0 B9R0.45 C#CCCCCCCCC Amb2721541 [0,0,0,0,0,0|1,0,3]=4 1 B9R0.45 C#CCOCC\C=C\CO Amb27945361 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.45 C#CCSCC\C=C\CC Amb27833434 [0,0,0,0,0,0|2,0,1]=3 3 B9R0.45 C#C\C=C\CCCCCO Amb28050732 [0,0,0,0,0,0|0,0,4]=4 4 B9R0.45 C=CCCCCC#CCO Amb27972321 [0,0,0,0,0,0|2,0,2]=4 5 B9R0.45 C=CCCCCCCC=O Amb28193259 [0,0,0,0,0,0|0,0,4]=4 6 B9R0.45 C=CCCCCCCCBr Amb19895211 [0,0,0,0,0,0|2,0,2]=4 7 B9R0.45 C=CCCCCCCCC Amb3940503 [0,0,0,0,0,0|1,0,2]=3 8 B9R0.45 C=CCCCCCCCCl Amb6298880 [0,0,0,0,0,0|2,0,2]=4 9 B9R0.45 C=CCCCCCCCN Amb24763980 [0,0,0,0,0,0|2,0,2]=4 10 B9R0.45 C=CCCCCCCCN Amb32653343 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.45 C=CCCCCCCCO Amb22733549 [0,0,0,0,0,0|2,0,2]=4 12 B9R0.45 C=CCCCCCCNC Amb28120535 [0,0,0,0,0,0|2,0,2]=4 13 B9R0.45 C=CCCCCCSCC Amb27396740 [0,0,0,0,0,0|2,0,1]=3 14 B9R0.45 C=CCCCCNCCC Amb26576689 [0,0,0,0,0,0|2,0,1]=3 15 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [0,0,0,0,0,0|2,0,1]=3 16 B9R0.45 C=CCCCC\C=C\CO Amb8389620 [0,0,0,0,0,0|2,0,0]=2 17 B9R0.45 C=CCCCNCCCC Amb27799206 [0,0,0,0,0,0|2,0,2]=4 18 B9R0.45 C=CCCCSC\C=C\C Amb28282443 [0,0,0,0,0,0|2,0,2]=4 19 B9R0.45 C=CCCC\C=C\CCO Amb27835106 [0,0,0,0,0,0|2,0,2]=4 20 B9R0.45 C=CCCNCCCCC Amb27838999 [0,0,0,0,0,0|2,0,2]=4 21 B9R0.45 C=CCCNCCOCC Amb28126723 [0,0,0,0,0,0|3,0,1]=4 22 B9R0.45 C=CCCSCCSCC Amb27197363 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.45 C=CCNCCCCCC Amb7756950 [0,0,0,0,0,0|2,0,2]=4 24 B9R0.45 C=CCOCCCCCC Amb17933923 [0,0,0,0,0,0|2,0,2]=4 25 B9R0.45 C=CCOCCCSCC Amb28187852 [0,0,0,0,0,0|3,0,1]=4 26 B9R0.45 C=CCOCCNCCC Amb27866133 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.45 C=CCONC\C=C\CCl Amb28194972 [0,0,0,0,0,0|4,0,0]=4 28 B9R0.45 C=CCSCCCCCC Amb22733767 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.45 C=CC\C=C\C\C=C\CO Amb28050671 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [0,0,0,0,0,0|1,0,3]=4 31 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [0,0,0,0,0,0|0,0,4]=4 32 B9R0.45 C=C\C=C\CCCN=C=O Amb26560308 [0,0,0,0,0,0|1,0,3]=4 33 B9R0.45 CC#CCCCCCC=O Amb28198592 [0,0,0,0,0,0|0,0,3]=3 34 B9R0.45 CC#CCCC\C=C\CBr Amb25327836 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.45 CC#CCNC\C=C\CC Amb27198885 [0,0,0,0,0,0|2,0,2]=4 36 B9R0.45 CCC#CCCCCCC Amb2721540 [0,0,0,0,0,0|1,0,3]=4 37 B9R0.45 CCC#CCCCCCO Amb28050678 [0,0,0,0,0,0|0,0,4]=4 38 B9R0.45 CCC=C=CCCCCO Amb28248694 [0,0,0,0,0,0|0,0,4]=4 39 B9R0.45 CCCCC#CCCC=O Amb27790685 [0,0,0,0,0,0|0,0,4]=4 40 B9R0.45 CCCCCCCCC#N Amb7764626 [0,0,0,0,0,0|1,0,3]=4 41 B9R0.45 CCCCCCCCCBr Amb3940224 [0,0,0,0,0,0|1,0,3]=4 42 B9R0.45 CCCCCCCCCC Amb7757835 [0,0,0,0,0,0|1,0,3]=4 43 B9R0.45 CCCCCCCCCCl Amb6652537 [0,0,0,0,0,0|1,0,3]=4 44 B9R0.45 CCCCCCCCCF Amb8515361 [0,0,0,0,0,0|1,0,3]=4 45 B9R0.45 CCCCCCCCCI Amb3940284 [0,0,0,0,0,0|1,0,3]=4 46 B9R0.45 CCCCCCCCCN Amb3987584 [0,0,0,0,0,0|1,0,3]=4 47 B9R0.45 CCCCCCCCCO Amb3940342 [0,0,0,0,0,0|0,0,4]=4 48 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [0,0,0,0,0,0|1,0,3]=4 49 B9R0.45 CCCCCCCCNC Amb7757640 [0,0,0,0,0,0|2,0,2]=4 50 B9R0.45 CCCCCCCCNN Amb7786451 [0,0,0,0,0,0|2,0,2]=4 51 B9R0.45 CCCCCCCCNO Amb28069968 [0,0,0,0,0,0|1,0,3]=4 52 B9R0.45 CCCCCCCCON Amb2818885 [0,0,0,0,0,0|2,0,2]=4 53 B9R0.45 CCCCCCCCSC Amb10553780 [0,0,0,0,0,0|2,0,2]=4 54 B9R0.45 CCCCCCCN=C=O Amb3940866 [0,0,0,0,0,0|1,0,3]=4 55 B9R0.45 CCCCCCCNC=O Amb27170738 [0,0,0,0,0,0|1,0,2]=3 56 B9R0.45 CCCCCCCOC=O Amb9787223 [0,0,0,0,0,0|1,0,2]=3 57 B9R0.45 CCCCCCCOCC Amb26332517 [0,0,0,0,0,0|2,0,2]=4 58 B9R0.45 CCCCCCNCCC Amb6730565 [0,0,0,0,0,0|2,0,2]=4 59 B9R0.45 CCCCCCOCC=O Amb26624223 [0,0,0,0,0,0|1,0,2]=3 60 B9R0.45 CCCCCCOCCC Amb27838831 [0,0,0,0,0,0|2,0,2]=4 61 B9R0.45 CCCCCC\C=C/CO Amb10807383 [0,0,0,0,0,0|2,0,1]=3 62 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [0,0,0,0,0,0|0,0,4]=4 63 B9R0.45 CCCCCC\C=C\CO Amb22168300 [0,0,0,0,0,0|2,0,1]=3 64 B9R0.45 CCCCCC\C=C\OC Amb30621739 [0,0,0,0,0,0|2,0,1]=3 65 B9R0.45 CCCCCOCCC=O Amb27628424 [0,0,0,0,0,0|1,0,2]=3 66 B9R0.45 CCCCC\C=C\OCC Amb27590195 [0,0,0,0,0,0|2,0,2]=4 67 B9R0.45 CCCCNC\C=C\CN Amb27391026 [0,0,0,0,0,0|3,0,1]=4 68 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [0,0,0,0,0,0|3,0,1]=4 69 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.45 CCCCOC\C=C\CN Amb27877410 [0,0,0,0,0,0|3,0,1]=4 71 B9R0.45 CCCCOC\C=C\CO Amb28453524 [0,0,0,0,0,0|3,0,1]=4 72 B9R0.45 CCCCOC\C=C\CS Amb27809829 [0,0,0,0,0,0|3,0,1]=4 73 B9R0.45 CCCCSC\C=C\CO Amb28205928 [0,0,0,0,0,0|3,0,1]=4 74 B9R0.45 CCCCSC\C=C\CS Amb27632116 [0,0,0,0,0,0|3,0,1]=4 75 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [0,0,0,0,0,0|0,0,4]=4 76 B9R0.45 CCCNCCCCCBr Amb27614955 [0,0,0,0,0,0|2,0,2]=4 77 B9R0.45 CCCNCCCCCO Amb17334254 [0,0,0,0,0,0|1,0,3]=4 78 B9R0.45 CCCNCCCCSC Amb18798068 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.45 CCCOCCCCCBr Amb27494337 [0,0,0,0,0,0|2,0,2]=4 80 B9R0.45 CCCOCCCCCN Amb27869443 [0,0,0,0,0,0|2,0,2]=4 81 B9R0.45 CCCOCCCNC=O Amb27453700 [0,0,0,0,0,0|2,0,1]=3 82 B9R0.45 CCCSCCCCC#N Amb18178253 [0,0,0,0,0,0|2,0,2]=4 83 B9R0.45 CCCSCCCCCBr Amb27603024 [0,0,0,0,0,0|2,0,2]=4 84 B9R0.45 CCCSCCCCCCl Amb9304986 [0,0,0,0,0,0|2,0,2]=4 85 B9R0.45 CCCSCCCCCS Amb27431515 [0,0,0,0,0,0|1,1,2]=4 86 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [0,0,0,0,0,0|0,0,2]=2 87 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,0,0,0,0,0|1,0,3]=4 88 B9R0.45 CCC\C=C\CCCCN Amb33373745 [0,0,0,0,0,0|1,0,3]=4 89 B9R0.45 CCC\C=C\CCN=C=O Amb33327158 [0,0,0,0,0,0|1,0,3]=4 90 B9R0.45 CCC\C=C\C\C=C\C=O Amb27635823 [0,0,0,0,0,0|0,0,4]=4 91 B9R0.45 CCNCCCCCCN Amb25855319 [0,0,0,0,0,0|2,0,2]=4 92 B9R0.45 CCNCCCCCOC Amb28186272 [0,0,0,0,0,0|3,0,1]=4 93 B9R0.45 CCNCCCCCSC Amb27167121 [0,0,0,0,0,0|3,0,1]=4 94 B9R0.45 CCOCCCCCCS Amb27834959 [0,0,0,0,0,0|1,1,2]=4 95 B9R0.45 CCOCCCCNC=O Amb27634560 [0,0,0,0,0,0|2,0,1]=3 96 B9R0.45 CCOCCOCCC=O Amb27167183 [0,0,0,0,0,0|2,0,1]=3 97 B9R0.45 CCONCCCCCO Amb28245082 [0,0,0,0,0,0|2,0,2]=4 98 B9R0.45 CCSCCCCCCCl Amb18186755 [0,0,0,0,0,0|2,0,2]=4 99 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [0,0,0,0,0,0|0,0,4]=4 100 B9R0.45 CC\C=C/CCCN=[N+]=[N-] Amb27794716 [0,0,0,0,0,0|3,0,0]=3 101 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [0,0,0,0,0,0|1,0,0]=1 102 B9R0.45 CC\C=C/CC\C=C\C=O Amb2720527 [0,0,0,0,0,0|0,0,2]=2 103 B9R0.45 CC\C=C/CC\C=C\CO Amb8515211 [0,0,0,0,0,0|0,0,4]=4 104 B9R0.45 CC\C=C/C\C=C/CC=O Amb18643319 [0,0,0,0,0,0|0,0,2]=2 105 B9R0.45 CC\C=C/C\C=C/CCO Amb22226805 [0,0,0,0,0,0|0,0,4]=4 106 B9R0.45 CC\C=C\C#CCCCO Amb28050570 [0,0,0,0,0,0|0,0,4]=4 107 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [0,0,0,0,0,0|0,0,4]=4 108 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [0,0,0,0,0,0|0,0,4]=4 109 B9R0.45 CC\C=C\C=C\CCC=O Amb27841138 [0,0,0,0,0,0|0,0,2]=2 110 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,0,0,0,0,0|1,0,1]=2 111 B9R0.45 CC\C=C\CC\C=C\C#N Amb26607477 [0,0,0,0,0,0|1,0,3]=4 112 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [0,0,0,0,0,0|0,0,2]=2 113 B9R0.45 CC\C=C\CC\C=C\CBr Amb26333018 [0,0,0,0,0,0|1,0,3]=4 114 B9R0.45 CC\C=C\CC\C=C\CC Amb24558322 [0,0,0,0,0,0|1,0,3]=4 115 B9R0.45 CC\C=C\CNCCOC Amb27432873 [0,0,0,0,0,0|3,0,0]=3 116 B9R0.45 CC\C=C\COCCCC Amb25912010 [0,0,0,0,0,0|2,0,1]=3 117 B9R0.45 CC\C=C\C\C=C\CC=O Amb28255687 [0,0,0,0,0,0|0,0,2]=2 118 B9R0.45 CC\C=C\C\C=C\CCO Amb27982236 [0,0,0,0,0,0|0,0,4]=4 119 B9R0.45 CC\N=N\CCCCCO Amb27631929 [0,0,0,0,0,0|2,0,2]=4 120 B9R0.45 COCCNC\C=C\CN Amb27489500 [0,0,0,0,0,0|4,0,0]=4 121 B9R0.45 COCCOC\C=C\CN Amb27459640 [0,0,0,0,0,0|4,0,0]=4 122 B9R0.45 COCCSC\C=C\CCl Amb28075250 [0,0,0,0,0,0|4,0,0]=4 123 B9R0.45 CO\C=C\CCCNC=O Amb27223364 [0,0,0,0,0,0|2,0,0]=2 124 B9R0.45 CO\N=C\CCCCC=O Amb27422978 [0,0,0,0,0,0|2,0,0]=2 125 B9R0.45 CSCCCCCNC=O Amb27165514 [0,0,0,0,0,0|2,0,2]=4 126 B9R0.45 CSCCCC\C=C\CO Amb27604531 [0,0,0,0,0,0|3,0,0]=3 127 B9R0.45 CSCCOC\C=C\CCl Amb28369177 [0,0,0,0,0,0|4,0,0]=4 128 B9R0.45 CSCCOC\C=C\CS Amb27188248 [0,0,0,0,0,0|4,0,0]=4 129 B9R0.45 CSCCSC\C=C\CCl Amb28186041 [0,0,0,0,0,0|4,0,0]=4 130 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [0,0,0,0,0,0|1,0,3]=4 131 B9R0.45 C\C=C/CCCCCCC Amb26019969 [0,0,0,0,0,0|1,0,3]=4 132 B9R0.45 C\C=C\C=C=CCCC=O Amb24682775 [0,0,0,0,0,0|0,0,3]=3 133 B9R0.45 C\C=C\C=C\CCCCBr Amb28137170 [0,0,0,0,0,0|1,0,3]=4 134 B9R0.45 C\C=C\CCCCCCO Amb27980554 [0,0,0,0,0,0|0,0,4]=4 135 B9R0.45 C\C=C\CCCCCNC Amb26398871 [0,0,0,0,0,0|2,0,2]=4 136 B9R0.45 C\C=C\CNC\C=C\CC Amb28201963 [0,0,0,0,0,0|2,0,1]=3 137 B9R0.45 C\C=C\CNC\C=C\CCl Amb27617645 [0,0,0,0,0,0|3,0,1]=4 138 B9R0.45 C\C=C\COC\C=C\CCl Amb27168340 [0,0,0,0,0,0|3,0,1]=4 