1]=4 209 B11R0.40 CCCCCCCCC(=O)OC SBB060593 [0,2,0,0,0,0|0,0,2]=4 210 B11R0.40 CCCCCCCCC(Br)CBr SBB060685 [0,2,0,0,0,0|1,0,0]=3 211 B11R0.40 CCCCCCCCC(Cl)CCl SBB060507 [0,2,0,0,0,0|1,0,0]=3 212 B11R0.40 CCCCCCCOC(=O)CC SBB060313 [0,2,0,0,0,0|0,0,2]=4 213 B11R0.40 CCCCCCCOC(=O)CCl SBB061233 [0,2,0,0,0,0|0,0,2]=4 214 B11R0.40 CCCCCCCOC(=O)CS SBB057443 [0,2,0,0,0,0|0,0,2]=4 215 B11R0.40 CCCCCCOCC(O)CCl SBB059973 [0,2,0,0,0,0|0,0,0]=2 216 B11R0.40 CCCCCCOCC(O)CO SBB060186 [0,2,0,0,0,0|0,0,0]=2 217 B11R0.42 CCCCCCCC(=O)N(C)C SBB007989 [0,2,0,0,0,0|0,0,2]=4 218 B11R0.46 CCCCCC(=O)OCC(C)C SBB056802 [0,2,0,0,0,0|1,0,1]=4 219 B11R0.148 CCCCCCCCCC(=O)O SBB060022 [0,2,0,0,0,0|1,0,1]=4 220 B11R0.148 CCCCCCCCCC(C)=O SBB060389 [0,2,0,0,0,0|0,0,2]=4 221 B11R0.148 CCCCCCCCOC(C)=O SBB060585 [0,2,0,0,0,0|0,0,2]=4 222 B11R0.148 CCCCSCCCCC(=O)O SBB019267 [0,2,0,0,0,0|1,0,1]=4 223 B11R0.159 CCCCCCCC[N+](C)(C)C SBB060103 [0,2,0,0,0,0|2,0,0]=4 224 B11R0.151 CCCCCC[C@H](O)C(F)(F)F SBB090172 [0,2,0,0,0,0|2,0,0]=4 225 B11R0.4 CCCCCCCC(=O)OCC SBB061059 [0,2,0,0,0,0|0,0,2]=4 226 B11R0.164 CCCCC(CC)CCC(=O)O SBB067105 [0,2,0,0,0,0|1,0,1]=4 227 B9R1.8 BrCCC1CCCCN1 SBB018737 [1,0,0,1,0,0|2,0,0]=4 228 B9R1.8 BrCCC1OCCCO1 SBB054748 [1,0,0,1,0,0|2,0,0]=4 229 B9R1.8 CCCC1CCCCN1 SBB017578 [1,0,0,1,0,0|1,0,0]=3 230 B9R1.8 CCCC1CCCCN1 SBB050937 [1,0,0,1,0,0|1,0,0]=3 231 B9R1.8 CCCC1OCCCO1 SBB060994 [1,0,0,1,0,0|1,0,0]=3 232 B9R1.8 CCCN1CCCCC1 SBB061042 [1,0,0,1,0,0|1,0,0]=3 233 B9R1.8 CCCN1CCNCC1 SBB056132 [1,0,0,1,0,0|2,0,0]=4 234 B9R1.8 CCCN1CCOCC1 SBB061033 [1,0,0,1,0,0|2,0,0]=4 235 B9R1.8 CCOC1CCNCC1 SBB027269 [1,0,0,1,0,0|2,0,0]=4 236 B9R1.8 CCOC1CCNCC1 SBB080379 [1,0,0,1,0,0|2,0,0]=4 237 B9R1.8 CNCC1COCCO1 SBB002649 [1,0,0,1,0,0|2,0,0]=4 238 B9R1.8 COCC1CCCNC1 SBB050890 [1,0,0,1,0,0|2,0,0]=4 239 B9R1.8 ClCCN1CCCCC1 SBB056102 [1,0,0,1,0,0|2,0,0]=4 240 B9R1.8 