0 B11R1.16 C1=CC=C(C=C1)C(=O)CC#N B151981 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.16 C1=CC=C(C=C1)C(=O)CCCl C154064 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123100 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C123101 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.16 C1=CC=C(C=C1)C(CCCl)O C153387 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101338 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101343 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.16 C1=CC=C(C=C1)C(CCO)N A101349 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.16 C=CCC(C1=CC=CC=C1)O P160315 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.16 CC(C1=CC=CC=C1)N=C=O I132137 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.16 CC(C1=CC=CC=C1)N=C=O R160892 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.16 CC(C1=CC=CC=C1)N=C=S R300627 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.16 CC(CC=O)C1=CC=CC=C1 P468811 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.16 CC(CCO)C1=CC=CC=C1 P169190 [0,0,0,0,0,0|2,0,0]=2 14 B11R1.16 CC(CCO)C1=CC=CC=C1 P638679 [0,0,0,0,0,0|2,0,0]=2 15 B11R1.16 CC(CNC)C1=CC=CC=C1 P342591 [0,0,0,0,0,0|0,0,0]=0 16 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P122944 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.16 CCCC(=O)C1=CC=CC=C1 B100860 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.16 CCCC(=O)C1=CC=CC=N1 B588269 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.16 CCCC(C1=CC=CC=C1)O P160157 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.16 CCCC(C1=CC=CC=C1)O R468963 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.16 CCCC(C1=CC=CC=C1)O S468962 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.16 CCOC(=N)C1=CC=CC=C1 E170842 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103424 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103425 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.16 CCOC(=O)C1=CC=CC=C1 E103426 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 E133085 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.16 CN(CCO)C1=CC=CC=C1 M140172 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.16 CNCC(C1=CC=CC=C1)O M351446 [0,0,0,0,0,0|1,0,0]=1 29 B11R1.16 CNOC(=O)C1=CC=CC=C1 O159914 [0,0,0,0,0,0|2,0,1]=3 30 B11R1.16 COCC(C1=CC=CC=C1)N R185788 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.15 C#CC(C1=CC=CC=C1)O P107039 [1,0,0,0,0,0|1,0,2]=4 32 B10R1.15 C1=CC=C(C=C1)C(=O)CBr B103328 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.15 C1=CC=C(C=C1)C(=O)CBr B131582 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.15 C1=CC=C(C=C1)C(=O)CCl C475739 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.15 C1=CC=C(C=C1)C(=O)CN A123237 [1,0,0,0,0,0|1,0,1]=3 36 B10R1.15 C1=CC=C(C=C1)C(=O)CO H102370 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.15 C1=CC=C(C=C1)C(=O)NN B104697 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.15 C1=CC=C(C=C1)C(=O)NO B152659 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.15 C1=CC=C(C=C1)C(=O)N[O-] S161112 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.15 C1=CC=C(C=C1)C(C#N)N P170863 [1,0,0,0,0,0|1,0,2]=4 41 B10R1.15 C1=CC=C(C=C1)C(CBr)Br D304999 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.15 C1=CC=C(C=C1)C(CBr)O B192257 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.15 C1=CC=C(C=C1)C(CCl)O R304018 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.15 C1=CC=C(C=C1)C(CCl)O S304439 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.15 C1=CC=C(C=C1)C(CN)O A102440 [1,0,0,0,0,0|1,0,0]=2 46 B10R1.15 C1=CC=C(C=C1)C(CN)O A151123 [1,0,0,0,0,0|1,0,0]=2 47 B10R1.15 C1=CC=C(C=C1)C(CN)O R138565 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.15 C1=CC=C(C=C1)C(CO)N P109343 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.15 C1=CC=C(C=C1)C(CO)N P117139 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.15 C1=CC=C(C=C1)C(CO)N P160161 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.15 C1=CC=C(C=C1)C(CO)O P100518 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.15 C1=CC=C(C=C1)C(CO)O P100519 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.15 C1=CC=C(C=C1)C(CO)O P112689 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.15 C=CC(C1=CC=CC=C1)Cl V303368 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.15 C=CC(C1=CC=CC=C1)O V189138 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.15 CC(=NO)C1=CC=CC=C1 A151383 [1,0,0,0,0,0|1,0,2]=4 57 B10R1.15 CC(=NO)C1=CC=CC=C1 A467913 [1,0,0,0,0,0|1,0,2]=4 58 B10R1.15 CC(C#N)C1=CC=CC=C1 M468313 [1,0,0,0,0,0|0,0,2]=3 59 B10R1.15 CC(C1=CC=CC=C1)NC I168221 [1,0,0,0,0,0|0,0,0]=1 60 B10R1.15 CC(C1=CC=CC=C1)NC I171118 [1,0,0,0,0,0|0,0,0]=1 61 B10R1.15 CC(C1=CC=CC=C1)NC I286935 [1,0,0,0,0,0|0,0,0]=1 62 B10R1.15 CC(C1=CC=CC=C1)[N+]#[C-] B300007 [1,0,0,0,0,0|0,0,2]=3 63 B10R1.15 CC(C=O)C1=CC=CC=C1 P160754 [1,0,0,0,0,0|1,0,1]=3 64 B10R1.15 CC(CN)C1=CC=CC=C1 P191947 [1,0,0,0,0,0|0,0,0]=1 65 B10R1.15 CC(CN)C1=CC=CC=C1 R160849 [1,0,0,0,0,0|0,0,0]=1 66 B10R1.15 CC(CO)C1=CC=CC=C1 P160710 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.15 CC(CO)C1=CC=CC=C1 R489486 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.15 CCC(=C)C1=CC=CC=C1 B302726 [1,0,0,0,0,0|0,0,2]=3 69 B10R1.15 CCC(=O)C1=CN=CC=C1 P131764 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.15 CCC(C)C1=CC=CC=C1 B100253 [1,0,0,0,0,0|0,0,0]=1 71 B10R1.15 CCC(C)C1=CC=CC=C1 B100254 [1,0,0,0,0,0|0,0,0]=1 72 B10R1.15 CCC(C)C1=CC=CC=C1 B128164 [1,0,0,0,0,0|0,0,0]=1 73 B10R1.15 CCC(C1=CC=CC=C1)N E334013 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.15 CCC(C1=CC=CC=C1)N