139 B9R0.45 C\C=C\C\C=C\CCC=O Amb27646624 [0,0,0,0,0,0|0,0,4]=4 140 B9R0.45 C\C=C\OCCCCCO Amb28350349 [0,0,0,0,0,0|1,0,3]=4 141 B9R0.45 N#CCCCCCCC=O Amb26516252 [0,0,0,0,0,0|1,0,3]=4 142 B9R0.45 N#CCCCC\C=C\CBr Amb27450252 [0,0,0,0,0,0|2,0,1]=3 143 B9R0.45 N#CCCCC\C=C\CCl Amb24505139 [0,0,0,0,0,0|2,0,1]=3 144 B9R0.45 N#CCCCC\C=C\CO Amb27770521 [0,0,0,0,0,0|2,0,1]=3 145 B9R0.45 N#C\C=C\C=C\CCC=O Amb27590706 [0,0,0,0,0,0|1,0,3]=4 146 B9R0.45 NCCCCCCNC=O Amb28251393 [0,0,0,0,0,0|2,0,2]=4 147 B9R0.45 NCCCNCCCC=O Amb27489145 [0,0,0,0,0,0|2,0,2]=4 148 B9R0.45 NC\C=C\CNCCCF Amb27881245 [0,0,0,0,0,0|3,0,1]=4 149 B9R0.45 NC\C=C\CSCCCO Amb27669770 [0,0,0,0,0,0|2,0,2]=4 150 B9R0.45 O=CCCCCCCC=O Amb27836602 [0,0,0,0,0,0|1,0,3]=4 151 B9R0.45 O=CCCCCCCCF Amb25075653 [0,0,0,0,0,0|1,0,2]=3 152 B9R0.45 O=CCCCCCCCO Amb25765567 [0,0,0,0,0,0|1,0,2]=3 153 B9R0.45 O=CCCCC\C=C\CF Amb27435440 [0,0,0,0,0,0|1,0,0]=1 154 B9R0.45 O=CCOCCOCCO Amb26024891 [0,0,0,0,0,0|3,0,1]=4 155 B9R0.45 O=CNCCC\C=C\CO Amb26994607 [0,0,0,0,0,0|2,0,0]=2 156 B9R0.45 O=C\C=C/CCCCC=O Amb27168965 [0,0,0,0,0,0|1,0,1]=2 157 B9R0.45 O=C\C=C\CC\C=C\C=O Amb27837987 [0,0,0,0,0,0|1,0,3]=4 158 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [0,0,0,0,0,0|2,0,1]=3 159 B9R0.45 OC\C=C\CCCCCO Amb27204813 [0,0,0,0,0,0|1,0,2]=3 160 B9R0.45 [N-]=[N+]=NCCC\C=C\CBr Amb28135784 [0,0,0,0,0,0|4,0,0]=4 161 B9R0.45 [N-]=[N+]=NCCC\C=C\CO Amb28368619 [0,0,0,0,0,0|4,0,0]=4 162 B8R0.4 C#CCCCCCC=O Amb25779363 [1,0,0,0,0,0|0,0,3]=4 163 B8R0.4 C#CCCCCCCC Amb3940501 [1,0,0,0,0,0|1,0,2]=4 164 B8R0.4 C#CCCCC\C=C/C Amb28291350 [1,0,0,0,0,0|1,0,1]=3 165 B8R0.4 C#CCCCC\C=C\C Amb28077120 [1,0,0,0,0,0|1,0,1]=3 166 B8R0.4 C#CCCC\C=C\CBr Amb27484040 [1,0,0,0,0,0|1,0,2]=4 167 B8R0.4 C=CCCCCCC=O Amb26017982 [1,0,0,0,0,0|0,0,2]=3 168 B8R0.4 C=CCCCCCCBr Amb3940223 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.4 C=CCCCCCCC Amb3940502 [1,0,0,0,0,0|1,0,1]=3 170 B8R0.4 C=CCCCCCCCl Amb6298879 [1,0,0,0,0,0|2,0,1]=4 171 B8R0.4 C=CCCCCCCI Amb26577493 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.4 C=CCCCCCCN Amb33543931 [1,0,0,0,0,0|2,0,1]=4 173 B8R0.4 C=CCCCCCCO Amb22230162 [1,0,0,0,0,0|2,0,1]=4 174 B8R0.4 C=CCCCCCNC Amb19335339 [1,0,0,0,0,0|2,0,1]=4 175 B8R0.4 C=CCCCCCSC Amb27780646 [1,0,0,0,0,0|2,0,1]=4 176 B8R0.4 C=CCCCCNCC Amb27461423 [1,0,0,0,0,0|2,0,0]=3 177 B8R0.4 C=CCCC\C=C\CBr Amb27477769 [1,0,0,0,0,0|1,0,1]=3 178 B8R0.4 C=CCCC\C=C\CO Amb19930201 [1,0,0,0,0,0|1,0,1]=3 179 B8R0.4 C=CCCNC\C=C\C Amb26455080 [1,0,0,0,0,0|2,0,0]=3 180 B8R0.4 C=CCCOCCC=O Amb28341311 [1,0,0,0,0,0|1,0,2]=4 181 B8R0.4 C=CCCSCCC=O Amb27424727 [1,0,0,0,0,0|1,0,2]=4 182 B8R0.4 C=CCCSCCCC Amb28078650 [1,0,0,0,0,0|2,0,1]=4 183 B8R0.4 C=CCNCCCCC Amb6706493 [1,0,0,0,0,0|2,0,1]=4 184 B8R0.4 C=CCNCCNCC Amb27185783 [1,0,0,0,0,0|3,0,0]=4 185 B8R0.4 C=CCNC\C=C\CC Amb27432892 [1,0,0,0,0,0|1,0,1]=3 186 B8R0.4 C=CCOCCCC=O Amb26885457 [1,0,0,0,0,0|1,0,2]=4 187 B8R0.4 C=CCOC\C=C/CBr Amb27768655 [1,0,0,0,0,0|2,0,1]=4 188 B8R0.4 C=CCOC\C=C\CBr Amb27433951 [1,0,0,0,0,0|2,0,1]=4 189 B8R0.4 C=CCONC\C=C\C Amb27424394 [1,0,0,0,0,0|3,0,0]=4 190 B8R0.4 C=CCSCCCCC Amb27837635 [1,0,0,0,0,0|2,0,1]=4 191 B8R0.4 C=CCSC\C=C\CN Amb27953494 [1,0,0,0,0,0|2,0,1]=4 192 B8R0.4 C=CCSC\C=C\CO Amb27761655 [1,0,0,0,0,0|2,0,1]=4 193 B8R0.4 C=CNCCCCCC Amb27398596 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.4 C=COCCCCCC Amb24440550 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.4 C=COCCCNC=O Amb27461474 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.4 C=COCCCNCC Amb6735761 [1,0,0,0,0,0|3,0,0]=4 197 B8R0.4 C=C\C=C\CCCCBr Amb32688174 [1,0,0,0,0,0|1,0,2]=4 198 B8R0.4 C=C\C=C\CCCCC Amb22641683 [1,0,0,0,0,0|0,0,3]=4 199 B8R0.4 C=C\C=C\CCCCCl Amb32688173 [1,0,0,0,0,0|1,0,2]=4 200 B8R0.4 CC#CCCCCC=O Amb27827379 [1,0,0,0,0,0|0,0,2]=3 201 B8R0.4 CCC#CCCCCC Amb9134716 [1,0,0,0,0,0|0,0,3]=4 202 B8R0.4 CCC#CCCCCN Amb28049876 [1,0,0,0,0,0|1,0,2]=4 203 B8R0.4 CCC#CCCCCO Amb26362942 [1,0,0,0,0,0|0,0,3]=4 204 B8R0.4 CCCCCC#CC=O Amb9825881 [1,0,0,0,0,0|0,0,3]=4 205 B8R0.4 CCCCCCCC#N Amb7764637 [1,0,0,0,0,0|1,0,2]=4 206 B8R0.4 CCCCCCCC=O Amb6891949 [1,0,0,0,0,0|0,0,1]=2 207 B8R0.4 CCCCCCCCBr Amb2689971 [1,0,0,0,0,0|1,0,2]=4 208 B8R0.4 CCCCCCCCC Amb8513269 [1,0,0,0,0,0|0,0,3]=4 209 B8R0.4 CCCCCCCCCl Amb7757832 [1,0,0,0,0,0|1,0,2]=4 210 B8R0.4 CCCCCCCCF Amb10840379 [1,0,0,0,0,0|1,0,2]=4 211 B8R0.4 CCCCCCCCI Amb637144 [1,0,0,0,0,0|1,0,2]=4 212 B8R0.4 CCCCCCCCN Amb2720240 [1,0,0,0,0,0|1,0,2]=4 213 B8R0.4 CCCCCCCCN Amb3940466 [1,0,0,0,0,0|1,0,2]=4 214 B8R0.4 CCCCCCCCO Amb6608788 [1,0,0,0,0,0|0,0,3]=4 215 B8R0.4 CCCCCCCCS Amb8513530 [1,0,0,0,0,0|0,1,2]=4 216 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [1,0,0,0,0,0|0,1,2]=4 217 B8R0.4 CCCCCCCNC Amb7761453 [1,0,0,0,0,0|2,0,1]=4 218 B8R0.4 CCCCCCCNN Amb7794376 [1,0,0,0,0,0|2,0,1]=4 219 B8R0.4 CCCCCCCOC Amb24584912 [1,0,0,0,0,0|2,0,1]=4 220 B8R0.4 CCCCCCCSC Amb22359861 [1,0,0,0,0,0|2,0,1]=4 221 B8R0.4 CCCCCCN=C=O Amb8516659 [1,0,0,0,0,0|1,0,2]=4 222 B8R0.4 CCCCCCNC=S Amb27880264 [1,0,0,0,0,0|1,1,1]=4 223 B8R0.4 CCCCCCNCC Amb6730567 [1,0,0,0,0,0|1,0,2]=4 224 B8R0.4 CCCCCCOCC Amb17672946 [1,0,0,0,0,0|1,0,2]=4 225 B8R0.4 CCCCCCON=O Amb17672945 [1,0,0,0,0,0|2,0,1]=4 226 B8R0.4 CCCCCC\C=C\Br Amb24677708 [1,0,0,0,0,0|1,0,2]=4 227 B8R0.4 CCCCCC\C=C\I Amb24446897 [1,0,0,0,0,0|1,0,2]=4 228 B8R0.4 CCCCCNCCC Amb6688182 [1,0,0,0,0,0|1,0,2]=4 229 B8R0.4 CCCCCOCC=O Amb27230502 [1,0,0,0,0,0|1,0,1]=3 230 B8R0.4 CCCCC\C=C\C#N Amb18642132 [1,0,0,0,0,0|1,0,2]=4 231 B8R0.4 CCCCC\C=C\CBr Amb17666913 [1,0,0,0,0,0|1,0,1]=3 232 B8R0.4 CCCCC\C=C\CO Amb33038088 [1,0,0,0,0,0|1,0,1]=3 233 B8R0.4 CCCCC\C=N\OC Amb28204102 [1,0,0,0,0,0|2,0,1]=4 234 B8R0.4 CCCCOCCC=O Amb27880111 [1,0,0,0,0,0|1,0,1]=3 235 B8R0.4 CCCCOCNC=O Amb27392745 [1,0,0,0,0,0|2,0,1]=4 236 B8R0.4 CCCCSCNC=O Amb27656061 [1,0,0,0,0,0|2,0,1]=4 237 B8R0.4 CCCCS\C=C\CO Amb27219509 [1,0,0,0,0,0|2,0,1]=4 238 B8R0.4 CCCC\C=C\OCC Amb17674075 [1,0,0,0,0,0|1,0,2]=4 239 B8R0.4 CCCNCCCCI Amb28072729 [1,0,0,0,0,0|2,0,1]=4 240 B8R0.4 CCCNCCCCN Amb17334115 [1,0,0,0,0,0|2,0,1]=4 241 B8R0.4 CCCNCCCCS Amb28349265 [1,0,0,0,0,0|1,1,1]=4 242 B8R0.4 CCCOCCCC=O Amb27795367 [1,0,0,0,0,0|1,0,1]=3 243 B8R0.4 CCCOCCCCBr Amb8874783 [1,0,0,0,0,0|2,0,1]=4 244 B8R0.4 CCCOCCCCCl Amb18181651 [1,0,0,0,0,0|2,0,1]=4 245 B8R0.4 CCCOCCCCO Amb27395455 [1,0,0,0,0,0|1,0,2]=4 246 B8R0.4 CCCOC\C=C\CCl Amb27628817 [1,0,0,0,0,0|2,0,1]=4 247 B8R0.4 CCCSCCCCCl Amb18798739 [1,0,0,0,0,0|2,0,1]=4 248 B8R0.4 CCCSCCCCN Amb9391521 [1,0,0,0,0,0|2,0,1]=4 249 B8R0.4 CCCSCCCCO Amb9370795 [1,0,0,0,0,0|1,0,2]=4 250 B8R0.4 CCCSCCCCS Amb27766901 [1,0,0,0,0,0|1,1,1]=4 251 B8R0.4 CCCSCCNC=O Amb27630895 [1,0,0,0,0,0|2,0,1]=4 252 B8R0.4 CCC\C=C/CCCC Amb26023943 [1,0,0,0,0,0|0,0,3]=4 253 B8R0.4 CCC\C=C\CCC=O Amb33172232 [1,0,0,0,0,0|0,0,2]=3 254 B8R0.4 CCC\C=C\CCCBr Amb26574256 [1,0,0,0,0,0|1,0,2]=4 255 B8R0.4 CCC\C=C\CCCC Amb2778543 [1,0,0,0,0,0|0,0,3]=4 256 B8R0.4 CCC\C=C\CCCN Amb33327176 [1,0,0,0,0,0|1,0,2]=4 257 B8R0.4 CCC\C=C\CCCS Amb33373717 [1,0,0,0,0,0|0,1,2]=4 258 B8R0.4 CCC\C=C\COC=O Amb22231662 [1,0,0,0,0,0|1,0,2]=4 259 B8R0.4 CCC\C=N\CCCC Amb19375587 [1,0,0,0,0,0|1,0,2]=4 260 B8R0.4 CCNCCCCC#N Amb27763344 [1,0,0,0,0,0|2,0,1]=4 261 B8R0.4 CCNCCCCCF Amb27956469 [1,0,0,0,0,0|2,0,1]=4 262 B8R0.4 CCNCCCCCI Amb27761837 [1,0,0,0,0,0|2,0,1]=4 263 B8R0.4 CCNCCCCCN Amb27447573 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.4 CCNCCCCCO Amb17334130 [1,0,0,0,0,0|1,0,2]=4 265 B8R0.4 CCNCCCCOC Amb27837458 [1,0,0,0,0,0|3,0,0]=4 266 B8R0.4 CCNCCCCSC Amb27837487 [1,0,0,0,0,0|3,0,0]=4 267 B8R0.4 CCNCCCNC=O Amb27220690 [1,0,0,0,0,0|2,0,0]=3 268 B8R0.4 CCOCCCCCBr Amb24502334 [1,0,0,0,0,0|2,0,1]=4 269 B8R0.4 CCOCCCCCCl Amb9001650 [1,0,0,0,0,0|2,0,1]=4 270 B8R0.4 CCOCCCCCS Amb27835597 [1,0,0,0,0,0|1,1,1]=4 271 B8R0.4 CCOCCCCNC Amb28049603 [1,0,0,0,0,0|3,0,0]=4 272 B8R0.4 CCOCCCN=C=O Amb2092862 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.4 CCOCCOCC=O Amb33539619 [1,0,0,0,0,0|2,0,0]=3 274 B8R0.4 CCOCC\C=C\CCl Amb27470132 [1,0,0,0,0,0|2,0,1]=4 275 B8R0.4 CCONCCCCO Amb28326276 [1,0,0,0,0,0|2,0,1]=4 276 B8R0.4 CCSCCCCC=O Amb24690525 [1,0,0,0,0,0|1,0,0]=2 277 B8R0.4 CCSCCCCCBr Amb25887441 [1,0,0,0,0,0|2,0,1]=4 278 B8R0.4 CCSCCCCCCl Amb9304998 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.4 CCSCCCCCF Amb28207049 [1,0,0,0,0,0|2,0,1]=4 280 B8R0.4 CCSCCCCCN Amb28049047 [1,0,0,0,0,0|2,0,1]=4 281 B8R0.4 CCSCCCCNC Amb27837488 [1,0,0,0,0,0|3,0,0]=4 282 B8R0.4 CCSCCCCOC Amb27651458 [1,0,0,0,0,0|3,0,0]=4 283 B8R0.4 CCSCCCN=C=O Amb24710786 [1,0,0,0,0,0|2,0,1]=4 284 B8R0.4 CCSCCCNC=O Amb27457130 [1,0,0,0,0,0|2,0,0]=3 285 B8R0.4 CC\C=C/CCCCC