N#CCC1CCCCO1 SBB071717 [1,0,0,1,0,0|1,0,1]=4 241 B9R1.8 N1CCN(CCC)CC1 SBB005871 [1,0,0,1,0,0|2,0,0]=4 242 B9R1.8 NCCC1CCCCC1 SBB051424 [1,0,0,1,0,0|1,0,0]=3 243 B9R1.8 NCCC1CCCCO1 SBB072556 [1,0,0,1,0,0|1,0,0]=3 244 B9R1.8 NCCC1CCCOC1 SBB050548 [1,0,0,1,0,0|2,0,0]=4 245 B9R1.8 NCCN1CCCCC1 SBB058602 [1,0,0,1,0,0|2,0,0]=4 246 B9R1.8 OCCC1CCCCN1 SBB027305 [1,0,0,1,0,0|1,0,0]=3 247 B9R1.8 OCCC1CCNCC1 SBB027320 [1,0,0,1,0,0|1,0,0]=3 248 B9R1.8 OCCN1CCCCC1 SBB040888 [1,0,0,1,0,0|1,0,0]=3 249 B9R1.8 OCCN1CCNCC1 SBB004225 [1,0,0,1,0,0|2,0,0]=4 250 B9R1.8 OCCN1CCOCC1 SBB004221 [1,0,0,1,0,0|2,0,0]=4 251 B9R1.12 CCCCN1CCCC1 SBB061041 [1,0,0,1,0,0|1,0,0]=3 252 B9R1.12 CCCNC1CCCC1 SBB080044 [1,0,0,1,0,0|1,0,0]=3 253 B9R1.12 CCNCC1CCCO1 SBB080022 [1,0,0,1,0,0|1,0,0]=3 254 B9R1.12 NCCCC1CCOC1 SBB012984 [1,0,0,1,0,0|2,0,0]=4 255 B9R1.12 NCCCN1CCCC1 SBB005799 [1,0,0,1,0,0|2,0,0]=4 256 B9R1.14 CCN1CCCC1CN SBB048031 [1,0,0,1,0,0|2,0,0]=4 257 B9R1.14 CCN1CCCC1CO SBB108758 [1,0,0,1,0,0|1,0,0]=3 258 B9R1.15 CN1CCCCC1CBr SBB018986 [1,0,0,1,0,0|2,0,0]=4 259 B9R1.15 CN1CCCCC1CCl SBB054961 [1,0,0,1,0,0|2,0,0]=4 260 B9R1.15 CN1CCCCC1CN SBB085728 [1,0,0,1,0,0|2,0,0]=4 261 B9R1.15 CN1CCCCC1CO SBB062716 [1,0,0,1,0,0|1,0,0]=3 262 B9R1.15 CN[C@H]1CCCC[C@@H]1O SBB302548 [1,0,0,1,0,0|1,0,0]=3 263 B9R1.15 CN[C@H]1CCCC[C@H]1O SBB302547 [1,0,0,1,0,0|1,0,0]=3 264 B9R1.15 O=C1CCCCC1CO SBB054864 [1,0,0,1,0,0|1,0,1]=4 265 B9R1.33 CN1CCCC1CCO SBB056164 [1,0,0,1,0,0|1,0,0]=3 266 B9R1.50 NC1CCCCCCC1 SBB004245 [1,0,0,1,0,0|1,0,0]=3 267 B9R1.50 O=C1CCCCCCC1 SBB008888 [1,0,0,1,0,0|0,0,2]=4 268 B9R1.50 OC1CCCCCCC1 SBB058905 [1,0,0,1,0,0|0,0,0]=2 269 B9R1.83 CCCCCCC1CO1 SBB017138 [1,0,0,1,0,0|0,0,0]=2 270 B9R1.83 CCCCOCC1CO1 SBB060096 [1,0,0,1,0,0|1,0,0]=3 271 B9R1.89 CCN1CCCCCC1 SBB056278 [1,0,0,1,0,0|1,0,0]=3 272 B9R1.89 CCN1CCCNCC1 SBB056277 [1,0,0,1,0,0|2,0,0]=4 273 