R138647 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.15 CCC(C1=CC=CC=C1)N R639496 [1,0,0,0,0,0|1,0,0]=2 76 B10R1.15 CCC(C1=CC=CC=C1)N S135110 [1,0,0,0,0,0|1,0,0]=2 77 B10R1.15 CCC(C1=CC=CC=C1)O P107008 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.15 CCC(C1=CC=CC=C1)O R138307 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.15 CCC(C1=CC=CC=C1)O S161360 [1,0,0,0,0,0|1,0,0]=2 80 B10R1.15 CCC(C1=CC=CC=N1)N P586083 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.15 CCN(C)C1=CC=CC=C1 N589658 [1,0,0,0,0,0|1,0,0]=2 82 B10R1.15 CN(C1=CC=CC=C1)N=O N134509 [1,0,0,0,0,0|2,0,1]=4 83 B10R1.15 CN(C=O)C1=CC=CC=C1 M106700 [1,0,0,0,0,0|2,0,1]=4 84 B10R1.15 CNC(=O)C1=CC=CC=C1 N304144 [1,0,0,0,0,0|1,0,1]=3 85 B10R1.15 CNC(=O)C1=CN=CC=C1 N159805 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.15 CNC(=O)C1=CN=CC=C1 N420708 [1,0,0,0,0,0|2,0,1]=4 87 B10R1.15 COC(=N)C1=CC=CC=C1 M158319 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.15 COC(=O)C1=CC=CC=C1 M108588 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.15 COC(=O)C1=CC=CC=C1 M108589 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.15 COC(=O)C1=CC=CC=C1 M108590 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.15 COC(=O)C1=CC=CC=C1 M108591 [1,0,0,0,0,0|2,0,1]=4 92 B10R1.15 COC(=O)C1=CC=CC=C1 M282394 [1,0,0,0,0,0|2,0,1]=4 93 B10R1.15 COS(=O)C1=CC=CC=C1 M158264 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.15 C[C@H](CO)C1=CC=CC=C1 S489449 [1,0,0,0,0,0|1,0,0]=2 95 B10R1.15 C\C=C(\C)/C1=CC=CC=C1 C348081 [1,0,0,0,0,0|0,0,2]=3 96 B10R1.17 C#CCCC1=CC=CC=C1 P160653 [1,0,0,0,0,0|1,0,1]=3 97 B10R1.17 C#CCOC1=CC=CC=C1 P113824 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.17 C#CCSC1=CC=CC=C1 P101830 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.17 C1=CC=C(C=C1)CCC#N P160077 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.17 C1=CC=C(C=C1)CCC=O P109695 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.17 C1=CC=C(C=C1)CCCBr B106986 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.17 C1=CC=C(C=C1)CCCCl C122445 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.17 C1=CC=C(C=C1)CCCI I469194 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.17 C1=CC=C(C=C1)CCCN P109694 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.17 C1=CC=C(C=C1)CCCN P292870 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.17 C1=CC=C(C=C1)CCCO P103663 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.17 C1=CC=C(C=C1)CCNN P132003 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.17 C1=CC=C(C=C1)CCNN P421872 [1,0,0,0,0,0|1,0,0]=2 109 B10R1.17 C1=CC=C(C=C1)CN=C=O B133636 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.17 C1=CC=C(C=C1)CN=C=S B140288 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.17 C1=CC=C(C=C1)CN=C=S B425154 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.17 C1=CC=C(C=C1)CN=[N+]=[N-] B189174 [1,0,0,0,0,0|2,0,1]=4 113 B10R1.17 C1=CC=C(C=C1)CNC=O N159287 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.17 C1=CC=C(C=C1)COC=O B152855 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.17 C1=CC=C(C=C1)COCCl B107578 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.17 C1=CC=C(C=C1)CSC#N B152183 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.17 C1=CC=C(C=C1)NCC#N P192616 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.17 C1=CC=C(C=C1)NCCN N159346 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.17 C1=CC=C(C=C1)NCCO N140440 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.17 C1=CC=C(C=C1)OCC#N P160111 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.17 C1=CC=C(C=C1)OCCBr B100876 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.17 C1=CC=C(C=C1)OCCCl B135225 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.17 C1=CC=C(C=C1)OCCN P132517 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.17 C1=CC=C(C=C1)OCCO E109367 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.17 C1=CC=C(C=C1)OCCO E109368 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.17 C1=CC=C(C=C1)OCCO E109369 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.17 C1=CC=C(C=C1)OCCO E109370 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.17 C1=CC=C(C=C1)OCCO P407596 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.17 C1=CC=C(C=C1)SCC#N P160109 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.17 C1=CC=C(C=C1)SCCBr B152504 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.17 C1=CC=C(C=C1)SCCCl C101832 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.17 C1=CC=C(C=C1)SCCO P101545 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.17 C1=CC=NC(=C1)CCCO P133143 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.17 C1=CN=CC=C1CCCN P192638 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.17 C1=CN=CC=C1CCCO P160633 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.17 C=CCCC1=CC=CC=C1 P160313 [1,0,0,0,0,0|1,0,1]=3 137 B10R1.17 C=CCNC1=CC=CC=C1 N159240 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.17 C=CCOC1=CC=CC=C1 A101096 [1,0,0,0,0,0|2,0,1]=4 139 B10R1.17 C=CCSC1=CC=CC=C1 A140290 [1,0,0,0,0,0|2,0,1]=4 140 B10R1.17 C=COCC1=CC=CC=C1 B178307 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.17 CCC#CC1=CC=CC=C1 P107031 [1,0,0,0,0,0|1,0,2]=4 142 B10R1.17 CCCCC1=CC=CC=C1 B100020 [1,0,0,0,0,0|1,0,0]=2 143 B10R1.17 CCCCC1=CC=CC=C1 B100021 [1,0,0,0,0,0|1,0,0]=2 144 B10R1.17 CCCCC1=CC=CC=C1 B128171 [1,0,0,0,0,0|1,0,0]=2 145 B10R1.17 CCCCC1=CN=CC=C1 B115782 [1,0,0,0,0,0|2,0,0]=3 146 B10R1.17 CCCC[N+]1=CC=CC=C1 B101511 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.17 CCCC[N+]1=CC=CC=C1 B102654 [1,0,0,0,0,0|2,0,0]=3 148 B10R1.17 