Amb25258581 [1,0,0,0,0,0|0,0,1]=2 286 B8R0.4 CC\C=C/CCCCN Amb28313712 [1,0,0,0,0,0|1,0,0]=2 287 B8R0.4 CC\C=C/CCCCO Amb22052636 [1,0,0,0,0,0|0,0,1]=2 288 B8R0.4 CC\C=C/CCOC=O Amb22230430 [1,0,0,0,0,0|1,0,0]=2 289 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [1,0,0,0,0,0|0,0,2]=3 290 B8R0.4 CC\C=C\CC#CCO Amb27398594 [1,0,0,0,0,0|0,0,3]=4 291 B8R0.4 CC\C=C\CCCC=O Amb33171685 [1,0,0,0,0,0|0,0,0]=1 292 B8R0.4 CC\C=C\CCCCC Amb22347893 [1,0,0,0,0,0|0,0,1]=2 293 B8R0.4 CC\C=C\CCCCN Amb33079175 [1,0,0,0,0,0|1,0,0]=2 294 B8R0.4 CC\C=C\CCN=C=O Amb33359304 [1,0,0,0,0,0|1,0,1]=3 295 B8R0.4 CC\C=C\CCNCC Amb27647277 [1,0,0,0,0,0|1,0,1]=3 296 B8R0.4 CC\C=C\CCOC=O Amb25147211 [1,0,0,0,0,0|1,0,0]=2 297 B8R0.4 CC\C=C\CCSCC Amb27260956 [1,0,0,0,0,0|1,0,1]=3 298 B8R0.4 CC\C=C\CC\C=C\I Amb28071366 [1,0,0,0,0,0|1,0,1]=3 299 B8R0.4 CC\C=C\C\C=C\CCl Amb27628399 [1,0,0,0,0,0|1,0,2]=4 300 B8R0.4 COCCCCCC=O Amb27467958 [1,0,0,0,0,0|1,0,1]=3 301 B8R0.4 COCCOCCC=O Amb26078964 [1,0,0,0,0,0|2,0,1]=4 302 B8R0.4 COCCSCCC=O Amb27837422 [1,0,0,0,0,0|2,0,1]=4 303 B8R0.4 COCOCCCC=O Amb27234488 [1,0,0,0,0,0|2,0,1]=4 304 B8R0.4 COC\C=C\CCC=O Amb26931864 [1,0,0,0,0,0|1,0,2]=4 305 B8R0.4 CO\C=C\CCCCO Amb27448464 [1,0,0,0,0,0|1,0,1]=3 306 B8R0.4 CO\N=C\CCCC=O Amb27408636 [1,0,0,0,0,0|2,0,0]=3 307 B8R0.4 CO\N=C\CCCCO Amb28049141 [1,0,0,0,0,0|2,0,1]=4 308 B8R0.4 CSCCCCCC=O Amb27981887 [1,0,0,0,0,0|1,0,1]=3 309 B8R0.4 CSCCCCNC=O Amb28366040 [1,0,0,0,0,0|2,0,1]=4 310 B8R0.4 CSCCCOCC=O Amb28286017 [1,0,0,0,0,0|2,0,1]=4 311 B8R0.4 CSCCOCCC=O Amb27823932 [1,0,0,0,0,0|2,0,1]=4 312 B8R0.4 CSCCSCCC=O Amb27956184 [1,0,0,0,0,0|2,0,1]=4 313 B8R0.4 C\C=C/C=C/CCCBr Amb27878672 [1,0,0,0,0,0|1,0,2]=4 314 B8R0.4 C\C=C/CCCCC=O Amb26854801 [1,0,0,0,0,0|0,0,0]=1 315 B8R0.4 C\C=C/CCCCCC Amb27478896 [1,0,0,0,0,0|1,0,1]=3 316 B8R0.4 C\C=C/CCC\C=C/C Amb22230407 [1,0,0,0,0,0|1,0,1]=3 317 B8R0.4 C\C=C/CCC\C=C\C Amb28142478 [1,0,0,0,0,0|1,0,1]=3 318 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [1,0,0,0,0,0|0,0,3]=4 319 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,0,0,0,0|0,0,3]=4 320 B8R0.4 C\C=C\CCCCCC Amb19930200 [1,0,0,0,0,0|1,0,1]=3 321 B8R0.4 C\C=C\CCCCCO Amb25247777 [1,0,0,0,0,0|0,0,2]=3 322 B8R0.4 C\C=C\CCCCNO Amb27849039 [1,0,0,0,0,0|1,0,1]=3 323 B8R0.4 C\C=C\CCC\C=C\C Amb27776888 [1,0,0,0,0,0|1,0,1]=3 324 B8R0.4 C\C=C\CCNCC#N Amb28422640 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [1,0,0,0,0,0|0,0,2]=3 326 B8R0.4 C\C=C\CNCCCI Amb27652349 [1,0,0,0,0,0|2,0,1]=4 327 B8R0.4 C\C=C\CNCCCN Amb27175088 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.4 C\C=C\COCCC#N Amb27779498 [1,0,0,0,0,0|2,0,1]=4 329 B8R0.4 C\C=C\COCCCBr Amb27949261 [1,0,0,0,0,0|2,0,1]=4 330 B8R0.4 C\C=C\COCCNC Amb27852522 [1,0,0,0,0,0|3,0,0]=4 331 B8R0.4 C\C=C\CSCCOC Amb27766159 [1,0,0,0,0,0|3,0,0]=4 332 B8R0.4 C\C=C\CSC\C=C\C Amb28049278 [1,0,0,0,0,0|2,0,1]=4 333 B8R0.4 C\C=C\C\C=C\CC=O Amb27489085 [1,0,0,0,0,0|0,0,2]=3 334 B8R0.4 C\C=C\OCCCCO Amb27486247 [1,0,0,0,0,0|1,0,2]=4 335 B8R0.4 FCCNC\C=C\CCl Amb27663609 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.4 N#CCCCCCC=O Amb18642301 [1,0,0,0,0,0|1,0,2]=4 337 B8R0.4 N#CCCC\C=C/CBr Amb28325715 [1,0,0,0,0,0|2,0,1]=4 338 B8R0.4 N#CSCCCCC=O Amb28436745 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.4 N#C\C=C\CCCC=O Amb18642109 [1,0,0,0,0,0|1,0,1]=3 340 B8R0.4 N#C\C=C\CCCCBr Amb27965026 [1,0,0,0,0,0|2,0,1]=4 341 B8R0.4 N#C\C=C\CCCCCl Amb27622521 [1,0,0,0,0,0|2,0,1]=4 342 B8R0.4 NCCCC\C=C\CO Amb24117507 [1,0,0,0,0,0|2,0,0]=3 343 B8R0.4 NCCCC\C=C\CO Amb27780423 [1,0,0,0,0,0|2,0,0]=3 344 B8R0.4 NC\C=C\CSCCO Amb27185672 [1,0,0,0,0,0|2,0,1]=4 345 B8R0.4 O=CCCCC#CCBr Amb27478060 [1,0,0,0,0,0|1,0,2]=4 346 B8R0.4 O=CCCCCCCBr Amb22755463 [1,0,0,0,0,0|1,0,1]=3 347 B8R0.4 O=CCCCCCCCl Amb27262031 [1,0,0,0,0,0|1,0,1]=3 348 B8R0.4 O=CCCCCNC=O Amb27841683 [1,0,0,0,0,0|2,0,0]=3 349 B8R0.4 O=CCCC\C=C\CO Amb27169480 [1,0,0,0,0,0|1,0,0]=2 350 B8R0.4 O=CCCOCCCO Amb28428559 [1,0,0,0,0,0|2,0,1]=4 351 B8R0.4 O=CCC\C=C/C=C/Br Amb27484031 [1,0,0,0,0,0|1,0,2]=4 352 B8R0.4 O=CCC\C=C\CCBr Amb25961650 [1,0,0,0,0,0|1,0,2]=4 353 B8R0.4 O=C\C=C/CCCC=O Amb28202061 [1,0,0,0,0,0|1,0,1]=3 354 B8R0.4 OC\C=C\CCCCO Amb27642149 [1,0,0,0,0,0|1,0,1]=3 355 B8R0.4 [C-]#[N+]CCCCCC=O Amb27424636 [1,0,0,0,0,0|1,0,2]=4 356 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [1,0,0,0,0,0|2,0,1]=4 357 B10R0.1 C=CCCCCC(=O)OCC Amb6298911 [0,1,0,0,0,0|2,0,0]=3 358 B10R0.1 C=CCCNCC(=O)OCC Amb33545654 [0,1,0,0,0,0|3,0,0]=4 359 B10R0.1 C=CCCOCC(=O)OCC Amb7793841 [0,1,0,0,0,0|3,0,0]=4 360 B10R0.1 C=CCNCCC(=O)OCC Amb8867193 [0,1,0,0,0,0|3,0,0]=4 361 B10R0.1 CCCCCCC(=O)CCC Amb8513848 [0,1,0,0,0,0|1,0,2]=4 362 B10R0.1 CCCCCCC(=O)OCC Amb8515401 [0,1,0,0,0,0|2,0,1]=4 363 B10R0.1 CCOC(=O)CCCCC#N Amb32665125 [0,1,0,0,0,0|2,0,1]=4 364 B10R0.1 CCOC(=O)CCCCCBr Amb2720508 [0,1,0,0,0,0|2,0,1]=4 365 B10R0.1 CCOC(=O)CCCCCCl Amb32665801 [0,1,0,0,0,0|2,0,1]=4 366 B10R0.1 CCOC(=O)CCCCCN Amb10553125 [0,1,0,0,0,0|2,0,1]=4 367 B10R0.1 CCOC(=O)CCCCCN Amb6479233 [0,1,0,0,0,0|2,0,1]=4 368 B10R0.1 CCOC(=O)CCCCCO Amb3939201 [0,1,0,0,0,0|1,0,2]=4 369 B10R0.1 CCOC(=O)CCCCNC Amb33803534 [0,1,0,0,0,0|3,0,0]=4 370 B10R0.1 CCOC(=O)CCCN=C=O Amb3939386 [0,1,0,0,0,0|2,0,1]=4 371 B10R0.1 C[C@@H](CC=O)CCC#CCBr Amb27673501 [0,1,0,0,0,0|1,0,2]=4 372 B10R0.4 C=C(Br)CCCCCCCC Amb6298935 [0,1,0,0,0,0|1,0,2]=4 373 B10R0.4 C=C(C)CCCCCCCC Amb6298941 [0,1,0,0,0,0|1,0,2]=4 374 B10R0.4 C=C(C)\C=C\CCCCCC Amb22546604 [0,1,0,0,0,0|1,0,2]=4 375 B10R0.4 C=C(Cl)CCCCCCCC Amb6298929 [0,1,0,0,0,0|1,0,2]=4 376 B10R0.4 C=CCCCCCC[C@@H](C)O Amb30594444 [0,1,0,0,0,0|1,0,2]=4 377 B10R0.4 C=CCCCCNCC(C)C Amb32651007 [0,1,0,0,0,0|2,0,1]=4 378 B10R0.4 CC(=O)CCCCC#CCBr Amb27673518 [0,1,0,0,0,0|1,0,2]=4 379 B10R0.4 CC(=O)CCCCC#CCO Amb28080242 [0,1,0,0,0,0|1,0,2]=4 380 B10R0.4 CC(=O)NCCCCCC=O Amb24113371 [0,1,0,0,0,0|1,0,2]=4 381 B10R0.4 CCC#CCCCCC(=O)O Amb27269519 [0,1,0,0,0,0|0,0,2]=3 382 B10R0.4 CCC#CCCCCC(N)=O Amb28079386 [0,1,0,0,0,0|0,0,2]=3 383 B10R0.4 CCCC#CCCCC(=O)O Amb27269520 [0,1,0,0,0,0|0,0,3]=4 384 B10R0.4 CCCC#CCCCC(N)=O Amb28079638 [0,1,0,0,0,0|0,0,3]=4 385 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [0,1,0,0,0,0|0,0,2]=3 386 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [0,1,0,0,0,0|0,0,2]=3 387 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [0,1,0,0,0,0|0,0,2]=3 388 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [0,1,0,0,0,0|0,0,2]=3 389 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [0,1,0,0,0,0|0,0,2]=3 390 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [0,1,0,0,0,0|1,0,2]=4 391 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [0,1,0,0,0,0|1,0,2]=4 392 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [0,1,0,0,0,0|1,0,2]=4 393 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [0,1,0,0,0,0|1,0,2]=4 394 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [0,1,0,0,0,0|1,0,2]=4 395 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [0,1,0,0,0,0|1,0,2]=4 396 B10R0.4 CCCCCC\C=C\C(C)O Amb22641689 [0,1,0,0,0,0|1,0,1]=3 397 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [0,1,0,0,0,0|1,0,2]=4 398 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [0,1,0,0,0,0|1,0,2]=4 399 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [0,1,0,0,0,0|2,0,1]=4 400 B10R0.4 CCC\C=C\CCCC(=O)O Amb33079428 [0,1,0,0,0,0|0,0,2]=3 401 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [0,1,0,0,0,0|2,0,1]=4 402 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [0,1,0,0,0,0|1,0,1]=3 403 B10R0.4 CCOCCOCCC(=O)O Amb6273854 [0,1,0,0,0,0|2,0,1]=4 404 B10R0.4 CCOCCOCCC(N)=O Amb18797953 [0,1,0,0,0,0|2,0,1]=4 405 B10R0.4 CC\C=C\CN\C=C\C(=O)O Amb28387904 [0,1,0,0,0,0|1,0,2]=4 406 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [0,1,0,0,0,0|1,0,2]=4 407 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [0,1,0,0,0,0|1,0,2]=4 408 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [0,1,0,0,0,0|1,0,2]=4 409 B10R0.4 O=C(O)CCCCC#CCBr Amb27673513 [0,1,0,0,0,0|1,0,2]=4 410 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [0,1,0,0,0,0|1,0,2]=4 411 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [0,1,0,0,0,0|1,0,2]=4 412 B10R0.4 O=C(O)CCCCOCCO Amb7782972 [0,1,0,0,0,0|2,0,1]=4 413 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [0,1,0,0,0,0|1,0,2]=4 414 B10R0.71 C=CCCCCCCCC=O Amb22734770 [0,1,0,0,0,0|0,0,3]=4 415 B10R0.71 C=CCCCCCCCCBr Amb9786895 [0,1,0,0,0,0|1,0,2]=4 416 B10R0.71 C=CCCCCCCCCN Amb28652858 [0,1,0,0,0,0|1,0,2]=4 417 B10R0.71 C=CCCCCCCCCN Amb32653011 [0,1,0,0,0,0|1,0,2]=4 418 B10R0.71 C=CCCCCCCCCO Amb6364973 [0,1,0,0,0,0|1,0,2]=4 419 B10R0.71 CCCCCCCCCC=O Amb3940437 [0,1,0,0,0,0|0,0,2]=3 420 B10R0.71 CCCCCCCCN=C=O Amb3940552 [0,1,0,0,0,0|0,0,3]=4 421 B10R0.71 CCCCCCCCNC=O Amb9787543 [0,1,0,0,0,0|0,0,2]=3 422 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [0,1,0,0,0,0|0,0,3]=4 423 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [0,1,0,0,0,0|1,0,1]=3 424 B10R0.71 CCCCC\C=C\CCC=O Amb33512982 [0,1,0,0,0,0|0,0,3]=4 425 B10R0.71 CC\C=C\CCCC#CCO Amb28080035 [0,1,0,0,0,0|0,0,3]=4 426 B10R0.71 COCCOCCOCC=O Amb32668382 [0,1,0,0,0,0|2,0,1]=4 427 B10R0.71 C\C=C\C=C\CCCCCC Amb22546597 [0,1,0,0,0,0|1,0,2]=4 428 B10R0.74 C=CCCCCCC(C)CC Amb33457233 [0,1,0,0,0,0|1,0,2]=4 429 B10R0.74 CCC(=O)NCCCCCN Amb18102728 [0,1,0,0,0,0|2,0,1]=4 430 B10R0.74 CCC(=O)OCCCN=C=O Amb32659955 [0,1,0,0,0,0|2,0,1]=4 431 B10R0.74 CCCCCCCC(=O)CC Amb6366429 [0,1,0,0,0,0|1,0,2]=4 432 B10R0.74 CCCCCC\C=C(\I)CC Amb22641682 [0,1,0,0,0,0|1,0,1]=3 433 B10R1.4 C=C1CCCC=C1CCC Amb22749769 [0,0,0,1,0,0|1,0,2]=4 434 B10R1.4 C=C1CCCC\C1=C\CO Amb27242614 [0,0,0,1,0,0|2,0,0]=3 435 B10R1.4 C=CCC1CCC=CC1O Amb28282730 [0,0,0,1,0,0|2,0,0]=3 436 B10R1.4 C=CC[C@@H]1CCC=C[C@@H]1O Amb27651866 [0,0,0,1,0,0|2,0,0]=3 437 B10R1.4 C=C\C=C1/CCCCC1=O Amb27464325 [0,0,0,1,0,0|0,0,2]=3 438 B10R1.4 C=C\C=C1\CCCCC1=O Amb27203837 [0,0,0,1,0,0|0,0,2]=3 439 B10R1.4 CC#CC1CCCCC1=O Amb24736857 [0,0,0,1,0,0|0,0,3]=4 440 B10R1.4 CC1=C(CCCl)CCCC1 Amb28423515 [0,0,0,1,0,0|2,0,1]=4 441 B10R1.4 CC1=C(\C=C/Cl)CCCC1 Amb27791809 [0,0,0,1,0,0|2,0,1]=4 442 B10R1.4 CC1CC=CCC1CC=O Amb27256521 [0,0,0,1,0,0|0,0,2]=3 443 B10R1.4 CC1CCCCC1NC=O Amb27589339 [0,0,0,1,0,0|1,0,2]=4 444 B10R1.4 CC1CNCCN1CC=O Amb27442045 [0,0,0,1,0,0|2,0,1]=4 445 B10R1.4 CC1CSCCN1CC=O Amb27837574 [0,0,0,1,0,0|2,0,1]=4 446 B10R1.4 CCCC1=CCCCC1=O Amb24722898 [0,0,0,1,0,0|0,0,2]=3 447 B10R1.4 CCCC1CCCCC1=O Amb22228916 [0,0,0,1,0,0|0,0,2]=3 448 B10R1.4 CCCC1CCCNC1=O Amb27475482 [0,0,0,1,0,0|1,0,2]=4 449 B10R1.4 CCCC1CCCOC1=O Amb25068420 [0,0,0,1,0,0|1,0,2]=4 450 B10R1.4 CCCC1CCNCC1=O Amb27629020 [0,0,0,1,0,0|1,0,2]=4 451 B10R1.4 CCCC1CSCCC1=O Amb24736412 [0,0,0,1,0,0|1,0,2]=4 452 B10R1.4 CCCN1CCCCC1=S Amb25348522 [0,0,0,1,0,0|1,1,1]=4 453 B10R1.4 CCCN1CCCNC1=O Amb28049410 [0,0,0,1,0,0|2,0,1]=4 454 B10R1.4 CCCN1CCNCC1=O Amb18285094 [0,0,0,1,0,0|2,0,1]=4 455 B10R1.4 CCCN1CCNCC1=O Amb22586868 [0,0,0,1,0,0|2,0,1]=4 456 B10R1.4 CCCN1CCNCC1=O Amb32412620 [0,0,0,1,0,0|2,0,1]=4 457 B10R1.4 CCC[C@@H]1CCCCC1=O Amb25146733 [0,0,0,1,0,0|0,0,2]=3 458 B10R1.4 CCNC1=CCCCC1=O Amb27768741 [0,0,0,1,0,0|1,0,1]=3 459 B10R1.4 CCNC1CCCNC1=O Amb18284476 [0,0,0,1,0,0|2,0,1]=4 460 B10R1.4 CCN[C@H]1CCCNC1=O Amb28367203 [0,0,0,1,0,0|2,0,1]=4 461 B10R1.4 CCOC1=CCCCC1=O Amb4012727 [0,0,0,1,0,0|1,0,1]=3 462 B10R1.4 CCOC1CCCCC1=O Amb4605921 [0,0,0,1,0,0|1,0,1]=3 463 B10R1.4 CCOC1CNCCC1=O Amb32674193 [0,0,0,1,0,0|2,0,1]=4 464 B10R1.4 CCOC1COCCC1=O Amb25838738 [0,0,0,1,0,0|2,0,1]=4 465 B10R1.4 CCSC1=CCCCC1=O Amb27615144 [0,0,0,1,0,0|1,0,1]=3 466 B10R1.4 CC\C=C1/CCCCC1=O Amb24690557 [0,0,0,1,0,0|0,0,0]=1 467 B10R1.4 CC\C=C1\CCCC[C@@H]1O Amb28321399 [0,0,0,1,0,0|0,0,2]=3 468 B10R1.4 CC\C=C1\CCCNC1C Amb27780234 [0,0,0,1,0,0|2,0,1]=4 469 B10R1.4 CN1CCCCC1CC=O Amb27643631 [0,0,0,1,0,0|1,0,2]=4 470 B10R1.4 CN\C=C1\CCC=CC1=O Amb26390892 [0,0,0,1,0,0|1,0,2]=4 471 B10R1.4 COCC1CCCCC1=O Amb25265248 [0,0,0,1,0,0|1,0,2]=4 472 B10R1.4 CO\C=C1\CCCCC1=O Amb17593542 [0,0,0,1,0,0|1,0,0]=2 473 B10R1.4 CO\N=C1\CCCCC1=O Amb27948600 [0,0,0,1,0,0|2,0,0]=3 474 B10R1.4 CS\C=C1/CCCCC1=O Amb22363978 [0,0,0,1,0,0|1,0,0]=2 475 B10R1.4 C\C=C/C1=CCCCC1=O Amb27960867 [0,0,0,1,0,0|0,0,2]=3 476 B10R1.4 C\C=C\[C@@H]1CCC=C[C@@H]1O Amb27210016 [0,0,0,1,0,0|2,0,1]=4 477 B10R1.4 N#CCC1CCC=CC1O Amb27839297 [0,0,0,1,0,0|2,0,1]=4 478 B10R1.4 N#C\C=C1\CCCCC1=O Amb27615149 [0,0,0,1,0,0|1,0,1]=3 479 B10R1.4 NCCC1CCCCC1=O Amb18202696 [0,0,0,1,0,0|1,0,2]=4 480 B10R1.4 NCCN1CCCCC1=O Amb13951132 [0,0,0,1,0,0|2,0,1]=4 481 B10R1.4 NCCN1CCCCC1=O Amb21954327 [0,0,0,1,0,0|2,0,1]=4 482 B10R1.4 NCCN1CCCCC1=O Amb2785016 [0,0,0,1,0,0|2,0,1]=4 483 B10R1.4 O=C1CCCCC1CCO Amb26606412 [0,0,0,1,0,0|1,0,2]=4 484 B10R1.4 O=C1CCCCN1CCO Amb9370459 [0,0,0,1,0,0|2,0,1]=4 485 B10R1.4 O=C1CCCCN1CCS Amb27837905 [0,0,0,1,0,0|2,0,1]=4 486 B10R1.4 O=CCC1CCC=CC1=O Amb28255699 [0,0,0,1,0,0|1,0,1]=3 487 B10R1.4 O=CCC1CCCCC1F Amb28132903 [0,0,0,1,0,0|1,0,2]=4 488 B10R1.4 O=CC[C@@H]1CCCC[C@H]1O Amb27841135 [0,0,0,1,0,0|1,0,2]=4 489 B10R1.4 OCCC1=C(Br)CCCC1 Amb22753170 [0,0,0,1,0,0|2,0,1]=4 490 B10R1.4 OCCC1CCC=CC1O Amb27604882 [0,0,0,1,0,0|1,0,2]=4 491 B10R1.5 C=CCN1CCC=C1CN Amb10604018 [0,0,0,1,0,0|3,0,0]=4 492 B10R1.5 CC#CC1=C(C=O)CCC1 Amb26020584 [0,0,0,1,0,0|0,0,3]=4 493 B10R1.5 CCC1CCC\C1=C/CN Amb28383733 [0,0,0,1,0,0|2,0,1]=4 494 B10R1.5 CCCC1COCC1C=O Amb29882921 [0,0,0,1,0,0|1,0,2]=4 495 B10R1.5 CCc1ccsc1CC=O Amb32729145 [0,0,0,1,0,0|1,0,2]=4 496 B10R1.5 C\C=C/[C@@H]1CCC[C@H]1C=O Amb27248372 [0,0,0,1,0,0|0,0,2]=3 497 B10R1.5 C\C=C1\COCC1CC=O Amb27636932 [0,0,0,1,0,0|1,0,2]=4 498 B10R1.5 C\C=C1\COC[C@@H]1CC=O Amb27970125 [0,0,0,1,0,0|1,0,2]=4 499 B10R1.5 OCC[C@@H]1CCC=C1CO Amb27594183 [0,0,0,1,0,0|1,0,2]=4 500 B10R1.7 CC1=CCCCCCC1=O Amb27951533 [0,0,0,1,0,0|0,0,2]=3 501 B10R1.7 CC1C=CCCCCC1O Amb27756520 [0,0,0,1,0,0|0,0,2]=3 502 B10R1.7 CC1CCCCCCC1=O Amb4020430 [0,0,0,1,0,0|0,0,2]=3 503 B10R1.7 C[C@@H]1C=CCCCC[C@H]1O Amb27481268 [0,0,0,1,0,0|0,0,2]=3 504 B10R1.7 Cl[C@@H]1C=CCCCC[C@H]1Cl Amb27633862 [0,0,0,1,0,0|2,0,1]=4 505 B10R1.7 F[C@@H]1C=CCCCC[C@H]1Br Amb27614160 [0,0,0,1,0,0|2,0,1]=4 506 B10R1.7 NC1CCCCCCC1=O Amb28050100 [0,0,0,1,0,0|1,0,2]=4 507 B10R1.7 O=C1CCCCCC=C1F Amb26624308 [0,0,0,1,0,0|1,0,2]=4 508 B10R1.7 O=C1CCCCCC=C1O Amb27250751 [0,0,0,1,0,0|1,0,2]=4 509 B10R1.7 O=C1CCCCCCC1Br Amb26871305 [0,0,0,1,0,0|1,0,2]=4 510 B10R1.7 O=C1CCCCCCC1Cl Amb22228745 [0,0,0,1,0,0|1,0,2]=4 511 B10R1.7 O=C1CCCCCCC1F Amb27837778 [0,0,0,1,0,0|1,0,2]=4 512 B10R1.7 O=C1CCCCCCC1O Amb22896567 [0,0,0,1,0,0|1,0,2]=4 513 B10R1.7 OC1C=CCCCCC1Br Amb28253657 [0,0,0,1,0,0|2,0,1]=4 514 B10R1.7 O[C@@H]1C=CCCCC[C@H]1O Amb27186951 [0,0,0,1,0,0|1,0,2]=4 515 B10R1.17 BrCCCC1CC=CCC1 Amb33477989 [0,0,0,1,0,0|1,0,1]=3 516 B10R1.17 BrC\C=C\C1CCCCC1 Amb32653503 [0,0,0,1,0,0|2,0,1]=4 517 B10R1.17 BrC\C=C\C1CCCCO1 Amb29885300 [0,0,0,1,0,0|1,0,2]=4 518 B10R1.17 C#CCCC1CC=CCC1 Amb33374072 [0,0,0,1,0,0|1,0,1]=3 519 B10R1.17 C#CCNC1CC=CCC1 Amb27984155 [0,0,0,1,0,0|2,0,1]=4 520 B10R1.17 C=CCCC1CCCOC1 Amb28050486 [0,0,0,1,0,0|2,0,1]=4 521 B10R1.17 C=CCCC1CCOCC1 Amb27475927 [0,0,0,1,0,0|2,0,1]=4 522 B10R1.17 C=CCCC1CCSCC1 Amb28370066 [0,0,0,1,0,0|2,0,1]=4 523 B10R1.17 C=CCC[C@@H]1CCCOC1 Amb27396055 [0,0,0,1,0,0|2,0,1]=4 524 B10R1.17 C=CCC[C@@H]1CCCSC1 Amb27751904 [0,0,0,1,0,0|2,0,1]=4 525 B10R1.17 C=CCNC1CC=CCC1 Amb27781888 [0,0,0,1,0,0|2,0,0]=3 526 B10R1.17 CCCCN1CC=CCC1 Amb27804605 [0,0,0,1,0,0|2,0,1]=4 527 B10R1.17 CCNCC1C=CCCC1 Amb28050368 [0,0,0,1,0,0|2,0,1]=4 528 B10R1.17 CC\C=C\C1CCCCN1 Amb33269457 [0,0,0,1,0,0|1,0,1]=3 529 B10R1.17 CC\C=C\C1CCCNC1 Amb33269456 [0,0,0,1,0,0|2,0,0]=3 530 B10R1.17 CC\C=C\C1CCNCC1 Amb33269448 [0,0,0,1,0,0|2,0,1]=4 531 B10R1.17 CC\C=C\C1CNCCO1 Amb33268708 [0,0,0,1,0,0|1,0,2]=4 532 B10R1.17 CC\C=C\C1COCCN1 Amb33225038 [0,0,0,1,0,0|2,0,1]=4 533 B10R1.17 CC\C=C\N1CCCCC1 Amb17673715 [0,0,0,1,0,0|2,0,1]=4 534 B10R1.17 CNCCC1CC=CCC1 Amb26016974 [0,0,0,1,0,0|2,0,0]=3 535 B10R1.17 CNCCN1CC=CCC1 Amb28397903 [0,0,0,1,0,0|3,0,0]=4 536 B10R1.17 CONCC1CC=CCC1 Amb27602441 [0,0,0,1,0,0|3,0,0]=4 537 B10R1.17 ClC\C=C\C1CCCCO1 Amb35637914 [0,0,0,1,0,0|1,0,2]=4 538 B10R1.17 Cl\C=C\CN1CC=CCC1 Amb28049802 [0,0,0,1,0,0|2,0,1]=4 539 B10R1.17 FCCCN1CC=CCC1 Amb28049772 [0,0,0,1,0,0|2,0,1]=4 540 B10R1.17 N#CCCC1CC=CCC1 Amb33314950 [0,0,0,1,0,0|1,0,1]=3 541 B10R1.17 N#CCNC1CC=CCC1 Amb28239352 [0,0,0,1,0,0|2,0,1]=4 542 B10R1.17 NCCCC1CC=CCC1 Amb30012160 [0,0,0,1,0,0|1,0,1]=3 543 B10R1.17 NC\C=C\C1CC=CCC1 Amb33374111 [0,0,0,1,0,0|2,0,1]=4 544 B10R1.17 NC\C=C\C1CCCCC1 Amb25828178 [0,0,0,1,0,0|2,0,1]=4 545 B10R1.17 NC\C=C\C1CCCCO1 Amb35645494 [0,0,0,1,0,0|1,0,2]=4 546 B10R1.17 NC\C=C\C1CCCOC1 Amb33474059 [0,0,0,1,0,0|3,0,0]=4 547 B10R1.17 NC\C=C\C1CCCSC1 Amb33428689 [0,0,0,1,0,0|3,0,0]=4 548 B10R1.17 NNCCC1CC=CCC1 Amb30012136 [0,0,0,1,0,0|2,0,0]=3 549 B10R1.17 NOCCC1CC=CCC1 Amb33203490 [0,0,0,1,0,0|2,0,0]=3 550 B10R1.17 O=C=NCC1CC=CCC1 Amb20668426 [0,0,0,1,0,0|1,0,1]=3 551 B10R1.17 O=CCCC1C=CCCC1 Amb28077624 [0,0,0,1,0,0|0,0,2]=3 552 B10R1.17 O=CCCC1CC=CCC1 Amb18643322 [0,0,0,1,0,0|0,0,0]=1 553 B10R1.17 O=CCCC1CCC=CO1 Amb18643564 [0,0,0,1,0,0|1,0,0]=2 554 B10R1.17 O=CCCC1CCCCC1 Amb3372079 [0,0,0,1,0,0|0,0,2]=3 555 B10R1.17 O=CCCC1CCCCN1 Amb17593576 [0,0,0,1,0,0|1,0,2]=4 556 B10R1.17 O=CCCC1CCCCO1 Amb27634719 [0,0,0,1,0,0|1,0,2]=4 557 B10R1.17 