B9R1.89 N#CC1CCCCCC1 SBB008917 [1,0,0,1,0,0|1,0,1]=4 274 B9R1.89 O=CC1CCCCCC1 SBB059644 [1,0,0,1,0,0|0,0,2]=4 275 B9R1.2 CCN1CCCC(N)C1 SBB010256 [1,0,0,1,0,0|2,0,0]=4 276 B9R1.6 CC(C)C1CCCCC1 SBB061161 [1,0,0,1,0,0|1,0,0]=3 277 B9R1.6 CN(C)C1CCCCC1 SBB060234 [1,0,0,1,0,0|2,0,0]=4 278 B9R1.6 C[C@@H](N)C1CCCCC1 SBB028230 [1,0,0,1,0,0|1,0,0]=3 279 B9R1.6 O=C(O)C1CCCCC1 SBB008550 [1,0,0,1,0,0|1,0,1]=4 280 B9R1.6 OB(O)C1CCCCC1 SBB052596 [1,0,0,1,0,0|2,0,0]=4 281 B9R1.7 CCCC1OCC(C)O1 SBB060973 [1,0,0,1,0,0|1,0,0]=3 282 B9R1.13 CC(=O)CC1CCCC1 SBB008343 [1,0,0,1,0,0|0,0,2]=4 283 B9R1.13 CC(N)CN1CCCC1 SBB014676 [1,0,0,1,0,0|2,0,0]=4 284 B9R1.13 CC(O)CN1CCCC1 SBB056722 [1,0,0,1,0,0|1,0,0]=3 285 B9R1.13 O=C(O)CC1CCCC1 SBB080711 [1,0,0,1,0,0|1,0,1]=4 286 B9R1.84 O=C(O)CCC1CCC1 SBB072391 [1,0,0,1,0,0|1,0,1]=4 287 B11R1.166 CC1CC[C@H](C(C)C)C(O)C1 SBB012356 [0,1,0,1,0,0|2,0,0]=4 288 B11R1.172 CC(N)COCC1CCCO1 SBB010416 [0,1,0,1,0,0|2,0,0]=4 289 B11R1.172 CN(C)CCNC1CCCC1 SBB050068 [0,1,0,1,0,0|2,0,0]=4 290 B11R1.172 O=C(O)CCCN1CCCC1 SBB077224 [0,1,0,1,0,0|1,0,1]=4 291 B11R1.24 CCCNC1CCCC(C)C1 SBB080101 [0,1,0,1,0,0|1,0,0]=3 292 B11R1.24 NCCCN1CCCC(O)C1 SBB017949 [0,1,0,1,0,0|1,0,0]=3 293 B11R1.86 CC(=O)CN1CCCCC1C SBB046421 [0,1,0,1,0,0|0,0,2]=4 294 B11R1.86 CC1CCCCN1CC(=O)O SBB046596 [0,1,0,1,0,0|1,0,1]=4 295 B11R1.86 CN1CCCCC1CC(=O)O SBB010391 [0,1,0,1,0,0|1,0,1]=4 296 B11R1.91 CC(C)CCN1CCNCC1 SBB046796 [0,1,0,1,0,0|2,0,0]=4 297 B11R1.91 CC(N)CCN1CCOCC1 SBB014838 [0,1,0,1,0,0|2,0,0]=4 298 B11R1.91 CN(C)CCC1CCCCN1 SBB016636 [0,1,0,1,0,0|2,0,0]=4 299 B11R1.91 CN(C)CCC1CCNCC1 SBB010376 [0,1,0,1,0,0|2,0,0]=4 300 B11R1.91 FC(F)CNC1CCCCC1 SBB046630 [0,1,0,1,0,0|2,0,0]=4 301 B11R1.91 O=C(O)CCC1CCCCN1 SBB018825 [0,1,0,1,0,0|1,0,1]=4 302 B11R1.91 O=C(O)CCC1CCCNC1 SBB014718 [0,1,0,1,0,0|1,0,1]=4 303 B11R1.99 CCCCCCCCC1CO1 SBB017139 [0,1,0,1,0,0|0,0,0]=2 