CCCC[N+]1=CC=CC=C1 B102663 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.17 CCCC[N+]1=CC=CC=C1 B120504 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.17 CCCOC1=CC=CC=C1 P405762 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.17 CCNCC1=CC=CC=C1 E113368 [1,0,0,0,0,0|2,0,0]=3 152 B10R1.17 CCNCC1=CC=CC=N1 N170728 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.17 CCNCC1=CC=CC=N1 N598953 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.17 CCNCC1=CC=NC=C1 E124679 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.17 CCOCC1=CC=CC=C1 E193820 [1,0,0,0,0,0|2,0,0]=3 156 B10R1.17 CNCCC1=CC=CC=C1 N159074 [1,0,0,0,0,0|0,0,0]=1 157 B10R1.17 CNCCC1=CC=CC=N1 B102783 [1,0,0,0,0,0|1,0,0]=2 158 B10R1.17 CNCCC1=CC=CC=N1 B152161 [1,0,0,0,0,0|1,0,0]=2 159 B10R1.17 CNCCC1=CC=CC=N1 B301305 [1,0,0,0,0,0|1,0,0]=2 160 B10R1.17 CNCCC1=CC=CC=N1 B424673 [1,0,0,0,0,0|1,0,0]=2 161 B10R1.17 CNCCC1=CC=CC=N1 M424771 [1,0,0,0,0,0|1,0,0]=2 162 B10R1.17 COCCC1=CC=CC=C1 P160567 [1,0,0,0,0,0|1,0,0]=2 163 B10R1.17 COCCC1=CC=CC=N1 M157981 [1,0,0,0,0,0|2,0,0]=3 164 B10R1.17 COCSC1=CC=CC=C1 M158419 [1,0,0,0,0,0|2,0,0]=3 165 B12R1.3 CCN(CCO)C1=CC=CC=C1 E140165 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.16 C=CCC(C1=CC=C(C=C1)Cl)O C468752 [0,1,0,0,0,0|2,0,1]=4 167 B12R1.16 CCCC(=O)C1=CC=C(C=C1)Cl C154065 [0,1,0,0,0,0|2,0,1]=4 168 B12R1.16 CCCC(=O)C1=CC=C(C=C1)F F194057 [0,1,0,0,0,0|2,0,1]=4 169 B12R1.16 CCCC(=O)C1=CC=C(C=C1)O H156888 [0,1,0,0,0,0|2,0,1]=4 170 B12R1.16 CNCC(C1=CC=C(C=C1)O)O S107339 [0,1,0,0,0,0|1,0,0]=2 171 B12R1.16 CNCC(C1=CC=C(C=C1)O)O S107340 [0,1,0,0,0,0|1,0,0]=2 172 B12R1.16 CNCC(C1=CC=C(C=C1)O)O S129817 [0,1,0,0,0,0|1,0,0]=2 173 B12R1.16 CNCC(C1=CC=C(C=C1)O)O S161302 [0,1,0,0,0,0|1,0,0]=2 174 B12R1.16 CNCC(C1=CC=C(C=C1)O)O S427007 [0,1,0,0,0,0|1,0,0]=2 175 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 S408033 [0,1,0,0,0,0|1,0,0]=2 176 B12R1.17 C1=CC(=CC(=C1)Cl)C(CCO)N A194578 [0,1,0,0,0,0|3,0,0]=4 177 B12R1.17 CNCC(C1=CC(=CC=C1)O)O P106007 [0,1,0,0,0,0|1,0,0]=2 178 B12R1.17 CNCC(C1=CC(=CC=C1)O)O S161304 [0,1,0,0,0,0|1,0,0]=2 179 B12R1.17 CNCC(O)C1=CC(=CC=C1)O P408457 [0,1,0,0,0,0|1,0,0]=2 180 B12R1.30 CCCCC(=O)C1=CC=CC=C1 V107009 [0,1,0,0,0,0|2,0,1]=4 181 B12R1.30 CCCCC(C1=CC=CC=C1)O P160160 [0,1,0,0,0,0|2,0,0]=3 182 B12R1.30 CCCCC(C1=CC=CC=C1)O P424881 [0,1,0,0,0,0|2,0,0]=3 183 B12R1.30 CCCOC(=O)C1=CC=CC=C1 P160151 [0,1,0,0,0,0|2,0,1]=4 184 B12R1.30 CN(CCC#N)C1=CC=CC=C1 N158975 [0,1,0,0,0,0|2,0,1]=4 185 B12R1.30 CN(CCCN)C1=CC=CC=C1 N158989 [0,1,0,0,0,0|2,0,0]=3 186 B12R1.30 CNCCC(C1=CC=CC=C1)O A136323 [0,1,0,0,0,0|1,0,0]=2 187 B12R1.34 C1=CC=C(C=C1)C(C(CO)N)O A115269 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.34 CC(C1=CC=CC=C1)C(=O)OC M588693 [0,1,0,0,0,0|1,0,1]=3 189 B12R1.34 COC(=O)C(C1=CC=CC=C1)Br M158188 [0,1,0,0,0,0|2,0,1]=4 190 B12R1.34 COC(=O)C(C1=CC=CC=C1)N H191065 [0,1,0,0,0,0|2,0,1]=4 191 B12R1.34 COC(=O)C(C1=CC=CC=C1)N I132644 [0,1,0,0,0,0|2,0,1]=4 192 B12R1.34 COC(=O)C(C1=CC=CC=C1)N P106203 [0,1,0,0,0,0|2,0,1]=4 193 B12R1.34 COC(=O)C(C1=CC=CC=C1)N P106204 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.34 COC(=O)C(C1=CC=CC=C1)O M107081 [0,1,0,0,0,0|2,0,1]=4 195 B12R1.34 COC(=O)C(C1=CC=CC=C1)O M107988 [0,1,0,0,0,0|2,0,1]=4 196 B12R1.34 COC(=O)C(C1=CC=CC=C1)O M107989 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.39 CC(CC=C)(C1=CC=CC=C1)O P133854 [0,1,0,0,0,0|1,0,1]=3 198 B12R1.39 CCO[Si](C)(C)C1=CC=CC=C1 E168078 [0,1,0,0,0,0|2,1,0]=4 199 B12R1.39 CSCS(=O)(=O)C1=CC=CC=C1 M349452 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N P113810 [0,1,0,0,0,0|3,0,0]=4 201 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N R160918 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)N S193296 [0,1,0,0,0,0|3,0,0]=4 203 B12R1.107 C1=CC=C(C=C1)C(CC(=O)O)O H157337 [0,1,0,0,0,0|3,0,0]=4 204 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 B103859 [0,1,0,0,0,0|2,0,1]=4 205 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 I157669 [0,1,0,0,0,0|2,0,1]=4 206 B12R1.107 CC(C1=CC=CC=C1)NC(=O)C D303544 [0,1,0,0,0,0|2,0,0]=3 207 B12R1.107 CC(C1=CC=CC=C1)OC(=O)C P195955 [0,1,0,0,0,0|2,0,0]=3 208 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 P133853 [0,1,0,0,0,0|2,0,0]=3 209 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 M192082 [0,1,0,0,0,0|3,0,0]=4 210 B12R1.308 CCCC(=O)C1=CC=CC=C1O H192549 [0,1,0,0,0,0|2,0,1]=4 211 B12R2.2 C1CC(=NC1)C2=CC=CC=C2 P341771 [0,0,0,1,0,0|2,0,1]=4 212 B12R2.2 C1CC(NC1)C2=CC=CC=C2 P345688 [0,0,0,1,0,0|2,0,0]=3 213 B12R2.2 C1CC(NC1)C2=CC=CC=C2 R176807 [0,0,0,1,0,0|2,0,0]=3 214 B12R2.2 C1CC(NC1)C2=CN=CC=C2 N113829 [0,0,0,1,0,0|3,0,0]=4 215 B12R2.2 C1CCN(C1)C2=CC=CC=C2 P332600 [0,0,0,1,0,0|2,0,0]=3 216 B12R2.2 C1CCN(C1)C2=CC=NC=C2 P121075 [0,0,0,1,0,0|3,0,0]=4 217 B12R2.2 C1CSC(S1)C2=CC=CC=C2 P404945 [0,0,0,1,0,0|3,0,0]=4 218 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T102999 [0,0,0,1,0,0|2,0,0]=3 219 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113718 [0,0,0,1,0,0|2,0,0]=3 220 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T113722 [0,0,0,1,0,0|2,0,0]=3 221 B12R2.1081 C1CC(C2=CC=CC=C2C1)N T401554 [0,0,0,1,0,0|2,0,0]=3 222 B12R2.1081 C1CC(C2=CC=CC=C2C1)O R160835 [0,0,0,1,0,0|2,0,0]=3 223 B12R2.1081 C1CC(C2=CC=CC=C2C1)O S161373 [0,0,0,1,0,0|2,0,0]=3 224 B12R2.1081 C1CC(C2=CC=CC=C2C1)O T161537 [0,0,0,1,0,0|2,0,0]=3 225 B12R2.1081 C1CC2=CC=CC=C2C(=O)C1 T106838 [0,0,0,1,0,0|2,0,1]=4 226 B12R2.1081 CC1C2=CC=CC=C2CCN1 M193575 [0,0,0,1,0,0|2,0,0]=3 227 B12R2.1081 CC1CNCC2=CC=CC=C12 P165923 [0,0,0,1,0,0|0,0,0]=1 228 B12R2.2028 C1C(C2=CC=CC=C2C1=O)Br B184388 [0,0,0,1,0,0|3,0,0]=4 229 B12R2.2028 CC1CC(=O)C2=CC=CC=C12 