O=CCCC1CCCOC1 Amb25867773 [0,0,0,1,0,0|1,0,1]=3 558 B10R1.17 O=CCCC1CCCSC1 Amb25312526 [0,0,0,1,0,0|1,0,1]=3 559 B10R1.17 O=CCCC1CCOCC1 Amb24372180 [0,0,0,1,0,0|1,0,1]=3 560 B10R1.17 O=CCCN1CCCCC1 Amb25957250 [0,0,0,1,0,0|1,0,2]=4 561 B10R1.17 O=CCCN1CCNCC1 Amb18991446 [0,0,0,1,0,0|2,0,1]=4 562 B10R1.17 O=CCCN1CCOCC1 Amb22263099 [0,0,0,1,0,0|2,0,1]=4 563 B10R1.17 O=CCCN1CCOCC1 Amb22491435 [0,0,0,1,0,0|2,0,1]=4 564 B10R1.17 O=CCCN1CCOCC1 Amb32882555 [0,0,0,1,0,0|2,0,1]=4 565 B10R1.17 O=CCC[C@@H]1COCCO1 Amb27762561 [0,0,0,1,0,0|2,0,1]=4 566 B10R1.17 O=CCOC1CCCCC1 Amb28423544 [0,0,0,1,0,0|1,0,2]=4 567 B10R1.17 O=CCOC1CCOCC1 Amb28381886 [0,0,0,1,0,0|2,0,1]=4 568 B10R1.17 O=CCSC1CCOCC1 Amb18177709 [0,0,0,1,0,0|2,0,1]=4 569 B10R1.17 O=CNCC1CCC=CO1 Amb27433258 [0,0,0,1,0,0|2,0,0]=3 570 B10R1.17 O=CNCC1CCCCC1 Amb27394363 [0,0,0,1,0,0|1,0,2]=4 571 B10R1.17 O=C\C=C\C1CC=CCC1 Amb25691324 [0,0,0,1,0,0|0,0,2]=3 572 B10R1.17 OCCCC1CC=CCC1 Amb27150884 [0,0,0,1,0,0|0,0,2]=3 573 B10R1.17 OCCCC1CCC=CO1 Amb27839340 [0,0,0,1,0,0|1,0,2]=4 574 B10R1.17 OC\C=C\C1CC=CCC1 Amb33080419 [0,0,0,1,0,0|2,0,1]=4 575 B10R1.17 OC\C=C\C1CCCCC1 Amb25789470 [0,0,0,1,0,0|2,0,1]=4 576 B10R1.17 OC\C=C\C1CCCCO1 Amb33080462 [0,0,0,1,0,0|1,0,2]=4 577 B10R1.17 OC\C=C\C1CCCOC1 Amb27793974 [0,0,0,1,0,0|3,0,0]=4 578 B10R1.17 OC\C=C\C1CCCSC1 Amb33450071 [0,0,0,1,0,0|3,0,0]=4 579 B10R1.17 SCCCC1CC=CCC1 Amb33318626 [0,0,0,1,0,0|0,1,1]=3 580 B10R1.17 [C-]#[N+]CCC1CC=CCC1 Amb33314434 [0,0,0,1,0,0|2,0,0]=3 581 B10R1.17 [N-]=[N+]=NCC1CC=CCC1 Amb26361869 [0,0,0,1,0,0|3,0,0]=4 582 B10R1.19 C=C1CCCCCC1CC Amb35681185 [0,0,0,1,0,0|1,0,2]=4 583 B10R1.19 CC1=C(CO)CCCCC1 Amb28249117 [0,0,0,1,0,0|2,0,1]=4 584 B10R1.19 CC1CCCCCC1C=O Amb28049958 [0,0,0,1,0,0|0,0,2]=3 585 B10R1.19 CCC1CCCCCC1=O Amb25948482 [0,0,0,1,0,0|0,0,2]=3 586 B10R1.19 CCC1NCCCNC1=O Amb26546872 [0,0,0,1,0,0|2,0,1]=4 587 B10R1.19 CCN1CCCNCC1=O Amb24524558 [0,0,0,1,0,0|2,0,1]=4 588 B10R1.19 CCN1CCCNCC1=O Amb33212644 [0,0,0,1,0,0|2,0,1]=4 589 B10R1.19 CCN1CCNCCC1=O Amb21959077 [0,0,0,1,0,0|2,0,1]=4 590 B10R1.19 CCN1CCNCCC1=O Amb32410399 [0,0,0,1,0,0|2,0,1]=4 591 B10R1.19 CC[C@@H]1NCCCNC1=O Amb32671416 [0,0,0,1,0,0|2,0,1]=4 592 B10R1.19 CC[C@H]1CCCCCC1=O Amb27951448 [0,0,0,1,0,0|0,0,2]=3 593 B10R1.19 CC[C@H]1NCCCNC1=O Amb25726155 [0,0,0,1,0,0|2,0,1]=4 594 B10R1.19 CN1CCCCCC1C=O Amb27633340 [0,0,0,1,0,0|1,0,2]=4 595 B10R1.19 COC1=CCCCNC1=O Amb28397869 [0,0,0,1,0,0|2,0,0]=3 596 B10R1.19 COC1CCCCCC1=O Amb26329265 [0,0,0,1,0,0|1,0,2]=4 597 B10R1.19 CSC1=CCCCCN1C Amb27481870 [0,0,0,1,0,0|3,0,0]=4 598 B10R1.19 C[C@@H]1C=COC=C[C@H]1C=O Amb27875021 [0,0,0,1,0,0|1,0,2]=4 599 B10R1.19 C\C=C1\CCCCCC1=O Amb24698888 [0,0,0,1,0,0|0,0,2]=3 600 B10R1.19 N#CC1=CCCCCC1=O Amb27227257 [0,0,0,1,0,0|1,0,1]=3 601 B10R1.19 NCC1CCCCCC1=O Amb27965542 [0,0,0,1,0,0|1,0,2]=4 602 B10R1.19 O=C1CCCCCC1CO Amb27944951 [0,0,0,1,0,0|1,0,2]=4 603 B10R1.19 O=C1CCCCCN1CCl Amb17949681 [0,0,0,1,0,0|2,0,1]=4 604 B10R1.19 O=C1CCCCCN1CO Amb1038986 [0,0,0,1,0,0|2,0,1]=4 605 B10R1.19 O=C=C1CCCCCC1=O Amb27948690 [0,0,0,1,0,0|1,0,2]=4 606 B10R1.19 O=CC1=CCCCCC1=O Amb28288321 [0,0,0,1,0,0|1,0,1]=3 607 B10R1.19 [N-]=[N+]=C1CCCCCC1=O Amb17593499 [0,0,0,1,0,0|2,0,1]=4 608 B10R1.20 C=CC1CCCCC1CC Amb27662673 [0,0,0,1,0,0|1,0,2]=4 609 B10R1.20 CCC1=C(C=O)CCCC1 Amb28050009 [0,0,0,1,0,0|0,0,2]=3 610 B10R1.20 CCC1=C(C=O)CCCO1 Amb24365295 [0,0,0,1,0,0|1,0,1]=3 611 B10R1.20 CCC1=C(C=O)OCCO1 Amb27407002 [0,0,0,1,0,0|2,0,1]=4 612 B10R1.20 CCC1CCCCC1C=O Amb28069911 [0,0,0,1,0,0|0,0,2]=3 613 B10R1.20 CCN1CCCCC1C=O Amb23586129 [0,0,0,1,0,0|1,0,1]=3 614 B10R1.20 COC1=C(C=O)CCCC1 Amb24476974 [0,0,0,1,0,0|1,0,2]=4 615 B10R1.20 COC1C=CCCC1C=O Amb18643578 [0,0,0,1,0,0|1,0,2]=4 616 B10R1.20 COC1CCCCC1C=O Amb24647644 [0,0,0,1,0,0|1,0,2]=4 617 B10R1.20 CO[C@@H]1C=CCC[C@@H]1C=O Amb27841146 [0,0,0,1,0,0|1,0,2]=4 618 B10R1.20 CSC1CCCCC1C=O Amb27973686 [0,0,0,1,0,0|1,0,2]=4 619 B10R1.20 CS[C@@H]1CCCC[C@@H]1C=O Amb27855012 [0,0,0,1,0,0|1,0,2]=4 620 B10R1.20 O=CC1=CCCC[C@H]1C=O Amb27229618 [0,0,0,1,0,0|1,0,1]=3 621 B10R1.20 O=CC1CCCCC1CO Amb18643890 [0,0,0,1,0,0|1,0,2]=4 622 B10R1.20 OCC1=CCCCC1CO Amb27835167 [0,0,0,1,0,0|1,0,2]=4 623 B10R1.21 C#CCCCC1C=CCN1 Amb27629365 [0,0,0,1,0,0|2,0,1]=4 624 B10R1.21 C#CCCNC1C=CCC1 Amb35713403 [0,0,0,1,0,0|2,0,1]=4 625 B10R1.21 C=CCCCC1=CCC=C1 Amb27816709 [0,0,0,1,0,0|1,0,2]=4 626 B10R1.21 C=CCCCC1CCCC1 Amb27390216 [0,0,0,1,0,0|1,0,2]=4 627 B10R1.21 C=CCCCC1CCCN1 Amb27839002 [0,0,0,1,0,0|2,0,1]=4 628 B10R1.21 C=CCCCC1CCSC1 Amb28344683 [0,0,0,1,0,0|2,0,1]=4 629 B10R1.21 CCCCNC1C=CCC1 Amb27252122 [0,0,0,1,0,0|2,0,1]=4 630 B10R1.21 CC\C=C\CC1CCCN1 Amb33268700 [0,0,0,1,0,0|1,0,1]=3 631 B10R1.21 CC\C=C\CC1CCNC1 Amb32953772 [0,0,0,1,0,0|2,0,0]=3 632 B10R1.21 CSCCCC1C=CCN1 Amb27771301 [0,0,0,1,0,0|3,0,0]=4 633 B10R1.21 C\C=C\CNC1C=CCC1 Amb30009044 [0,0,0,1,0,0|2,0,1]=4 634 B10R1.21 Cl\C=C\CNC1C=CCC1 Amb35672309 [0,0,0,1,0,0|2,0,1]=4 635 B10R1.21 N#CCCNC1C=CCC1 Amb35672298 [0,0,0,1,0,0|2,0,1]=4 636 B10R1.21 NC\C=C\CC1CCCC1 Amb33378377 [0,0,0,1,0,0|2,0,1]=4 637 B10R1.21 O=CCCCC1C=CCC1 Amb18643323 [0,0,0,1,0,0|0,0,0]=1 638 B10R1.21 O=CCCCC1CCCC1 Amb25838994 [0,0,0,1,0,0|0,0,2]=3 639 B10R1.21 O=CCCCC1CCCO1 Amb25714393 [0,0,0,1,0,0|1,0,1]=3 640 B10R1.21 O=CCCCC1CCCS1 Amb33415400 [0,0,0,1,0,0|1,0,1]=3 641 B10R1.21 O=CCCCC1CCOC1 Amb26996770 [0,0,0,1,0,0|1,0,1]=3 642 B10R1.21 O=CCCCC1CCSC1 Amb33225844 [0,0,0,1,0,0|1,0,1]=3 643 B10R1.21 O=CCCCC1OCCO1 Amb6752057 [0,0,0,1,0,0|2,0,1]=4 644 B10R1.21 O=CCCCN1CCCC1 Amb33445897 [0,0,0,1,0,0|1,0,2]=4 645 B10R1.21 O=CCCCc1ccco1 Amb28050259 [0,0,0,1,0,0|1,0,2]=4 646 B10R1.21 O=CCCCc1cccs1 Amb17089166 [0,0,0,1,0,0|1,0,2]=4 647 B10R1.21 O=CCCCc1ccoc1 Amb25684248 [0,0,0,1,0,0|1,0,2]=4 648 B10R1.21 O=CCCCc1ccon1 Amb33199364 [0,0,0,1,0,0|2,0,1]=4 649 B10R1.21 O=CCCCc1ccsc1 Amb24415638 [0,0,0,1,0,0|1,0,2]=4 650 B10R1.21 O=CCCCn1cccn1 Amb32726913 [0,0,0,1,0,0|2,0,1]=4 651 B10R1.21 O=CCCCn1ccnc1 Amb18643276 [0,0,0,1,0,0|2,0,1]=4 652 B10R1.21 O=CCCOC1CCCC1 Amb33540933 [0,0,0,1,0,0|1,0,2]=4 653 B10R1.21 O=CCCOC1CCCO1 Amb28049924 [0,0,0,1,0,0|2,0,1]=4 654 B10R1.21 O=CCCOC1CCOC1 Amb27835293 [0,0,0,1,0,0|2,0,1]=4 655 B10R1.21 O=CCOCC1CCCO1 Amb28064332 [0,0,0,1,0,0|2,0,1]=4 656 B10R1.21 O=CCSCC1CCCC1 Amb28197773 [0,0,0,1,0,0|1,0,2]=4 657 B10R1.21 O=CCSCC1CCCO1 Amb27839516 [0,0,0,1,0,0|2,0,1]=4 658 B10R1.21 OCCCCC1C=CCC1 Amb28139719 [0,0,0,1,0,0|0,0,2]=3 659 B10R1.21 OC\C=C\CC1CCCC1 Amb27980617 [0,0,0,1,0,0|2,0,1]=4 660 B10R1.29 C=C=CCC1CCCC1=O Amb28382394 [0,0,0,1,0,0|0,0,3]=4 661 B10R1.29 C=C\C=C\N1CCCC1=O Amb27263091 [0,0,0,1,0,0|1,0,2]=4 662 B10R1.29 CC#CCC1CCCC1=O Amb28388198 [0,0,0,1,0,0|0,0,3]=4 663 B10R1.29 CC1OCCC1CCC=O Amb33426817 [0,0,0,1,0,0|1,0,1]=3 664 B10R1.29 CCCCC1CCCC1=O Amb19301037 [0,0,0,1,0,0|0,0,2]=3 665 B10R1.29 CCCCC1COCC1=O Amb29885828 [0,0,0,1,0,0|1,0,2]=4 666 B10R1.29 CCCCN1CCCC1=O Amb4605894 [0,0,0,1,0,0|1,0,2]=4 667 B10R1.29 CCC\C=C1/CCCC1=O Amb25936513 [0,0,0,1,0,0|0,0,2]=3 668 B10R1.29 CCC\C=C1\CCCC1=O Amb27432602 [0,0,0,1,0,0|0,0,2]=3 669 B10R1.29 CCC\C=C1\CCNC1=O Amb27632969 [0,0,0,1,0,0|1,0,2]=4 670 B10R1.29 CCN\C=C1\CCOC1=O Amb27626048 [0,0,0,1,0,0|2,0,1]=4 671 B10R1.29 CCOCC1CCCC1=O Amb24431926 [0,0,0,1,0,0|1,0,1]=3 672 B10R1.29 CCOCC1COCC1=O Amb35639027 [0,0,0,1,0,0|2,0,1]=4 673 B10R1.29 CCO\C=C1/CCCC1=O Amb33291258 [0,0,0,1,0,0|1,0,1]=3 674 B10R1.29 CN1CCCC1CCC=O Amb25305618 [0,0,0,1,0,0|1,0,2]=4 675 B10R1.29 CN1CCCC1\C=C\CO Amb27457798 [0,0,0,1,0,0|3,0,0]=4 676 B10R1.29 COCCC1CCCC1=O Amb27665846 [0,0,0,1,0,0|1,0,2]=4 677 B10R1.29 COCOC1CCCC1=O Amb25319346 [0,0,0,1,0,0|2,0,1]=4 678 B10R1.29 CSCCC1CCCC1=O Amb27794162 [0,0,0,1,0,0|1,0,2]=4 679 B10R1.29 CSCOC1CCCC1=O Amb25236984 [0,0,0,1,0,0|2,0,1]=4 680 B10R1.29 C\C=C\CC1CCNC1=O Amb27193738 [0,0,0,1,0,0|1,0,2]=4 681 B10R1.29 Cc1ccnn1CCC=O Amb28454032 [0,0,0,1,0,0|2,0,1]=4 682 B10R1.29 Cc1ccoc1CCC=O Amb33343122 [0,0,0,1,0,0|1,0,2]=4 683 B10R1.29 Cc1ccsc1CCC=O Amb26454122 [0,0,0,1,0,0|1,0,2]=4 684 B10R1.29 Cn1cccc1CCC=O Amb26546875 [0,0,0,1,0,0|1,0,2]=4 685 B10R1.29 N#C\C=C\N1CCCC1=O Amb17593451 [0,0,0,1,0,0|2,0,1]=4 686 B10R1.29 O=C1CCCC1CCCF Amb26876720 [0,0,0,1,0,0|1,0,2]=4 687 B10R1.29 O=C1CCC[C@@H]1CCCBr Amb27233151 [0,0,0,1,0,0|1,0,2]=4 688 B10R1.29 O=CCCC1CCCC1O Amb27636929 [0,0,0,1,0,0|1,0,2]=4 689 B10R1.29 O=C\C=C\N1CCCC1=O Amb22522719 [0,0,0,1,0,0|2,0,1]=4 690 B10R1.37 C\C=C\C=C\C1CCC1=O Amb27432677 [0,0,0,1,0,0|0,0,2]=3 691 B10R1.57 O=CNCCCC1CCN1 Amb28368901 [0,0,0,1,0,0|2,0,1]=4 692 B10R1.60 CCC[C@H]1O[C@@H]1CCC=O Amb27235308 [0,0,0,1,0,0|1,0,2]=4 693 B10R1.60 CO\C=C\C1CC1CCO Amb27826488 [0,0,0,1,0,0|1,0,2]=4 694 B10R1.78 BrC1C=CCCCCCC1 Amb24638769 [0,0,0,1,0,0|2,0,1]=4 695 B10R1.78 C=C1C=CCCCCC=C1 Amb22364880 [0,0,0,1,0,0|1,0,2]=4 696 B10R1.78 O=C1C=C=CCCCCC1 Amb28253726 [0,0,0,1,0,0|0,0,3]=4 697 B10R1.78 O=C1C=CC=CCCCC1 Amb22342438 [0,0,0,1,0,0|0,0,2]=3 698 B10R1.78 O=C1CCC=C=CCCC1 Amb27250729 [0,0,0,1,0,0|0,0,2]=3 699 B10R1.78 O=C1CCC=COCCC1 Amb27972974 [0,0,0,1,0,0|1,0,0]=2 700 B10R1.78 O=C1CCCC=CCCN1 Amb27393949 [0,0,0,1,0,0|1,0,2]=4 701 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [0,0,0,1,0,0|0,0,2]=3 702 B10R1.78 O=C1CCCCCCCN1 Amb8513494 [0,0,0,1,0,0|1,0,2]=4 703 B10R1.78 O=C1CCCCOCCN1 Amb27201667 [0,0,0,1,0,0|2,0,1]=4 704 B10R1.78 O=C1CCCCSCCC1 Amb28144124 [0,0,0,1,0,0|1,0,1]=3 705 B10R1.85 CCCC1=NCCCCC1 Amb27483664 [0,0,0,1,0,0|1,0,2]=4 706 B10R1.85 CNCC1CCC=CCC1 Amb27173087 [0,0,0,1,0,0|2,0,0]=3 707 B10R1.85 ClCC=C1CCCCCC1 Amb27234644 [0,0,0,1,0,0|2,0,1]=4 708 B10R1.85 O=C=NC1CCC=CCC1 Amb27607890 [0,0,0,1,0,0|1,0,1]=3 709 B10R1.85 O=CCC1CCCCCC1 Amb28315719 [0,0,0,1,0,0|0,0,2]=3 710 B10R1.85 O=CNC1CCCOCC1 Amb27660499 [0,0,0,1,0,0|2,0,1]=4 711 B10R1.85 O=CNC1CCCSCC1 Amb35691519 [0,0,0,1,0,0|2,0,1]=4 712 B10R1.85 OCC=C1CCCCCC1 Amb27977336 [0,0,0,1,0,0|2,0,1]=4 713 B10R1.85 OCCC1CCC=CCO1 Amb27471268 [0,0,0,1,0,0|1,0,2]=4 714 B10R1.129 CCCCCC1CC1C=O Amb26343852 [0,0,0,1,0,0|0,0,2]=3 715 B10R1.129 CCCCC[C@@H]1O[C@@H]1C=O Amb27640547 [0,0,0,1,0,0|1,0,2]=4 716 B10R1.129 CC\C=C/C[C@@H]1O[C@H]1C=O Amb28367700 [0,0,0,1,0,0|1,0,0]=2 717 B10R1.129 CC\C=C\CC1CC1CO Amb28073942 [0,0,0,1,0,0|0,0,2]=3 718 B10R1.129 CC\C=C\CC1OC1CO Amb27839565 [0,0,0,1,0,0|1,0,2]=4 719 B10R1.129 CC\C=C\C[C@@H]1O[C@H]1CO Amb27480691 [0,0,0,1,0,0|1,0,2]=4 720 B10R1.129 CC\C=C\C[C@H]1O[C@H]1CO Amb27422612 [0,0,0,1,0,0|1,0,2]=4 721 B10R1.161 BrCC1CCC=CCCC1 Amb26064028 [0,0,0,1,0,0|1,0,1]=3 722 B10R1.161 COC1=CCCCCCC1 Amb2721275 [0,0,0,1,0,0|2,0,1]=4 723 B10R1.161 ClCC1CCC=CCCC1 Amb32691343 [0,0,0,1,0,0|1,0,1]=3 724 B10R1.161 NCC1CCC=CCCC1 Amb27461448 [0,0,0,1,0,0|1,0,1]=3 725 B10R1.161 NCC1CCC=CCCC1 Amb32721501 [0,0,0,1,0,0|1,0,1]=3 726 B10R1.161 O=CC1CCC=CCCC1 Amb25766561 [0,0,0,1,0,0|0,0,0]=1 727 B10R1.161 O=CC1CCCCCCC1 Amb31307750 [0,0,0,1,0,0|0,0,2]=3 728 B10R1.161 O=CC1CCCCCCC1 Amb8390588 [0,0,0,1,0,0|0,0,2]=3 729 B10R1.161 O=CN1CCCCCCC1 Amb27150999 [0,0,0,1,0,0|1,0,2]=4 730 B10R1.161 O=CN1CCCCNCC1 Amb28126835 [0,0,0,1,0,0|2,0,1]=4 731 B10R1.161 OCC1=CCCCCCC1 Amb28185100 [0,0,0,1,0,0|2,0,1]=4 732 B10R1.161 OCC1CCC=CCCC1 Amb25098662 [0,0,0,1,0,0|0,0,2]=3 733 B10R1.177 C=CCCCCNC1CC1 Amb26437254 [0,0,0,1,0,0|2,0,1]=4 734 B10R1.177 O=CCCCOCC1CC1 Amb33167106 [0,0,0,1,0,0|1,0,2]=4 735 B10R1.177 O=COCCCCC1CC1 Amb8384805 [0,0,0,1,0,0|1,0,2]=4 736 B7R0.1 C#CCCCCC=C Amb22367006 [2,0,0,0,0,0|1,0,1]=4 737 B7R0.1 C#CCCCCCC Amb3940499 [2,0,0,0,0,0|1,0,1]=4 738 B7R0.1 C#CCC\C=C\CC Amb33267869 [2,0,0,0,0,0|0,0,2]=4 739 B7R0.1 C=C=CCCCC=O Amb28144035 [2,0,0,0,0,0|0,0,2]=4 740 B7R0.1 C=CCCC#CC=O Amb27224253 [2,0,0,0,0,0|0,0,2]=4 741 B7R0.1 C=CCCCCC=O Amb9785164 [2,0,0,0,0,0|0,0,0]=2 742 B7R0.1 C=CCCCCCBr Amb16234121 [2,0,0,0,0,0|1,0,1]=4 743 B7R0.1 C=CCCCCCC Amb3940500 [2,0,0,0,0,0|1,0,0]=3 744 B7R0.1 C=CCCCCCCl Amb6298878 [2,0,0,0,0,0|1,0,1]=4 745 B7R0.1 C=CCCCCCI Amb24483139 [2,0,0,0,0,0|1,0,1]=4 746 B7R0.1 C=CCCCCCN Amb18641754 [2,0,0,0,0,0|1,0,1]=4 747 B7R0.1 C=CCCCCCO Amb4017321 [2,0,0,0,0,0|0,0,2]=4 748 B7R0.1 C=CCCCCNC Amb19886674 [2,0,0,0,0,0|2,0,0]=4 749 B7R0.1 C=CCCCCNC Amb22495849 [2,0,0,0,0,0|2,0,0]=4 750 B7R0.1 C=CCCCN=C=O Amb26567370 [2,0,0,0,0,0|1,0,1]=4 751 B7R0.1 C=CCCCNCC Amb28461005 [2,0,0,0,0,0|1,0,1]=4 752 B7R0.1 C=CCCCNCC Amb32988644 [2,0,0,0,0,0|1,0,1]=4 753 B7R0.1 C=CCCCSCC Amb27600986 [2,0,0,0,0,0|1,0,1]=4 754 B7R0.1 C=CCCC\C=C\C Amb24700388 [2,0,0,0,0,0|0,0,1]=3 755 B7R0.1 C=CCCNCC=C Amb18641672 [2,0,0,0,0,0|2,0,0]=4 756 B7R0.1 C=CCCNCCC Amb27796644 [2,0,0,0,0,0|2,0,0]=4 757 B7R0.1 C=CCCSCCC Amb27806215 [2,0,0,0,0,0|2,0,0]=4 758 B7R0.1 C=CCC\C=C\CO Amb27406831 [2,0,0,0,0,0|1,0,1]=4 759 B7R0.1 C=CCNC\C=C\C Amb18124233 [2,0,0,0,0,0|1,0,1]=4 760 B7R0.1 C=CCOCCC=O Amb26516382 [2,0,0,0,0,0|1,0,0]=3 761 B7R0.1 C=CCOCCCC Amb3940494 [2,0,0,0,0,0|2,0,0]=4 762 B7R0.1 C=CSCCCCC Amb27666051 [2,0,0,0,0,0|2,0,0]=4 763 B7R0.1 C=C\C=C\CCCC Amb22729011 [2,0,0,0,0,0|0,0,2]=4 764 B7R0.1 CC#CCCCC=O Amb17593142 [2,0,0,0,0,0|0,0,2]=4 765 B7R0.1 CC=C=CCCCC Amb28284500 [2,0,0,0,0,0|0,0,2]=4 766 B7R0.1 CCC#CCCCC Amb4017968 [2,0,0,0,0,0|0,0,2]=4 767 B7R0.1 CCCCC#CC=O Amb17593134 [2,0,0,0,0,0|0,0,2]=4 768 B7R0.1 CCCCCCC#N Amb7764659 [2,0,0,0,0,0|1,0,1]=4 769 B7R0.1 CCCCCCC=O Amb3939948 [2,0,0,0,0,0|0,0,0]=2 770 B7R0.1 CCCCCCCBr Amb3941482 [2,0,0,0,0,0|1,0,1]=4 771 B7R0.1 CCCCCCCC Amb8513274 [2,0,0,0,0,0|0,0,2]=4 772 B7R0.1 CCCCCCCCl Amb6608669 [2,0,0,0,0,0|1,0,1]=4 773 B7R0.1 CCCCCCCI Amb3940283 [2,0,0,0,0,0|1,0,1]=4 774 B7R0.1 CCCCCCCN Amb3940125 [2,0,0,0,0,0|1,0,1]=4 775 B7R0.1 CCCCCCCO Amb6608791 [2,0,0,0,0,0|0,0,2]=4 776 B7R0.1 CCCCCCC[Mg+] Amb22351260 [2,0,0,0,0,0|1,0,1]=4 777 B7R0.1 CCCCCCNC Amb4037010 [2,0,0,0,0,0|2,0,0]=4 778 B7R0.1 CCCCCCNN Amb7786617 [2,0,0,0,0,0|2,0,0]=4 779 B7R0.1 CCCCCCNO Amb24591654 [2,0,0,0,0,0|1,0,1]=4 780 B7R0.1 CCCCCCNO Amb32687464 [2,0,0,0,0,0|1,0,1]=4 781 B7R0.1 CCCCCCON Amb18641933 [2,0,0,0,0,0|2,0,0]=4 782 B7R0.1 CCCCCCSC Amb22359692 [2,0,0,0,0,0|2,0,0]=4 783 B7R0.1 CCCCCC[Mg]Br Amb22337740 [2,0,0,0,0,0|2,0,0]=4 784 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [2,0,0,0,0,0|2,0,0]=4 785 B7R0.1 CCCCCN=C=O Amb3939207 [2,0,0,0,0,0|1,0,1]=4 786 B7R0.1 CCCCCNCC Amb6243353 [2,0,0,0,0,0|1,0,1]=4 787 B7R0.1 CCCCCOCC Amb22733705 [2,0,0,0,0,0|1,0,1]=4 788 B7R0.1 CCCCCON=O Amb17939401 [2,0,0,0,0,0|2,0,0]=4 789 B7R0.1 CCCCC\C=C\Br Amb27985859 [2,0,0,0,0,0|1,0,1]=4 790 B7R0.1 CCCCC\C=C\Cl Amb28384465 [2,0,0,0,0,0|1,0,1]=4 791 B7R0.1 CCCCC\C=C\I Amb22641605 [2,0,0,0,0,0|1,0,1]=4 792 B7R0.1 CCCCNCCC Amb3939261 [2,0,0,0,0,0|1,0,1]=4 793 B7R0.1 CCCCOCC=O Amb26515709 [2,0,0,0,0,0|1,0,0]=3 794 B7R0.1 CCCCSCC=O Amb28189740 [2,0,0,0,0,0|1,0,0]=3 795 B7R0.1 CCCCSCCC Amb4017586 [2,0,0,0,0,0|1,0,1]=4 796 B7R0.1 CCCCSSCC Amb26515761 [2,0,0,0,0,0|2,0,0]=4 797 B7R0.1 CCCC\C=C\C#N Amb18641342 [2,0,0,0,0,0|1,0,1]=4 798 B7R0.1 CCCC\C=C\C=O Amb2720528 [2,0,0,0,0,0|0,0,2]=4 799 B7R0.1 CCCC\C=C\CN Amb25175053 [2,0,0,0,0,0|1,0,0]=3 800 B7R0.1 CCCC\C=C\CO Amb8514979 [2,0,0,0,0,0|1,0,0]=3 801 B7R0.1 CCCC\C=N\OC Amb27969362 [2,0,0,0,0,0|2,0,0]=4 802 B7R0.1 CCCC\N=C\CCl Amb28141548 [2,0,0,0,0,0|2,0,0]=4 803 B7R0.1 CCCNCCC=O Amb27838403 [2,0,0,0,0,0|1,0,0]=3 804 B7R0.1 CCC\C=C/CCC Amb27838401 [2,0,0,0,0,0|0,0,2]=4 805 B7R0.1 CCC\C=C\CC=O Amb32954538 [2,0,0,0,0,0|0,0,2]=4 806 B7R0.1 CCC\C=C\CCC Amb9134769 [2,0,0,0,0,0|0,0,2]=4 807 B7R0.1 CCC\C=C\OCC Amb25074036 [2,0,0,0,0,0|1,0,1]=4 808 B7R0.1 CCNCCCCO Amb3940019 [2,0,0,0,0,0|1,0,1]=4 809 B7R0.1 CCNC\C=C/CO Amb28072875 [2,0,0,0,0,0|2,0,0]=4 810 B7R0.1 CCNC\C=C\CN Amb27972499 [2,0,0,0,0,0|2,0,0]=4 811 B7R0.1 CCOCCCC=O Amb27236777 [2,0,0,0,0,0|1,0,0]=3 812 B7R0.1 CCOCCCCBr Amb8855444 [2,0,0,0,0,0|2,0,0]=4 813 B7R0.1 CCOCCCCCl Amb20242741 [2,0,0,0,0,0|2,0,0]=4 814 B7R0.1 CCOCCCCN Amb6249686 [2,0,0,0,0,0|2,0,0]=4 815 B7R0.1 CCOCCCCO Amb19148112 [2,0,0,0,0,0|1,0,1]=4 816 B7R0.1 CCOC\C=C\CO Amb25221278 [2,0,0,0,0,0|2,0,0]=4 817 B7R0.1 CCOC\C=C\CS Amb28254606 [2,0,0,0,0,0|2,0,0]=4 818 B7R0.1 CCSCCCC=O Amb33323662 [2,0,0,0,0,0|1,0,0]=3 819 B7R0.1 CCSCCCCBr Amb9304999 [2,0,0,0,0,0|2,0,0]=4 820 B7R0.1 CCSCCCCCl Amb18796695 [2,0,0,0,0,0|2,0,0]=4 821 B7R0.1 CCSCCCCN Amb9391471 [2,0,0,0,0,0|2,0,0]=4 822 B7R0.1 CCSCCCCO Amb9370799 [2,0,0,0,0,0|1,0,1]=4 823 B7R0.1 CCSCCCCS Amb27223548 [2,0,0,0,0,0|1,1,0]=4 824 B7R0.1 CCSCCNC=O Amb27752341 [2,0,0,0,0,0|2,0,0]=4 825 B7R0.1 CCSC\C=C\CN Amb33474425 [2,0,0,0,0,0|2,0,0]=4 826 B7R0.1 CCSC\C=C\CO Amb33475304 [2,0,0,0,0,0|2,0,0]=4 827 B7R0.1 CC\C=C/CCCO Amb22053865 [2,0,0,0,0,0|0,0,1]=3 828 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [2,0,0,0,0,0|0,0,2]=4 829 B7R0.1 CC\C=C\CCC#N Amb33172608 [2,0,0,0,0,0|1,0,1]=4 830 B7R0.1 CC\C=C\CCC=O Amb27390797 [2,0,0,0,0,0|0,0,0]=2 831 B7R0.1 CC\C=C\CCCBr Amb27232700 [2,0,0,0,0,0|1,0,0]=3 832 B7R0.1 CC\C=C\CCCC Amb19930202 [2,0,0,0,0,0|0,0,0]=2 833 B7R0.1 CC\C=C\CCCCl Amb28410595 [2,0,0,0,0,0|1,0,0]=3 834 B7R0.1 CC\C=C\CCCN Amb33474692 [2,0,0,0,0,0|1,0,0]=3 835 B7R0.1 CC\C=C\CCCO Amb33172698 [2,0,0,0,0,0|0,0,1]=3 836 B7R0.1 CC\C=C\CCCS Amb32882557 [2,0,0,0,0,0|0,1,0]=3 837 B7R0.1 CC\C=C\CCNC Amb32953435 [2,0,0,0,0,0|1,0,0]=3 838 B7R0.1 CC\C=C\CCNN Amb27435651 [2,0,0,0,0,0|2,0,0]=4 839 B7R0.1 CC\C=C\CCON Amb33268245 [2,0,0,0,0,0|2,0,0]=4 840 B7R0.1 CC\C=C\CCSC Amb27397344 [2,0,0,0,0,0|1,0,0]=3 841 B7R0.1 CC\C=C\CN=C=O Amb33449407 [2,0,0,0,0,0|1,0,1]=4 842 B7R0.1 CC\C=N\CCCC