304 B11R1.99 CCCCCCOCC1CO1 SBB060098 [0,1,0,1,0,0|0,0,0]=2 305 B11R1.742 CC(C)CN1CCCNCC1 SBB046514 [0,1,0,1,0,0|2,0,0]=4 306 B11R1.742 CC(O)CN1CCCCCC1 SBB056515 [0,1,0,1,0,0|0,0,0]=2 307 B11R1.742 O=C(O)CN1CCCCCC1 SBB010389 [0,1,0,1,0,0|1,0,1]=4 308 B11R1.928 O=C(O)CC1(O)CCCCC1 SBB300165 [0,1,0,1,0,0|1,0,1]=4 309 B11R1.87 CC(C)(C)[C@@H]1CCCC[C@H]1N SBB000124 [0,1,0,1,0,0|2,0,0]=4 310 B11R1.20 CC(C)CN1CCC(N)CC1 SBB024585 [0,1,0,1,0,0|2,0,0]=4 311 B11R1.20 CC(N)CN1CCC(C)CC1 SBB020375 [0,1,0,1,0,0|2,0,0]=4 312 B11R1.1 CCCCC1CCC(=O)CC1 SBB059680 [0,1,0,1,0,0|0,0,2]=4 313 B11R1.1 NCCCN1CCC(O)CC1 SBB010406 [0,1,0,1,0,0|2,0,0]=4 314 B11R1.1 [C@H]1(N)CC[C@@H](CCCC)CC1 SBB059718 [0,1,0,1,0,0|1,0,0]=3 315 B11R1.1 [C@H]1(O)CC[C@H](CCCC)CC1 SBB059708 [0,1,0,1,0,0|0,0,0]=2 316 B11R1.40 CCC(N)CN1CCCCC1 SBB017940 [0,1,0,1,0,0|2,0,0]=4 317 B11R1.40 CCC(O)CN1CCOCC1 SBB061153 [0,1,0,1,0,0|2,0,0]=4 318 B11R1.40 CNC(C)CC1CCCCC1 SBB050337 [0,1,0,1,0,0|1,0,0]=3 319 B11R1.40 C\C(CN1CCCCC1)=N/O SBB020250 [0,1,0,1,0,0|1,0,1]=4 320 B11R1.40 NC(CO)CC1CCCCC1 SBB057172 [0,1,0,1,0,0|1,0,0]=3 321 B11R1.40 NCC(O)CN1CCOCC1 SBB002800 [0,1,0,1,0,0|2,0,0]=4 322 B11R1.40 OCC(O)CN1CCOCC1 SBB058011 [0,1,0,1,0,0|2,0,0]=4 323 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 SBB067146 [0,1,0,1,0,0|1,0,1]=4 324 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 SBB058636 [0,1,0,1,0,0|1,0,1]=4 325 B11R2.484 OC12CCCC(CCC1)O2 SBB086253 [0,0,0,2,0,0|1,0,0]=3 326 B11R2.1852 O=C(O)C1C2CCCCC21 SBB010153 [0,0,0,2,0,0|1,0,1]=4 327 B11R2.845 CC(N)C1CC2CCC1C2 SBB007064 [0,0,0,2,0,0|1,0,0]=3 328 B11R2.845 O=C(O)C1CC2CCC1C2 SBB008208 [0,0,0,2,0,0|1,0,1]=4 329 B11R2.432 CN1C2CCC1CC(N)C2 SBB021746 [0,0,0,2,0,0|2,0,0]=4 330 B11R2.432 CN1[C@H]2CC[C@@H]1C[C@H](O)C2 SBB006506 [0,0,0,2,0,0|1,0,0]=3 331 B11R2.432 [C@H]12CC[C@H](CC(N)C1)N2C SBB052108 [0,0,0,2,0,0|2,0,0]=4