M123327 [0,0,0,1,0,0|2,0,0]=3 230 B12R2.2028 CN1C2=CC=CC=C2C(=N1)Br B169582 [0,0,0,1,0,0|2,0,1]=4 231 B12R2.2028 CN1C=[N+](C2=CC=CC=C21)C D487249 [0,0,0,1,0,0|1,0,1]=3 232 B12R2.2075 C1CC1C(=O)C2=CC=CC=C2 C136569 [0,0,0,1,0,0|2,0,1]=4 233 B12R2.2075 C1CC1C(C2=CC=CC=C2)N C489506 [0,0,0,1,0,0|2,0,0]=3 234 B12R2.2075 C1CC1C(C2=CC=CC=C2)N R190868 [0,0,0,1,0,0|2,0,0]=3 235 B12R2.2075 C1CC1C(C2=CC=CC=C2)N S489510 [0,0,0,1,0,0|2,0,0]=3 236 B12R2.2075 C1CC1C(C2=CC=CC=C2)O A151682 [0,0,0,1,0,0|2,0,0]=3 237 B12R1.32 CN(CC#C)CC1=CC=CC=C1 N159008 [0,0,0,0,0,1|2,0,1]=4 238 B12R1.32 CN(CC#C)CC1=CC=CC=C1 P105535 [0,0,0,0,0,1|2,0,1]=4 239 B12R1.32 CN(CC#C)CC1=CC=CC=C1 P423169 [0,0,0,0,0,1|2,0,1]=4 240 B12R1.32 CN(CCO)CC1=CC=CC=C1 M134243 [0,0,0,0,0,1|3,0,0]=4 241 B9R0.45 CCCCC=CC=CC=O N102611 [1,0,1,0,0,0|2,0,0]=4 242 B9R1.6 C1=CC=C(C=C1)C(=N)N B100938 [2,0,0,0,0,0|1,0,1]=4 243 B9R1.6 C1=CC=C(C=C1)C(=N)N B100967 [2,0,0,0,0,0|1,0,1]=4 244 B9R1.6 C1=CC=C(C=C1)C(=N)N B349126 [2,0,0,0,0,0|1,0,1]=4 245 B9R1.6 C1=CC=C(C=C1)C(=N)N B422069 [2,0,0,0,0,0|1,0,1]=4 246 B9R1.6 C1=CC=C(C=C1)C(=O)N B110551 [2,0,0,0,0,0|1,0,1]=4 247 B9R1.6 C1=CC=C(C=C1)C(=O)N B110552 [2,0,0,0,0,0|1,0,1]=4 248 B9R1.6 C1=CC=C(C=C1)C(=O)N B118608 [2,0,0,0,0,0|1,0,1]=4 249 B9R1.6 C1=CC=C(C=C1)C(=S)N T111125 [2,0,0,0,0,0|1,0,1]=4 250 B9R1.6 C1=CC=C(C=C1)C(Br)Br D300412 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.6 C1=CC=C(C=C1)C(F)F D404169 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.6 CC(=C)C1=CC=CC=C1 M104900 [2,0,0,0,0,0|0,0,2]=4 253 B9R1.6 CC(=C)C1=CC=CC=C1 M104901 [2,0,0,0,0,0|0,0,2]=4 254 B9R1.6 CC(=C)C1=CC=CC=C1 P347730 [2,0,0,0,0,0|0,0,2]=4 255 B9R1.6 CC(=C)C1=CC=CC=C1 P491419 [2,0,0,0,0,0|0,0,2]=4 256 B9R1.6 CC(=O)C1=CC=CC=C1 A103666 [2,0,0,0,0,0|1,0,1]=4 257 B9R1.6 CC(=O)C1=CC=CC=C1 A103667 [2,0,0,0,0,0|1,0,1]=4 258 B9R1.6 CC(=O)C1=CC=CC=C1 A103669 [2,0,0,0,0,0|1,0,1]=4 259 B9R1.6 CC(=O)C1=CC=CC=C1 A427211 [2,0,0,0,0,0|1,0,1]=4 260 B9R1.6 CC(=O)C1=CC=CC=C1 A471960 [2,0,0,0,0,0|1,0,1]=4 261 B9R1.6 CC(=O)C1=CC=CC=C1 A474131 [2,0,0,0,0,0|1,0,1]=4 262 B9R1.6 CC(=O)C1=CC=CC=C1 A474138 [2,0,0,0,0,0|1,0,1]=4 263 B9R1.6 CC(C)C1=CC=CC=C1 I101049 [2,0,0,0,0,0|0,0,0]=2 264 B9R1.6 CC(C)C1=CC=CC=C1 I101050 [2,0,0,0,0,0|0,0,0]=2 265 B9R1.6 CC(C)C1=CC=CC=C1 I101052 [2,0,0,0,0,0|0,0,0]=2 266 B9R1.6 CC(C)C1=CC=CC=N1 I177046 [2,0,0,0,0,0|1,0,0]=3 267 B9R1.6 CC(C)C1=CC=NC=C1 I136834 [2,0,0,0,0,0|1,0,0]=3 268 B9R1.6 CC(C1=CC=CC=C1)Br B104540 [2,0,0,0,0,0|1,0,0]=3 269 B9R1.6 CC(C1=CC=CC=C1)Cl C107586 [2,0,0,0,0,0|1,0,0]=3 270 B9R1.6 CC(C1=CC=CC=C1)N M105678 [2,0,0,0,0,0|0,0,0]=2 271 B9R1.6 CC(C1=CC=CC=C1)N M105679 [2,0,0,0,0,0|0,0,0]=2 272 B9R1.6 CC(C1=CC=CC=C1)N M106714 [2,0,0,0,0,0|0,0,0]=2 273 B9R1.6 CC(C1=CC=CC=C1)N M141280 [2,0,0,0,0,0|0,0,0]=2 274 B9R1.6 CC(C1=CC=CC=C1)N R432669 [2,0,0,0,0,0|0,0,0]=2 275 B9R1.6 CC(C1=CC=CC=C1)N R432670 [2,0,0,0,0,0|0,0,0]=2 276 B9R1.6 CC(C1=CC=CC=C1)N R432682 [2,0,0,0,0,0|0,0,0]=2 277 B9R1.6 CC(C1=CC=CC=C1)N S135224 [2,0,0,0,0,0|0,0,0]=2 278 B9R1.6 CC(C1=CC=CC=C1)N S432505 [2,0,0,0,0,0|0,0,0]=2 279 B9R1.6 CC(C1=CC=CC=C1)O P100878 [2,0,0,0,0,0|1,0,0]=3 280 B9R1.6 CC(C1=CC=CC=C1)O P103660 [2,0,0,0,0,0|1,0,0]=3 281 B9R1.6 CC(C1=CC=CC=C1)O P113820 [2,0,0,0,0,0|1,0,0]=3 282 B9R1.6 CC(C1=CC=CC=C1)O P165285 [2,0,0,0,0,0|1,0,0]=3 283 B9R1.6 CC(C1=CC=CC=N1)N P589080 [2,0,0,0,0,0|1,0,0]=3 284 B9R1.6 CC(C1=CC=CC=N1)O P191765 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.6 CC(C1=CC=CC=N1)O R404547 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.6 CC(C1=CC=CC=N1)O S161029 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.6 CC(C1=CC=NC=C1)N A467309 [2,0,0,0,0,0|1,0,0]=3 288 B9R1.6 CC(C1=CC=NC=C1)O I170921 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.6 CC(C1=CC=NC=C1)O R192493 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.6 CC(C1=CN=CC=C1)N P193948 [2,0,0,0,0,0|1,0,0]=3 291 B9R1.6 CN(C)C1=CC=CC=C1 D100060 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.6 CN(C)C1=CC=CC=C1 D100061 [2,0,0,0,0,0|1,0,0]=3 293 B9R1.6 CN(C)C1=CC=CC=C1 D100063 [2,0,0,0,0,0|1,0,0]=3 294 B9R1.6 CN(C)C1=CC=CC=N1 D154133 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.6 CN(C)C1=CC=NC=C1 C405558 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.6 CN(C)C1=CC=NC=C1 D109207 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.6 CN(C)C1=CC=NC=C1 D155582 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.6 CN(C1=CC=CC=C1)N M298692 [2,0,0,0,0,0|1,0,0]=3 299 B9R1.6 CP(C)C1=CC=CC=C1 C118698 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.6 CP(C)C1=CC=CC=C1 D115603 [2,0,0,0,0,0|1,0,0]=3 301 B9R1.6 CS(=O)C1=CC=CC=C1 M158079 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.6 CS(=O)C1=CC=CC=C1 M464276 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.6 C[Si](=O)C1=CC=CC=C1 P331251 [2,0,0,0,0,0|1,1,0]=4 304 B9R1.6 C[Si](C)C1=CC=CC=C1 D111809 [2,0,0,0,0,0|0,1,0]=3 305 B9R1.6 C[Si](C)C1=CC=CC=N1 D331179 [2,0,0,0,0,0|1,1,0]=4 306 B9R1.8 C1=CC(=CN=C1)CCN A151786 [2,0,0,0,0,0|1,0,0]=3 307 B9R1.8 C1=CC(=CN=C1)CCN A169450 [2,0,0,0,0,0|1,0,0]=3 308 B9R1.8 C1=CC=C(C=C1)C=NN B589372 [2,0,0,0,0,0|1,0,1]=4 309 B9R1.8 C1=CC=C(C=C1)CC=O P105078 [2,0,0,0,0,0|1,0,1]=4 310 B9R1.8 C1=CC=C(C=C1)CC=O P105080 [2,0,0,0,0,0|1,0,1]=4 311 B9R1.8 C1=CC=C(C=C1)CC=O P420978 [2,0,0,0,0,0|1,0,1]=4 312 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [2,0,0,0,0,0|1,0,0]=3 313 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [2,0,0,0,0,0|1,0,0]=3 314 B9R1.8 C1=CC=C(C=C1)CCI I138375 [2,0,0,0,0,0|1,0,0]=3 315 B9R1.8 C1=CC=C(C=C1)CCN P105641 [2,0,0,0,0,0|0,0,0]=2 316 B9R1.8 C1=CC=C(C=C1)CCN P160641 [2,0,0,0,0,0|0,0,0]=2 