Amb27946052 [2,0,0,0,0,0|1,0,0]=3 843 B7R0.1 COCCCCC=O Amb27410175 [2,0,0,0,0,0|1,0,0]=3 844 B7R0.1 COCCOCC=O Amb26051823 [2,0,0,0,0,0|2,0,0]=4 845 B7R0.1 COCC\C=C\CCl Amb10844762 [2,0,0,0,0,0|2,0,0]=4 846 B7R0.1 COCC\C=C\CN Amb33474375 [2,0,0,0,0,0|2,0,0]=4 847 B7R0.1 COCC\C=C\CO Amb32954125 [2,0,0,0,0,0|2,0,0]=4 848 B7R0.1 COCOCCC=O Amb25804170 [2,0,0,0,0,0|2,0,0]=4 849 B7R0.1 CO\C=C\CCC=O Amb18641790 [2,0,0,0,0,0|1,0,0]=3 850 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|1,0,0]=3 851 B7R0.1 CSCC\C=C\CN Amb33198278 [2,0,0,0,0,0|2,0,0]=4 852 B7R0.1 CSCC\C=C\CO Amb33198279 [2,0,0,0,0,0|2,0,0]=4 853 B7R0.1 C\C=C/CCCCC Amb4035902 [2,0,0,0,0,0|0,0,1]=3 854 B7R0.1 C\C=C/CCCCO Amb4019856 [2,0,0,0,0,0|0,0,1]=3 855 B7R0.1 C\C=C\C=C\CCC Amb27493119 [2,0,0,0,0,0|0,0,2]=4 856 B7R0.1 C\C=C\CCCCC Amb8513437 [2,0,0,0,0,0|0,0,1]=3 857 B7R0.1 C\C=C\CCCCN Amb27209196 [2,0,0,0,0,0|1,0,0]=3 858 B7R0.1 C\C=C\CCNC=O Amb27874072 [2,0,0,0,0,0|1,0,0]=3 859 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [2,0,0,0,0,0|1,0,1]=4 860 B7R0.1 C\C=C\CC\C=C\Cl Amb27433939 [2,0,0,0,0,0|1,0,1]=4 861 B7R0.1 C\C=C\CNCCC Amb28127654 [2,0,0,0,0,0|1,0,1]=4 862 B7R0.1 C\C=C\CNCCN Amb27983366 [2,0,0,0,0,0|2,0,0]=4 863 B7R0.1 C\C=C\CSCCO Amb9362982 [2,0,0,0,0,0|1,0,1]=4 864 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [2,0,0,0,0,0|0,0,2]=4 865 B7R0.1 C\C=N/CCCCN Amb27838890 [2,0,0,0,0,0|2,0,0]=4 866 B7R0.1 ClC\C=C\CCCCl Amb27421977 [2,0,0,0,0,0|2,0,0]=4 867 B7R0.1 N#CCCCCC=O Amb17593149 [2,0,0,0,0,0|1,0,1]=4 868 B7R0.1 NCCCCNC=O Amb18641902 [2,0,0,0,0,0|2,0,0]=4 869 B7R0.1 NCCC\C=C/CO Amb27838308 [2,0,0,0,0,0|2,0,0]=4 870 B7R0.1 NCCC\C=C\CO Amb24117506 [2,0,0,0,0,0|2,0,0]=4 871 B7R0.1 NCCC\C=C\CO Amb33734220 [2,0,0,0,0,0|2,0,0]=4 872 B7R0.1 NCCC\C=C\CO Amb33743765 [2,0,0,0,0,0|2,0,0]=4 873 B7R0.1 O=CCCCCC=O Amb17593185 [2,0,0,0,0,0|1,0,0]=3 874 B7R0.1 O=CCCCCCBr Amb18127461 [2,0,0,0,0,0|1,0,0]=3 875 B7R0.1 O=CCCCCCCl Amb16185781 [2,0,0,0,0,0|1,0,0]=3 876 B7R0.1 O=CCCCCCF Amb24533888 [2,0,0,0,0,0|1,0,0]=3 877 B7R0.1 O=CCCCCCO Amb18641885 [2,0,0,0,0,0|1,0,0]=3 878 B7R0.1 O=CCCOCCO Amb18641946 [2,0,0,0,0,0|2,0,0]=4 879 B7R0.1 O=CCSCCCO Amb27871143 [2,0,0,0,0,0|2,0,0]=4 880 B7R0.1 O=CNCCCCF Amb27168251 [2,0,0,0,0,0|2,0,0]=4 881 B7R0.1 O=CNCCCCO Amb28187191 [2,0,0,0,0,0|2,0,0]=4 882 B7R0.1 O=C\C=C\CCC=O Amb18124241 [2,0,0,0,0,0|1,0,1]=4 883 B7R0.1 OC\C=C/CCCCl Amb27862350 [2,0,0,0,0,0|2,0,0]=4 884 B7R0.1 OC\C=C\CCCO Amb27205649 [2,0,0,0,0,0|1,0,1]=4 885 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [2,0,0,0,0,0|2,0,0]=4 886 B7R0.1 [C-]#[N+]CC\C=C\CC Amb33268261 [2,0,0,0,0,0|1,0,1]=4 887 B9R0.2 C#C\C=C\CCCC(=O)O Amb27227921 [1,1,0,0,0,0|0,0,2]=4 888 B9R0.2 C=C(C)CCCCCCC Amb6298940 [1,1,0,0,0,0|1,0,1]=4 889 B9R0.2 C=C(C)CCCOCC=O Amb27617165 [1,1,0,0,0,0|1,0,1]=4 890 B9R0.2 C=C(C)\C=C\CCCC=O Amb18643329 [1,1,0,0,0,0|0,0,1]=3 891 B9R0.2 C=C(Cl)CNC\C=C\CC Amb27422836 [1,1,0,0,0,0|1,0,1]=4 892 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [1,1,0,0,0,0|0,0,2]=4 893 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [1,1,0,0,0,0|0,0,2]=4 894 B9R0.2 C=CCCCCCC(C)C Amb27205011 [1,1,0,0,0,0|1,0,1]=4 895 B9R0.2 C=CCCCCC[C@@H](C)O Amb28318202 [1,1,0,0,0,0|1,0,1]=4 896 B9R0.2 C=CCCCCNC(C)=O Amb27436512 [1,1,0,0,0,0|2,0,0]=4 897 B9R0.2 C=CCCCCNC(C)C Amb26067882 [1,1,0,0,0,0|2,0,0]=4 898 B9R0.2 C=CCCCCOC(C)=O Amb10842183 [1,1,0,0,0,0|2,0,0]=4 899 B9R0.2 C=CCCC\C=C\C(C)=O Amb27628550 [1,1,0,0,0,0|0,0,2]=4 900 B9R0.2 C=C\C=C/CCCC(C)=O Amb28126953 [1,1,0,0,0,0|0,0,2]=4 901 B9R0.2 C=C\C=C\CCCC(C)=O Amb25713959 [1,1,0,0,0,0|0,0,2]=4 902 B9R0.2 C=C\C=C\CCCC(N)=O Amb26017610 [1,1,0,0,0,0|0,0,2]=4 903 B9R0.2 CC#CCCCCC(N)=O Amb27258980 [1,1,0,0,0,0|0,0,2]=4 904 B9R0.2 CC(=O)CCCCCCN Amb25147578 [1,1,0,0,0,0|1,0,1]=4 905 B9R0.2 CC(=O)CCCCCCN Amb32663700 [1,1,0,0,0,0|1,0,1]=4 906 B9R0.2 CC(=O)CCC\C=C/C#N Amb28244715 [1,1,0,0,0,0|1,0,1]=4 907 B9R0.2 CC(=O)CNCCCC=O Amb24664343 [1,1,0,0,0,0|1,0,1]=4 908 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [1,1,0,0,0,0|1,0,0]=3 909 B9R0.2 CC(=O)NCCCNC=O Amb28197455 [1,1,0,0,0,0|2,0,0]=4 910 B9R0.2 CC(=O)OCCCCC=O Amb26505388 [1,1,0,0,0,0|1,0,0]=3 911 B9R0.2 CC(=O)OCCC\C=C\Cl Amb24720035 [1,1,0,0,0,0|2,0,0]=4 912 B9R0.2 CC(=O)SCCCCC=O Amb27432569 [1,1,0,0,0,0|1,0,0]=3 913 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [1,1,0,0,0,0|1,0,1]=4 914 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [1,1,0,0,0,0|1,0,1]=4 915 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [1,1,0,0,0,0|0,0,2]=4 916 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [1,1,0,0,0,0|0,0,0]=2 917 B9R0.2 CC(C)=CCCCCCCl Amb27879457 [1,1,0,0,0,0|1,0,1]=4 918 B9R0.2 CC(C)=CCCOCC=O Amb28290541 [1,1,0,0,0,0|1,0,0]=3 919 B9R0.2 CC(C)=CCC\C=C\C=O Amb18643301 [1,1,0,0,0,0|0,0,2]=4 920 B9R0.2 CC(C)CCCCCC=O Amb22233123 [1,1,0,0,0,0|0,0,1]=3 921 B9R0.2 CC(C)CCC\C=C/CBr Amb27258137 [1,1,0,0,0,0|1,0,1]=4 922 B9R0.2 CC(C)CCC\C=C\CBr Amb27435416 [1,1,0,0,0,0|1,0,1]=4 923 B9R0.2 CC(C)CCC\C=C\CN Amb24560072 [1,1,0,0,0,0|1,0,1]=4 924 B9R0.2 CC(C)CCC\C=C\CO Amb27427814 [1,1,0,0,0,0|1,0,1]=4 925 B9R0.2 CC(C)CCSCCC=O Amb27589044 [1,1,0,0,0,0|1,0,1]=4 926 B9R0.2 CC(C)OCCCCC=O Amb33172005 [1,1,0,0,0,0|1,0,0]=3 927 B9R0.2 CC(C)OCCCNC=O Amb28129481 [1,1,0,0,0,0|2,0,0]=4 928 B9R0.2 CC(C)SCCCCC=O Amb28065431 [1,1,0,0,0,0|1,0,0]=3 929 B9R0.2 CC(O)CCC\C=C\CCl Amb24502312 [1,1,0,0,0,0|1,0,1]=4 930 B9R0.2 CC(O)CCC\C=C\CO Amb27604113 [1,1,0,0,0,0|1,0,1]=4 931 B9R0.2 CC(S)\C=C\CCCCO Amb27486620 [1,1,0,0,0,0|0,0,1]=3 932 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [1,1,0,0,0,0|0,0,2]=4 933 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [1,1,0,0,0,0|0,0,2]=4 934 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [1,1,0,0,0,0|0,0,1]=3 935 B9R0.2 CCCCCCCC(=O)O Amb3940371 [1,1,0,0,0,0|0,0,1]=3 936 B9R0.2 CCCCCCCC(=O)S Amb10561702 [1,1,0,0,0,0|0,0,1]=3 937 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [1,1,0,0,0,0|0,0,1]=3 938 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [1,1,0,0,0,0|0,0,1]=3 939 B9R0.2 CCCCCCCC(C)=O Amb6891951 [1,1,0,0,0,0|0,0,1]=3 940 B9R0.2 CCCCCCCC(N)=O Amb8999028 [1,1,0,0,0,0|0,0,1]=3 941 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [1,1,0,0,0,0|1,0,1]=4 942 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [1,1,0,0,0,0|1,0,1]=4 943 B9R0.2 CCCCCCCS(N)=O Amb32720352 [1,1,0,0,0,0|1,0,1]=4 944 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [1,1,0,0,0,0|1,0,1]=4 945 B9R0.2 CCCCCCNC(C)=O Amb3368460 [1,1,0,0,0,0|1,0,1]=4 946 B9R0.2 CCCCCCNC(N)=O Amb23569596 [1,1,0,0,0,0|1,0,1]=4 947 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [1,1,0,0,0,0|1,0,1]=4 948 B9R0.2 CCCCCCOC(C)=O Amb8513414 [1,1,0,0,0,0|1,0,1]=4 949 B9R0.2 CCCCCCOC(N)=O Amb22495526 [1,1,0,0,0,0|1,0,1]=4 950 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [1,1,0,0,0,0|1,0,1]=4 951 B9R0.2 CCCCCCSC(C)=O Amb27837874 [1,1,0,0,0,0|1,0,1]=4 952 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [1,1,0,0,0,0|1,0,1]=4 953 B9R0.2 CCCCCNCC(N)=O Amb6708061 [1,1,0,0,0,0|1,0,1]=4 954 B9R0.2 CCCCCOCC(=O)O Amb8902706 [1,1,0,0,0,0|1,0,1]=4 955 B9R0.2 CCCCCSCC(=O)O Amb6249571 [1,1,0,0,0,0|1,0,1]=4 956 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [1,1,0,0,0,0|0,0,1]=3 957 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [1,1,0,0,0,0|0,0,1]=3 958 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [1,1,0,0,0,0|0,0,1]=3 959 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [1,1,0,0,0,0|0,0,1]=3 960 B9R0.2 CCCCNCCC(=O)O Amb7755713 [1,1,0,0,0,0|1,0,1]=4 961 B9R0.2 CCCCNCCC(C)=O Amb26381876 [1,1,0,0,0,0|1,0,1]=4 962 B9R0.2 CCCCNCCC(N)=O Amb8841106 [1,1,0,0,0,0|1,0,1]=4 963 B9R0.2 CCCCOCCC(N)=O Amb27480748 [1,1,0,0,0,0|1,0,1]=4 964 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,1,0,0,0,0|1,0,1]=4 965 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,1,0,0,0,0|1,0,1]=4 966 B9R0.2 CCCOCCCC(=O)O Amb8874517 [1,1,0,0,0,0|1,0,1]=4 967 B9R0.2 CCCSCCCC(=O)O Amb6680215 [1,1,0,0,0,0|1,0,1]=4 968 B9R0.2 CCCSCCCC(C)=O Amb9660304 [1,1,0,0,0,0|1,0,1]=4 969 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [1,1,0,0,0,0|0,0,2]=4 970 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [1,1,0,0,0,0|0,0,2]=4 971 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [1,1,0,0,0,0|0,0,2]=4 972 B9R0.2 CCC\C=C\CCC(N)=O Amb27493443 [1,1,0,0,0,0|0,0,2]=4 973 B9R0.2 CCNCCCCC(=O)O Amb24385094 [1,1,0,0,0,0|1,0,0]=3 974 B9R0.2 CCNCCCCC(=O)O Amb32686610 [1,1,0,0,0,0|1,0,0]=3 975 B9R0.2 CCNCCCCC(C)=O Amb27951143 [1,1,0,0,0,0|1,0,0]=3 976 B9R0.2 CCNCCCCC(N)=O Amb27964384 [1,1,0,0,0,0|1,0,0]=3 977 B9R0.2 CCNCCCNC(N)=O Amb9466113 [1,1,0,0,0,0|2,0,0]=4 978 B9R0.2 