317 B9R1.8 C1=CC=C(C=C1)CCN P290339 [2,0,0,0,0,0|0,0,0]=2 318 B9R1.8 C1=CC=C(C=C1)CCN P408003 [2,0,0,0,0,0|0,0,0]=2 319 B9R1.8 C1=CC=C(C=C1)CCN P421867 [2,0,0,0,0,0|0,0,0]=2 320 B9R1.8 C1=CC=C(C=C1)CCN P425250 [2,0,0,0,0,0|0,0,0]=2 321 B9R1.8 C1=CC=C(C=C1)CCN P491880 [2,0,0,0,0,0|0,0,0]=2 322 B9R1.8 C1=CC=C(C=C1)CCN P493037 [2,0,0,0,0,0|0,0,0]=2 323 B9R1.8 C1=CC=C(C=C1)CCN P493125 [2,0,0,0,0,0|0,0,0]=2 324 B9R1.8 C1=CC=C(C=C1)CCO P108195 [2,0,0,0,0,0|1,0,0]=3 325 B9R1.8 C1=CC=C(C=C1)CCO P108197 [2,0,0,0,0,0|1,0,0]=3 326 B9R1.8 C1=CC=C(C=C1)CCO P424995 [2,0,0,0,0,0|1,0,0]=3 327 B9R1.8 C1=CC=C(C=C1)CCS P160530 [2,0,0,0,0,0|1,0,0]=3 328 B9R1.8 C1=CC=C(C=C1)CNN B122576 [2,0,0,0,0,0|1,0,0]=3 329 B9R1.8 C1=CC=C(C=C1)CNN B137990 [2,0,0,0,0,0|1,0,0]=3 330 B9R1.8 C1=CC=C(C=C1)CNN B464175 [2,0,0,0,0,0|1,0,0]=3 331 B9R1.8 C1=CC=C(C=C1)CNO I137166 [2,0,0,0,0,0|1,0,0]=3 332 B9R1.8 C1=CC=C(C=C1)CON O159948 [2,0,0,0,0,0|1,0,0]=3 333 B9R1.8 C1=CC=C(C=C1)CON O189173 [2,0,0,0,0,0|1,0,0]=3 334 B9R1.8 C1=CC=C(C=C1)SCCl C101827 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.8 C1=CC=NC(=C1)CCBr B186289 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.8 C1=CC=NC(=C1)CCN A151790 [2,0,0,0,0,0|1,0,0]=3 337 B9R1.8 C1=CC=NC(=C1)CCO P160791 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.8 C1=CN=CC=C1CCN A109738 [2,0,0,0,0,0|1,0,0]=3 339 B9R1.8 C1=CN=CC=C1CCS P134707 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.8 C1=CN=CC=C1CCS P478833 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.8 C=CCC1=CC=CC=C1 A101037 [2,0,0,0,0,0|0,0,2]=4 342 B9R1.8 CC#CC1=CC=CC=C1 P141240 [2,0,0,0,0,0|0,0,2]=4 343 B9R1.8 CC=CC1=CC=CC=C1 C153576 [2,0,0,0,0,0|0,0,2]=4 344 B9R1.8 CC=CC1=CC=CC=C1 M136687 [2,0,0,0,0,0|0,0,2]=4 345 B9R1.8 CC=CC1=CC=CC=C1 T134052 [2,0,0,0,0,0|0,0,2]=4 346 B9R1.8 CC=CC1=CC=CC=C1 T301941 [2,0,0,0,0,0|0,0,2]=4 347 B9R1.8 CCCC1=CC=CC=C1 P104621 [2,0,0,0,0,0|0,0,0]=2 348 B9R1.8 CCCC1=CC=CC=C1 P104624 [2,0,0,0,0,0|0,0,0]=2 349 B9R1.8 CCCC1=CC=CC=C1 P104625 [2,0,0,0,0,0|0,0,0]=2 350 B9R1.8 CCCC1=CC=CC=C1 P104626 [2,0,0,0,0,0|0,0,0]=2 351 B9R1.8 CCCC1=CC=CC=C1 P128158 [2,0,0,0,0,0|0,0,0]=2 352 B9R1.8 CCCC1=CC=CC=N1 P160637 [2,0,0,0,0,0|1,0,0]=3 353 B9R1.8 CCCC1=CC=NC=C1 P160632 [2,0,0,0,0,0|1,0,0]=3 354 B9R1.8 CCCC1=NC=CN=C1 P132679 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.8 CCC[N+]1=CC=CC=C1 P404861 [2,0,0,0,0,0|1,0,0]=3 356 B9R1.8 CCNC1=CC=CC=C1 E103974 [2,0,0,0,0,0|1,0,0]=3 357 B9R1.8 CCOC1=CC=CC=C1 E108654 [2,0,0,0,0,0|1,0,0]=3 358 B9R1.8 CCOC1=CC=CC=C1 E108655 [2,0,0,0,0,0|1,0,0]=3 359 B9R1.8 CCOC1=CC=CC=N1 E137467 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.8 CCSC1=CC=CC=C1 E101809 [2,0,0,0,0,0|1,0,0]=3 361 B9R1.8 CNCC1=CC=CC=C1 B106919 [2,0,0,0,0,0|0,0,0]=2 362 B9R1.8 CNCC1=CC=CC=N1 M168526 [2,0,0,0,0,0|1,0,0]=3 363 B9R1.8 CNCC1=CN=CC=C1 M138441 [2,0,0,0,0,0|1,0,0]=3 364 B9R1.8 COCC1=CC=CC=C1 B103161 [2,0,0,0,0,0|1,0,0]=3 365 B9R1.8 COCC1=CC=CC=C1 B591251 [2,0,0,0,0,0|1,0,0]=3 366 B9R1.8 CSCC1=CC=CC=C1 B152510 [2,0,0,0,0,0|1,0,0]=3 367 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B153177 [2,0,0,0,0,0|0,0,2]=4 368 B11R1.7 CC(C#C)(C1=CC=CC=C1)O P111201 [1,1,0,0,0,0|0,0,2]=4 369 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 M404765 [1,1,0,0,0,0|0,0,2]=4 370 B11R1.7 CC(C)(C1=CC=CC=C1)OO C109598 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.7 CC(C)(CCl)C1=CC=CC=C1 C107610 [1,1,0,0,0,0|1,0,0]=3 372 B11R1.7 CC(C)(CO)C1=CC=CC=C1 M294317 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.7 CCC(C)(C)C1=CC=CC=C1 A102508 [1,1,0,0,0,0|0,0,0]=2 374 B11R1.7 CCC(C)(C1=CC=CC=C1)O P474236 [1,1,0,0,0,0|0,0,0]=2 375 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 E156274 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.7 CNS(=O)(=O)C1=CC=CC=C1 N158939 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 M158465 [1,1,0,0,0,0|1,1,0]=4 378 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 S139118 [1,1,0,0,0,0|1,1,0]=4 379 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 S140418 [1,1,0,0,0,0|1,1,0]=4 380 B11R1.7 C[Si](C)(CCl)C1=CC=CC=C1 C153449 [1,1,0,0,0,0|1,1,0]=4 381 B11R1.12 B(CC)(CC)C1=CN=CC=C1 D122653 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.12 C1=CC=C(C=C1)C(CO)CO P160752 [1,1,0,0,0,0|1,0,0]=3 383 B11R1.12 CCC(C#N)C1=CC=CC=C1 P139257 [1,1,0,0,0,0|0,0,1]=3 384 B11R1.12 CCC(CC)C1=CC=CC=N1 P136764 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.12 CCN(CC)C1=CC=CC=C1 D111034 [1,1,0,0,0,0|1,0,0]=3 386 B11R1.12 CCN(CC)C1=CC=CC=C1 D111035 [1,1,0,0,0,0|1,0,0]=3 387 B11R1.12 CCN(CC)C1=CC=CC=C1 N138157 [1,1,0,0,0,0|1,0,0]=3 388 B11R1.12 CCP(CC)C1=CC=CC=C1 D154321 [1,1,0,0,0,0|1,0,0]=3 389 B11R1.12 CCP(CC)C1=CC=CC=C1 D196395 [1,1,0,0,0,0|1,0,0]=3 390 B11R1.12 COC(C1=CC=CC=C1)OC B107016 [1,1,0,0,0,0|1,0,0]=3 391 B11R1.12 COC(CO)C1=CC=CC=C1 M351712 [1,1,0,0,0,0|1,0,0]=3 392 B11R1.12 COP(C1=CC=CC=C1)OC D189099 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.22 C1=CC(=CC=C1C(=O)CN)Br A136664 [1,1,0,0,0,0|1,0,1]=4 394 B11R1.22 C1=CC(=CC=C1C(=O)CN)F A184615 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.22 C1=CC(=CC=C1C(CN)O)O O101521 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.22 C1=CC(=CC=C1C(CO)N)Br A587986 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br B137954 [1,1,0,0,0,0|1,0,1]=4 398 B11R1.22 CCC(=O)C1=CC=C(C=C1)C M102232 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl C109480 [1,1,0,0,0,0|1,0,1]=4 400 B11R1.22 CCC(=O)C1=CC=C(C=C1)F F156638 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.22 CCC(=O)C1=CC=C(C=C1)N A419382 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.22 CCC(=O)C1=CC=C(C=C1)O H107590 [1,1,0,0,0,0|1,0,1]=4 403 B11R1.22 CCC(C)C1=CC=C(C=C1)Br B136925 [1,1,0,0,0,0|0,0,0]=2 404 B11R1.22 CCC(C)C1=CC=C(C=C1)N S161429 [1,1,0,0,0,0|0,0,0]=2 405 B11R1.22 CCC(C)C1=CC=C(C=C1)O S161081 [1,1,0,0,0,0|0,0,0]=2 406 B11R1.22 CCC(C1=CC=C(C=C1)Cl)N C489594 [1,1,0,0,0,0|1,0,0]=3 407 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br N183369 [1,1,0,0,0,0|1,0,1]=4 408 B11R1.22 CNC(=O)C1=CC=C(C=C1)N A151421 [1,1,0,0,0,0|1,0,1]=4 409 B11R1.22 NCC(O)C1=CC=C(O)C=C1 O408184 [1,1,0,0,0,0|1,0,0]=3 410 B11R1.23 C1=CC(=CC(=C1)Br)C(CO)N A587851 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.23 C1=CC(=CC(=C1)O)C(CN)O R133855 [1,1,0,0,0,0|1,0,0]=3 412 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br B138434 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl C136265 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.23 CCC(=O)C1=CC(=CC=C1)F F138865 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.23 CCC(=O)C1=CC(=CC=C1)O H190518 [1,1,0,0,0,0|1,0,1]=4 416 B11R1.23 CNC(=O)C1=CC(=CC=C1)Br N184787 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.23 CNC(=O)C1=CC(=CC=C1)N A483668 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.36 C1=CC=C(C=C1)C(C(=O)N)N D189180 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.36 C1=CC=C(C=C1)C(C(=O)N)N S185796 [1,1,0,0,0,0|1,0,1]=4 420 B11R1.36 C1=CC=C(C=C1)C(C(=O)N)O M342074 [1,1,0,0,0,0|1,0,1]=4 421 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 N159396 [1,1,0,0,0,0|1,0,1]=4 422 B11R1.36 CC(C(=O)C1=CC=CC=C1)Cl C154066 [1,1,0,0,0,0|1,0,1]=4 423 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 I134082 [1,1,0,0,0,0|1,0,1]=4 424 B11R1.36 CC(C1=CC=CC=C1)C(=O)O B102422 [1,1,0,0,0,0|1,0,1]=4 425 B11R1.36 CC(C1=CC=CC=C1)C(=O)O P102421 [1,1,0,0,0,0|1,0,1]=4 426 B11R1.36 CC(C1=CC=CC=C1)C(=O)O P128106 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.36 CC(C1=CC=CC=C1)C(=O)O P424260 [1,1,0,0,0,0|1,0,1]=4 428 B11R1.36 CC(C1=CC=CC=C1)N(C)C R160852 [1,1,0,0,0,0|0,0,0]=2 429 B11R1.36 CC(C1=CC=CC=C1)N(C)C S161322 [1,1,0,0,0,0|0,0,0]=2 430 B11R1.36 CN(C)C(=O)C1=CC=CC=C1 I134083 [1,1,0,0,0,0|1,0,1]=4 431 B11R1.222 C1=CC=C(C(=C1)C(CO)O)Cl S138159 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.222 CCC(=O)C1=CC=CC=C1C M182612 [1,1,0,0,0,0|1,0,1]=4 433 B11R1.222 CCC(=O)C1=CC=CC=C1Cl C194312 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.222 CCC(=O)C1=CC=CC=C1F F108013 [1,1,0,0,0,0|1,0,1]=4 435 B11R1.222 CCC(=O)C1=CC=CC=C1O H156886 [1,1,0,0,0,0|1,0,1]=4 436 B11R1.222 CCC(C)C1=CC=CC=C1O S161080 [1,1,0,0,0,0|0,0,0]=2 437 B11R1.222 CNC(=O)C1=CC=CC=C1F F573628 [1,1,0,0,0,0|1,0,1]=4 438 B11R1.222 CNC(=O)C1=CC=CC=C1N A151423 [1,1,0,0,0,0|1,0,1]=4 439 B11R1.222 CNC(=O)C1=CC=CC=C1O H343180 [1,1,0,0,0,0|1,0,1]=4 440 B11R1.222 CNC(=O)C1=CC=CC=C1S M121843 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.1 C1=CC(=CC=C1CCCN)Cl C191754 [1,1,0,0,0,0|2,0,0]=4 442 B11R1.1 C1=CC(=CC=C1CCCO)Br B135402 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.1 C1=CC(=CC=C1CCCO)Cl C405534 [1,1,0,0,0,0|2,0,0]=4 444 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [1,1,0,0,0,0|2,0,0]=4 445 B11R1.1 CCCCC1=CC=C(C=C1)Br B115516 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.1 CCCCC1=CC=C(C=C1)Cl B167540 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.1 CCCCC1=CC=C(C=C1)I B124312 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.1 CCCCC1=CC=C(C=C1)N B100731 [1,1,0,0,0,0|1,0,0]=3 449 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [1,1,0,0,0,0|1,0,0]=3 450 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120508 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120511 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120512 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B343853 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.1 CCCC[N+]1=CC=C(C=C1)C W196192 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.1 CCCOC1=CC=C(C=C1)Br B138795 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.1 CCCOC1=CC=C(C=C1)N P420032 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.1 CCCOC1=CC=C(C=C1)O P132532 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [1,1,0,0,0,0|1,0,0]=3 460 B11R1.17 C1=CC=C(C(=C1)CCC#N)Cl C194792 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.17 C1=CC=C(C(=C1)CCCO)Br B193732 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.17 CCCCC1=CC=CC=C1N B151822 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.24 C1=CC(=CC(=C1)Cl)CCC=O C167090 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.24 C1=CC(=CC(=C1)F)CCCBr B587429 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120506 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.24 CCCC[N+]1=CC=CC(=C1)C B120507 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.24 CCNCC1=CC(=CC=C1)F N187982 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.28 C#CCOCC1=CC=CC=C1 P589024 [1,1,0,0,0,0|1,0,1]=4 469 B11R1.28 C1=CC=C(C=C1)CCCCBr B140194 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.28 C1=CC=C(C=C1)CCCCCl P404858 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.28 C1=CC=C(C=C1)CCCCN B292880 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.28 C1=CC=C(C=C1)CCCCN P160136 [1,1,0,0,0,0|1,0,0]=3 473 B11R1.28 C1=CC=C(C=C1)CCCCN P160137 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.28 C1=CC=C(C=C1)CCCCN P493282 [1,1,0,0,0,0|1,0,0]=3 475 B11R1.28 C1=CC=C(C=C1)CCCCO P138687 [1,1,0,0,0,0|1,0,0]=3 476 B11R1.28 C1=CC=C(C=C1)CCN=C=O P160767 [1,1,0,0,0,0|0,0,2]=4 477 B11R1.28 C1=CC=C(C=C1)CCN=C=S P102544 [1,1,0,0,0,0|0,0,2]=4 478 B11R1.28 C1=CC=C(C=C1)CCNC=O I168819 [1,1,0,0,0,0|0,0,1]=3 479 B11R1.28 C1=CC=C(C=C1)CCOC=O F302132 [1,1,0,0,0,0|1,0,1]=4 480 B11R1.28 C1=CC=C(C=C1)CNCCN B124211 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.28 C1=CC=C(C=C1)CNCCO B111181 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.28 C1=CC=C(C=C1)COCC=O B136421 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.28 C1=CC=C(C=C1)COCCBr B107737 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.28 C1=CC=C(C=C1)COCCCl B132425 [1,1,0,0,0,0|2,0,0]=4 485 B11R1.28 C1=CC=C(C=C1)COCCN B193115 [1,1,0,0,0,0|2,0,0]=4 486 B11R1.28 C1=CC=C(C=C1)COCCO B111396 [1,1,0,0,0,0|2,0,0]=4 487 B11R1.28 C1=CC=C(C=C1)CSCCO B140387 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.28 C1=CC=C(C=C1)NCCC#N A151772 [1,1,0,0,0,0|2,0,0]=4 489 B11R1.28 C1=CC=C(C=C1)NCCCO A151778 [1,1,0,0,0,0|2,0,0]=4 490 B11R1.28 C1=CC=C(C=C1)OCCCBr P160566 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.28 C1=CC=C(C=C1)OCCCN P353595 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.28 C1=CC=C(C=C1)OCCCO P160296 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.28 C1=CN=CC=C1CCCCO P193755 [1,1,0,0,0,0|2,0,0]=4 494 B11R1.28 C=CCNCC1=CC=CC=C1 N158987 [1,1,0,0,0,0|1,0,1]=4 495 B11R1.28 C=CCOCC1=CC=CC=C1 A151095 [1,1,0,0,0,0|1,0,1]=4 496 B11R1.28 CCCC#CC1=CC=CC=C1 P404844 [1,1,0,0,0,0|1,0,1]=4 497 B11R1.28 CCCCCC1=CC=CC=C1 A151374 [1,1,0,0,0,0|1,0,0]=3 498 B11R1.28 CCCCCC1=CC=CC=N1 A132572 [1,1,0,0,0,0|2,0,0]=4 499 B11R1.28 CCCCCC1=CC=NC=C1 A151146 [1,1,0,0,0,0|2,0,0]=4 500 B11R1.28 CCCCNC1=CC=CC=C1 B140175 [1,1,0,0,0,0|1,0,0]=3 501 B11R1.28 CCCCNC1=CC=CC=C1 N590954 [1,1,0,0,0,0|1,0,0]=3 502 B11R1.28 CCCCOC1=CC=CC=C1 B153006 [1,1,0,0,0,0|1,0,0]=3 503 B11R1.28 CCCNCC1=CC=CC=C1 N191934 [1,1,0,0,0,0|1,0,0]=3 504 B11R1.28 CNCCOC1=CC=CC=C1 N169984 [1,1,0,0,0,0|0,0,0]=2 505 B11R1.28 OCCSCc1ccccc1 H109405 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.40 C1=CC=C(C=C1)CC(=O)NN P160484 [1,1,0,0,0,0|1,0,1]=4 507 B11R1.40 C1=CC=C(C=C1)CC(CO)N P100530 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.40 C1=CC=C(C=C1)CC(CO)N P109244 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.40 C1=CC=C(C=C1)CC(CO)N S160981 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.40 CCC(=O)CC1=CC=CC=C1 P160130 [1,1,0,0,0,0|1,0,1]=4 511 B11R1.40 CCC(CC1=CC=CC=C1)N P344719 [1,1,0,0,0,0|1,0,0]=3 512 B11R1.40 CCC(CC1=CC=CC=C1)O E352402 [1,1,0,0,0,0|1,0,0]=3 513 B11R1.40 CNC(=O)OC1=CC=CC=C1 P587924 [1,1,0,0,0,0|1,0,1]=4 514 B11R1.40 CNC(=S)NC1=CC=CC=C1 M158401 [1,1,0,0,0,0|1,0,1]=4 515 B11R1.40 COC(=O)CC1=CC=CC=C1 M106997 [1,1,0,0,0,0|1,0,1]=4 516 B11R1.91 B(CCC1=CC=CC=C1)(O)O P119631 [1,1,0,0,0,0|2,0,0]=4 517 B11R1.91 C1=CC=C(C=C1)CCC(=O)Cl P101406 [1,1,0,0,0,0|2,0,0]=4 518 B11R1.91 C1=CC=C(C=C1)CCC(=O)N P160460 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109276 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P109277 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.91 C1=CC=C(C=C1)CCC(=O)O P424323 [1,1,0,0,0,0|2,0,0]=4 522 B11R1.91 CC(=C)COC1=CC=CC=C1 M420042 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.91 CC(=O)CCC1=CC=CC=C1 P106914 [1,1,0,0,0,0|1,0,0]=3 524 B11R1.91 CC(=O)COC1=CC=CC=C1 P160134 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.91 CC(=O)NCC1=CC=CC=C1 N159297 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109251 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.91 CC(=O)OCC1=CC=CC=C1 B109253 [1,1,0,0,0,0|2,0,0]=4 528 B11R1.91 CC(C)NCC1=CC=CC=C1 B100437 [1,1,0,0,0,0|2,0,0]=4 529 B11R1.91 CC(CCC1=CC=CC=C1)N M168739 [1,1,0,0,0,0|1,0,0]=3 530 B11R1.91 CC(CCC1=CC=CC=C1)O I168710 [1,1,0,0,0,0|1,0,0]=3 531 B11R1.91 CC(CCC1=CC=CC=C1)O I170111 [1,1,0,0,0,0|1,0,0]=3 532 B11R1.91 CC(CCC1=CC=CC=C1)O P160159 [1,1,0,0,0,0|1,0,0]=3 533 B11R1.91 CC(COC1=CC=CC=C1)O B299831 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.91 CC(COC1=CC=CC=C1)O P135297 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.91 CN(C)CCC1=CC=CC=C1 N302096 [1,1,0,0,0,0|0,0,0]=2 536 B11R1.29 CNCCC(C1=CC=CS1)O S160977 [0,1,0,0,1,0|2,0,0]=4 537 B13R1.348 CC(C)CC(CC1=CC=CC=C1)O M158741 [0,1,0,0,0,1|2,0,0]=4 538 B13R1.398 CCCN(CCC)C1=CC=CC=C1 N159178 [0,2,0,0,0,0|2,0,0]=4 539 B13R1.398 CCOC(C1=CC=CC=C1)OCC B153147 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.713 C1=CC=C(C=C1)C(CC(=O)O)CN A179304 [0,2,0,0,0,0|2,0,0]=4 541 B13R1.713 C1=CC=C(C=C1)C(CC(=O)O)CN A183566 [0,2,0,0,0,0|2,0,0]=4 542 B13R1.713 CC(C)NC(CO)C1=CC=CC=C1 I121110 [0,2,0,0,0,0|2,0,0]=4 543 B13R1.466 CNCC(=O)C1=CC(=C(C=C1)O)O A129906 [0,2,0,0,0,0|1,0,1]=4 544 B13R1.466 CNCC(=O)C1=CC(=C(O)C=C1)O A408863 [0,2,0,0,0,0|1,0,1]=4 545 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O D274858 [0,2,0,0,0,0|1,0,0]=3 546 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O E113174 [0,2,0,0,0,0|1,0,0]=3 547 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O E129809 [0,2,0,0,0,0|1,0,0]=3 548 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G108394 [0,2,0,0,0,0|1,0,0]=3 549 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G108395 [0,2,0,0,0,0|1,0,0]=3 550 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G108396 [0,2,0,0,0,0|1,0,0]=3 551 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G108397 [0,2,0,0,0,0|1,0,0]=3 552 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G108398 [0,2,0,0,0,0|1,0,0]=3 553 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O G274269 [0,2,0,0,0,0|1,0,0]=3 554 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O L137183 [0,2,0,0,0,0|1,0,0]=3 555 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O L303968 [0,2,0,0,0,0|1,0,0]=3 556 B13R1.466 CNCC(C1=CC(=C(C=C1)O)O)O L424712 [0,2,0,0,0,0|1,0,0]=3 557 B13R1.466 CNCC(O)C1=CC(=C(O)C=C1)O E408820 [0,2,0,0,0,0|1,0,0]=3 558 B13R1.466 CNCC(O)C1=CC(=C(O)C=C1)O L408183 [0,2,0,0,0,0|1,0,0]=3 559 B13R1.11 CCC(=O)OC(C)C1=CC=CC=C1 S117685 [0,2,0,0,0,0|1,0,1]=4 560 B13R1.11 COC(=O)CC(C1=CC=CC=C1)N M343428 [0,2,0,0,0,0|2,0,0]=4 561 B13R1.24 CCCCCC(C1=CC=CC=C1)O P160139 [0,2,0,0,0,0|2,0,0]=4 562 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 D154638 [0,2,0,0,0,0|1,0,1]=4 563 B13R1.708 CC(C)(C1=CC=CC=C1)C(=O)OC M194022 [0,2,0,0,0,0|1,0,1]=4 564 B11R2.1 C1C2=CC=CC=C2C(=O)N1 I170551 [1,0,0,1,0,0|1,0,1]=4 565 B11R2.1 C1CC(=O)C2=CC=CC=C21 I106436 [1,0,0,1,0,0|1,0,1]=4 566 B11R2.1 C1CC(=O)C2=CC=CC=C21 I426156 [1,0,0,1,0,0|1,0,1]=4 567 B11R2.1 C1CC2=C(C1O)C=CC=N2 D586296 [1,0,0,1,0,0|2,0,0]=4 568 B11R2.1 C1CC2=CC=CC=C2C1N A114505 [1,0,0,1,0,0|1,0,0]=3 569 B11R2.1 C1CC2=CC=CC=C2C1N D186125 [1,0,0,1,0,0|1,0,0]=3 570 B11R2.1 C1CC2=CC=CC=C2C1N S192732 [1,0,0,1,0,0|1,0,0]=3 571 B11R2.1 C1CC2=CC=CC=C2C1N S469445 [1,0,0,1,0,0|1,0,0]=3 572 B11R2.1 C1CC2=CC=CC=C2C1O H157335 [1,0,0,1,0,0|1,0,0]=3 573 B11R2.1 C1CC2=CC=CC=C2C1O H419517 [1,0,0,1,0,0|1,0,0]=3 574 B11R2.1 C1CC2=CC=CC=C2C1O H592262 [1,0,0,1,0,0|1,0,0]=3 575 B11R2.1 CC1=CNC2=CC=CC=C12 M426157 [1,0,0,1,0,0|0,0,2]=4 576 B11R2.1 CC1=CNC2=CC=CC=C12 S104736 [1,0,0,1,0,0|0,0,2]=4 577 B11R2.1 CC1CCC2=CC=CC=C12 M304586 [1,0,0,1,0,0|0,0,0]=2 578 B11R2.1 CC1CCC2=NC=CN=C12 M111400 [1,0,0,1,0,0|2,0,0]=4 579 B11R2.1 CC1CNC2=CC=CC=C12 M589123 [1,0,0,1,0,0|0,0,0]=2 580 B11R2.4 C1C(C1N)C2=CC=CC=C2 R132818 [1,0,0,1,0,0|0,0,0]=2 581 B11R2.4 C1C(C1N)C2=CC=CC=C2 T275460 [1,0,0,1,0,0|0,0,0]=2 582 B11R2.4 C1C(C1N)C2=CC=CC=C2 T422413 [1,0,0,1,0,0|0,0,0]=2 583 B11R2.40 C1CC1(C2=CC=CC=C2)N P589058 [1,0,0,1,0,0|1,0,0]=3 584 B11R2.20 C1C=CCC2=CC=CC=C21 D155281 [1,0,0,1,0,0|1,0,1]=4 585 B11R2.20 C1CC2=CC=CC=C2C=C1 D155011 [1,0,0,1,0,0|1,0,1]=4 586 B11R2.20 C1CC2=CC=CC=C2NC1 T107484 [1,0,0,1,0,0|2,0,0]=4 587 B11R2.20 C1CCC2=C(C1)C=CC=N2 T108003 [1,0,0,1,0,0|2,0,0]=4 588 B11R2.20 C1CCC2=C(C1)C=CN=C2 T162590 [1,0,0,1,0,0|2,0,0]=4 589 B11R2.20 C1CCC2=CC=CC=C2C1 T100976 [1,0,0,1,0,0|1,0,0]=3 590 B11R2.20 C1CCC2=CC=CC=C2C1 T100978 [1,0,0,1,0,0|1,0,0]=3 591 B11R2.20 C1CCC2=CC=CC=C2C1 T100979 [1,0,0,1,0,0|1,0,0]=3 592 B11R2.20 C1CCC2=CC=CC=C2C1 T100981 [1,0,0,1,0,0|1,0,0]=3 593 B11R2.20 C1CCC2=CC=CC=C2C1 T119673 [1,0,0,1,0,0|1,0,0]=3 594 B11R2.20 C1CN=CC2=CC=CC=C21 D169557 [1,0,0,1,0,0|0,0,2]=4 595 B11R2.20 C1CNCC2=C1C=CC=N2 T176221 [1,0,0,1,0,0|1,0,0]=3 596 B11R2.20 C1CNCC2=CC=CC=C21 T139420 [1,0,0,1,0,0|0,0,0]=2 597 B11R2.20 C1COCC2=CC=CC=C21 I122961 [1,0,0,1,0,0|1,0,0]=3 598 B11R2.238 C1C(N1)CC2=CC=CC=C2 S304496 [1,0,0,1,0,0|0,0,0]=2 599 B11R2.238 C1C(O1)CC2=CC=CC=C2 E472459 [1,0,0,1,0,0|1,0,0]=3 600 B11R2.238 C1CC1SC2=CC=CC=C2 C101828 [1,0,0,1,0,0|2,0,0]=4 601 B13R2.64 C1CCN(C1)CC2=CC=CC=C2 B192606 [0,0,0,1,0,1|2,0,0]=4 602 B13R2.64 C1COCN1CC2=CC=CC=C2 B151820 [0,0,0,1,0,1|2,0,0]=4 603 B13R2.328 CN1CC(=O)NC2=CC=CC=C21 M194507 [0,0,0,1,0,1|1,0,1]=4 604 B13R2.3 C1CC(CC=C1)C2=CC=CC=C2 P160395 [0,1,0,1,0,0|1,0,0]=3 605 B13R2.3 C1CC(CNC1)C2=CC=CC=C2 P138790 [0,1,0,1,0,0|0,0,0]=2 606 B13R2.3 C1CCC(=CC1)C2=CC=CC=C2 P134539 [0,1,0,1,0,0|1,0,1]=4 607 B13R2.3 C1CCC(CC1)C2=CC=CC=C2 P111365 [0,1,0,1,0,0|1,0,0]=3 608 B13R2.3 C1CCN(CC1)C2=CC=CC=C2 P160168 [0,1,0,1,0,0|2,0,0]=4 609 B13R2.3 C1CCNC(C1)C2=CC=CC=C2 R467341 [0,1,0,1,0,0|1,0,0]=3 610 B13R2.3 C1CCNC(C1)C2=CC=CC=N2 R467036 [0,1,0,1,0,0|2,0,0]=4 611 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A109397 [0,1,0,1,0,0|2,0,0]=4 612 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A124541 [0,1,0,1,0,0|2,0,0]=4 613 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A124543 [0,1,0,1,0,0|2,0,0]=4 614 B13R2.3 C1CCNC(C1)C2=CN=CC=C2 A493484 [0,1,0,1,0,0|2,0,0]=4 615 B13R2.3 C1CN(CCN1)C2=CC=CC=C2 P101918 [0,1,0,1,0,0|1,0,0]=3 616 B13R2.3 C1CN(CCN1)C2=CC=CC=C2 P137528 [0,1,0,1,0,0|1,0,0]=3 617 B13R2.3 C1CN(CCN1)C2=CC=CC=N2 P106881 [0,1,0,1,0,0|2,0,0]=4 618 B13R2.3 C1CN(CCN1)C2=CC=NC=C2 P113741 [0,1,0,1,0,0|2,0,0]=4 619 B13R2.3 C1CNC(CN1)C2=CC=CC=C2 P468169 [0,1,0,1,0,0|0,0,0]=2 620 B13R2.3 C1CNCC=C1C2=CC=CC=C2 T162101 [0,1,0,1,0,0|0,0,1]=3 621 B13R2.3 C1CNCCC1C2=CC=CC=C2 P119111 [0,1,0,1,0,0|0,0,0]=2 622 B13R2.3 C1CNCCC1C2=CC=NC=C2 P400607 [0,1,0,1,0,0|1,0,0]=3 623 B13R2.3 C1COC(CN1)C2=CC=CC=C2 R586682 [0,1,0,1,0,0|0,0,0]=2 624 B13R2.3 C1COCCN1C2=CC=CC=C2 P118291 [0,1,0,1,0,0|2,0,0]=4 625 B13R2.3 C1COCOC1C2=CC=CC=C2 P160795 [0,1,0,1,0,0|1,0,0]=3 626 B13R2.10 C1C(CNC1=O)C2=CC=CC=C2 P190023 [0,1,0,1,0,0|0,0,1]=3 627 B13R2.10 C1CN(CC1N)C2=CC=CC=C2 P587810 [0,1,0,1,0,0|2,0,0]=4 628 B13R2.10 CC1COC(O1)C2=CC=CC=C2 B117532 [0,1,0,1,0,0|2,0,0]=4 629 B13R2.10 CC1COC(O1)C2=CC=CC=C2 B140514 [0,1,0,1,0,0|2,0,0]=4 630 B13R2.1613 C1CC(C2=CC=CC=C2C1)C#N T405043 [0,1,0,1,0,0|1,0,1]=4 631 B13R2.12 C1CC(NC1)C2=CC=C(C=C2)Br B184178 [0,1,0,1,0,0|2,0,0]=4 632 B13R2.12 C1CCC(C1)C2=CC=C(C=C2)O C477108 [0,1,0,1,0,0|1,0,0]=3 633 B13R2.12 C1CCN(C1)C2=CC=C(C=C2)Br B151811 [0,1,0,1,0,0|2,0,0]=4 634 B13R2.12 CC1=CC=C(C=C1)C2CCCC2 C195195 [0,1,0,1,0,0|1,0,0]=3 635 B13R2.13 C1CC(NC1)C2=CC(=CC=C2)Br B342393 [0,1,0,1,0,0|2,0,0]=4 636 B13R2.371 CC1CCC(=O)C2=CC=CC=C12 M168319 [0,1,0,1,0,0|1,0,1]=4 637 B13R2.12159 CC1(CC(=O)C2=CC=CC=C21)C D135742 [0,1,0,1,0,0|2,0,0]=4 638 B13R2.423 C1C(C1C(=O)O)C2=CC=CC=C2 T139465 [0,1,0,1,0,0|2,0,0]=4 639 B13R2.18 C1CC(NC1)C2=CC=CC=C2Br B586924 [0,1,0,1,0,0|2,0,0]=4 640 B13R3.1962 C1C2C=CC1C3=CC=CC=C23 D120187 [0,0,0,2,0,0|1,0,1]=4 641 B9R1.12 CCCCC1=CC=CO1 B152372 [1,0,0,0,1,0|2,0,0]=4 642 B9R1.12 CCCCC1=CC=CS1 N189024 [1,0,0,0,1,0|2,0,0]=4 643 B9R1.12 CCCCC1=CSC=C1 B100752 [1,0,0,0,1,0|2,0,0]=4 644 B13R1.42 CCCC(C#CC1=CC=CC=C1)O P468870 [0,0,0,0,0,2|2,0,0]=4