CCNCC\C=C\C(C)C Amb27251097 [1,1,0,0,0,0|1,0,1]=4 979 B9R0.2 CCOCCCCC(=N)N Amb28352192 [1,1,0,0,0,0|2,0,0]=4 980 B9R0.2 CCOCCCCC(=O)O Amb9207786 [1,1,0,0,0,0|1,0,0]=3 981 B9R0.2 CCOCCCCC(C)=O Amb9659807 [1,1,0,0,0,0|1,0,0]=3 982 B9R0.2 CCOCCCCC(N)=S Amb18180039 [1,1,0,0,0,0|1,1,0]=4 983 B9R0.2 CCOCCCNC(C)=O Amb3886591 [1,1,0,0,0,0|2,0,0]=4 984 B9R0.2 CCOCCCNC(N)=O Amb404787 [1,1,0,0,0,0|2,0,0]=4 985 B9R0.2 CCOCCCOC(C)=O Amb22733319 [1,1,0,0,0,0|2,0,0]=4 986 B9R0.2 CCOCCOCC(=O)O Amb6258165 [1,1,0,0,0,0|2,0,0]=4 987 B9R0.2 CCOCCOCC(N)=O Amb28203011 [1,1,0,0,0,0|2,0,0]=4 988 B9R0.2 CCOCSCCC(=O)O Amb27447358 [1,1,0,0,0,0|2,0,0]=4 989 B9R0.2 CCONCCCC(=O)O Amb27839067 [1,1,0,0,0,0|2,0,0]=4 990 B9R0.2 CCSCCCCC(=O)O Amb7782874 [1,1,0,0,0,0|1,0,0]=3 991 B9R0.2 CCSCCCOC(C)=O Amb27605064 [1,1,0,0,0,0|2,0,0]=4 992 B9R0.2 CCSCCSCC(=O)O Amb28126747 [1,1,0,0,0,0|2,0,0]=4 993 B9R0.2 CCSCCSCC(N)=O Amb28293850 [1,1,0,0,0,0|2,0,0]=4 994 B9R0.2 CC\C=C\CCCC(C)N Amb28247293 [1,1,0,0,0,0|0,0,1]=3 995 B9R0.2 CC\C=C\CCNC(C)C Amb28250456 [1,1,0,0,0,0|1,0,1]=4 996 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [1,1,0,0,0,0|1,0,0]=3 997 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [1,1,0,0,0,0|1,0,0]=3 998 B9R0.2 CC\C=C\CNCC(C)O Amb27226293 [1,1,0,0,0,0|1,0,1]=4 999 B9R0.2 CC\C=C\C\C=C\C(C)=O Amb27226161 [1,1,0,0,0,0|0,0,2]=4 1000 B9R0.2 CN(C)CCCCCC=O Amb25743404 [1,1,0,0,0,0|1,0,1]=4 1001 B9R0.2 CNCCCCCC(C)=O Amb25728176 [1,1,0,0,0,0|1,0,1]=4 1002 B9R0.2 CNCCCCCC(N)=O Amb27625362 [1,1,0,0,0,0|1,0,1]=4 1003 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,1,0,0,0,0|1,0,1]=4 1004 B9R0.2 COCCCCCC(C)=O Amb27227265 [1,1,0,0,0,0|1,0,1]=4 1005 B9R0.2 CO\N=C\CCCC(C)=O Amb27267149 [1,1,0,0,0,0|2,0,0]=4 1006 B9R0.2 CSCCCCCC(=O)O Amb27444761 [1,1,0,0,0,0|1,0,1]=4 1007 B9R0.2 CS\C=C\CCCC(C)=O Amb28054428 [1,1,0,0,0,0|1,0,0]=3 1008 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [1,1,0,0,0,0|1,0,1]=4 1009 B9R0.2 C\C=C\C=C\CCC(=O)O Amb18643576 [1,1,0,0,0,0|0,0,2]=4 1010 B9R0.2 C\C=C\CCCCB(O)O Amb22167778 [1,1,0,0,0,0|1,0,1]=4 1011 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [1,1,0,0,0,0|0,0,0]=2 1012 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [1,1,0,0,0,0|0,0,0]=2 1013 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [1,1,0,0,0,0|1,0,0]=3 1014 B9R0.2 C\C=C\CCCSC(=N)N Amb24654932 [1,1,0,0,0,0|2,0,0]=4 1015 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [1,1,0,0,0,0|1,0,0]=3 1016 B9R0.2 C\C=C\CNCCC(N)=O Amb27251437 [1,1,0,0,0,0|1,0,0]=3 1017 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [1,1,0,0,0,0|1,0,1]=4 1018 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [1,1,0,0,0,0|1,0,1]=4 1019 B9R0.2 NC(=O)CCCCNC=O Amb27232578 [1,1,0,0,0,0|2,0,0]=4 1020 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,1,0,0,0,0|1,0,1]=4 1021 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,1,0,0,0,0|1,0,1]=4 1022 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [1,1,0,0,0,0|1,0,1]=4 1023 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [1,1,0,0,0,0|1,0,1]=4 1024 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [1,1,0,0,0,0|1,0,1]=4 1025 B9R0.2 O=C(O)CCCCCCF Amb25132501 [1,1,0,0,0,0|1,0,1]=4 1026 B9R0.2 O=C(O)CCCCCCO Amb9787028 [1,1,0,0,0,0|1,0,1]=4 1027 B9R0.2 O=C(O)CCCCCCS Amb24710334 [1,1,0,0,0,0|1,0,1]=4 1028 B9R0.2 O=C(O)CCCC\C=C\Br Amb26542054 [1,1,0,0,0,0|1,0,0]=3 1029 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [1,1,0,0,0,0|1,0,0]=3 1030 B9R0.2 O=C(O)CCNC\C=C\Cl Amb9326418 [1,1,0,0,0,0|2,0,0]=4 1031 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [1,1,0,0,0,0|1,0,1]=4 1032 B9R0.2 O=CCCC\C=C\B(O)O Amb24678117 [1,1,0,0,0,0|2,0,0]=4 1033 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [1,1,0,0,0,0|1,0,1]=4 1034 B9R0.5 C=CCC(C)NC\C=C\C Amb28383700 [1,1,0,0,0,0|2,0,0]=4 1035 B9R0.5 C=CCC(Cl)CCOCC Amb27855969 [1,1,0,0,0,0|2,0,0]=4 1036 B9R0.5 C=CCC(O)CCOCC Amb27756800 [1,1,0,0,0,0|2,0,0]=4 1037 B9R0.5 C=CCCC[C@H](C)CC=O Amb28049851 [1,1,0,0,0,0|0,0,2]=4 1038 B9R0.5 C=CC[C@H](O)CCCCC Amb27839428 [1,1,0,0,0,0|1,0,1]=4 1039 B9R0.5 CCCC(=O)CCCCN Amb28058184 [1,1,0,0,0,0|1,0,1]=4 1040 B9R0.5 CCCC(=O)NCCC=O Amb17102167 [1,1,0,0,0,0|1,0,1]=4 1041 B9R0.5 CCCC(=O)OCCC=O Amb28049893 [1,1,0,0,0,0|1,0,1]=4 1042 B9R0.5 CCCC(C)CCCC=O Amb27425021 [1,1,0,0,0,0|0,0,1]=3 1043 B9R0.5 CCCC(O)C\C=C\CO Amb27614990 [1,1,0,0,0,0|1,0,1]=4 1044 B9R0.5 CCCCCC(=O)CCC Amb2720457 [1,1,0,0,0,0|0,0,2]=4 1045 B9R0.5 CCCCCC(=O)NCC Amb3373540 [1,1,0,0,0,0|1,0,1]=4 1046 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,1,0,0,0,0|0,0,1]=3 1047 B9R0.5 CCCCCC(C)NC=O Amb27615073 [1,1,0,0,0,0|1,0,1]=4 1048 B9R0.5 CCCCCC(S)CC=O Amb27424790 [1,1,0,0,0,0|0,0,1]=3 1049 B9R0.5 CCCCC\C(Cl)=C\CCl Amb27749688 [1,1,0,0,0,0|1,0,1]=4 1050 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [1,1,0,0,0,0|1,0,1]=4 1051 B9R0.5 CCCCOC(C)CC=O Amb27838097 [1,1,0,0,0,0|1,0,1]=4 1052 B9R0.5 CCC[C@H](O)C\C=C\CO Amb27617048 [1,1,0,0,0,0|1,0,1]=4 1053 B9R0.5 CCC\C(C)=C\CCC=O Amb27224748 [1,1,0,0,0,0|0,0,2]=4 1054 B9R0.5 CCC\C=C\C(C)CC=O Amb27615137 [1,1,0,0,0,0|0,0,2]=4 1055 B9R0.5 CCNC(=O)CCCCBr Amb17239684 [1,1,0,0,0,0|2,0,0]=4 1056 B9R0.5 CCNC(=O)CCNC=O Amb27255900 [1,1,0,0,0,0|2,0,0]=4 1057 B9R0.5 CCOC(=N)CCCCBr Amb25890174 [1,1,0,0,0,0|2,0,0]=4 1058 B9R0.5 CCOC(=N)CCCCCl Amb26392208 [1,1,0,0,0,0|2,0,0]=4 1059 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [1,1,0,0,0,0|1,0,0]=3 1060 B9R0.5 CCOC(=O)CCCCBr Amb3940221 [1,1,0,0,0,0|2,0,0]=4 1061 B9R0.5 CCOC(=O)CCCCI Amb4006406 [1,1,0,0,0,0|2,0,0]=4 1062 B9R0.5 CCOC(=O)CCCCN Amb10807401 [1,1,0,0,0,0|2,0,0]=4 1063 B9R0.5 CCOC(=O)CCCCN Amb33527726 [1,1,0,0,0,0|2,0,0]=4 1064 B9R0.5 CCOC(=O)OCCC=O Amb28287679 [1,1,0,0,0,0|2,0,0]=4 1065 B9R0.5 CCOC(C)CCCC=O Amb33424998 [1,1,0,0,0,0|1,0,0]=3 1066 B9R0.5 CCO\C=C\C(C)CC=O Amb25701589 [1,1,0,0,0,0|1,0,1]=4 1067 B9R0.5 CC\C=C(/C)CCCCC Amb27666327 [1,1,0,0,0,0|0,0,1]=3 1068 B9R0.5 CC\C=C(\C)CCCC=O Amb27850024 [1,1,0,0,0,0|0,0,0]=2 1069 B9R0.5 CC\C=C\CC(Br)CCC Amb27488172 [1,1,0,0,0,0|0,0,1]=3 1070 B9R0.5 CC\C=C\CC(O)CCO Amb27605392 [1,1,0,0,0,0|0,0,1]=3 1071 B9R0.5 CO\C=C(/C)CCCC=O Amb27199142 [1,1,0,0,0,0|1,0,0]=3 1072 B9R0.5 CO\C=C(\C)CCCCO Amb27427194 [1,1,0,0,0,0|1,0,1]=4 1073 B9R0.5 C\C(=C/C#N)CCCC=O Amb27827416 [1,1,0,0,0,0|1,0,1]=4 1074 B9R0.5 C\C(=C/CO)CCCC=O Amb28287918 [1,1,0,0,0,0|1,0,0]=3 1075 B9R0.5 C\C(=C/CO)CCCCCl Amb27254213 [1,1,0,0,0,0|2,0,0]=4 1076 B9R0.5 C\C(=C/CO)CCCCO Amb27594384 [1,1,0,0,0,0|1,0,1]=4 1077 B9R0.5 C\C=C/CCC(C)CC=O Amb27751342 [1,1,0,0,0,0|0,0,0]=2 1078 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [1,1,0,0,0,0|0,0,1]=3 1079 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [1,1,0,0,0,0|0,0,2]=4 1080 B9R0.5 C\C=C\C(=O)CCCCF Amb27652289 [1,1,0,0,0,0|1,0,1]=4 1081 B9R0.5 C\C=C\C(=O)OCCC=O Amb27401196 [1,1,0,0,0,0|1,0,1]=4 1082 B9R0.5 C\C=C\C(O)CCCCC Amb28139884 [1,1,0,0,0,0|1,0,1]=4 1083 B9R0.5 C\C=C\CCC(C)CC=O Amb27849050 [1,1,0,0,0,0|0,0,0]=2 1084 B9R0.5 C\C=C\CCC(O)CCO Amb28350050 [1,1,0,0,0,0|0,0,2]=4 1085 B9R0.5 C\C=C\CCC(O)COC Amb27487822 [1,1,0,0,0,0|2,0,0]=4 1086 B9R0.5 C\C=C\CC\C(C)=C/C=O Amb27643406 [1,1,0,0,0,0|0,0,2]=4 1087 B9R0.5 C\C=C\CC\C(C)=C\C=O Amb18643316 [1,1,0,0,0,0|0,0,2]=4 1088 B9R0.5 C\C=C\OC[C@@H](C)CC=O Amb27849648 [1,1,0,0,0,0|1,0,0]=3 1089 B9R0.5 C\C=C\OC[C@H](C)CC=O Amb28050011 [1,1,0,0,0,0|1,0,0]=3 1090 B9R0.5 ClC\C=C(/Cl)CCCCCl Amb27872281 [1,1,0,0,0,0|2,0,0]=4 1091 B9R0.18 C=CCCC(=O)C\C=C\C Amb26987246 [1,1,0,0,0,0|1,0,1]=4 1092 B9R0.18 C=CCCC(O)CSCC Amb28187146 [1,1,0,0,0,0|2,0,0]=4 1093 B9R0.18 C=CCCC(O)\C=C\CC Amb28064086 [1,1,0,0,0,0|0,0,1]=3 1094 B9R0.18 C=CCCN(C)C\C=C\C Amb27756894 [1,1,0,0,0,0|2,0,0]=4 1095 B9R0.18 C=C\C=C/[C@H](C)CCC=O Amb27768605 [1,1,0,0,0,0|0,0,2]=4 1096 B9R0.18 CCCCC(N)CCC=O Amb33036353 [1,1,0,0,0,0|0,0,1]=3 1097 B9R0.18 CCCCC(O)CCC=O Amb27236595 [1,1,0,0,0,0|0,0,1]=3 1098 B9R0.18 CCCCC(O)\C=C\CO Amb28050649 [1,1,0,0,0,0|1,0,1]=4 1099 B9R0.18 CCCC[C@@H](C)\C=C\CO Amb28350350 [1,1,0,0,0,0|1,0,1]=4 1100 B9R0.18 CCCC[C@H](O)\C=C\CO Amb27213889 [1,1,0,0,0,0|1,0,1]=4 1101 B9R0.18 CC\C=C\C(=O)CCC=O Amb18643586 [1,1,0,0,0,0|0,0,1]=3 1102 B9R0.18 CC\C=C\C(=O)CCCC Amb25219828 [1,1,0,0,0,0|0,0,2]=4 1103 B9R0.18 CC\C=C\C(O)COCC Amb27213918 [1,1,0,0,0,0|1,0,1]=4 1104 B9R0.18 COCCC(C)CCC=O Amb27798414 [1,1,0,0,0,0|1,0,1]=4 1105 B9R0.18 CO\C=C\C(C)CCCO Amb27431438 [1,1,0,0,0,0|1,0,1]=4 1106 B9R0.18 CO\C=C\[C@@H](C)CCC=O Amb27390146 [1,1,0,0,0,0|1,0,0]=3 1107 B9R0.18 CO\C=C\[C@@H](C)CCCO Amb27395954 [1,1,0,0,0,0|1,0,1]=4 1108 B9R0.18 CS\C=C\C(C)CCCO Amb27835868 [1,1,0,0,0,0|1,0,1]=4 1109 B9R0.18 C\C=C\CC(N)CCCC Amb26501784 [1,1,0,0,0,0|1,0,1]=4 1110 B9R0.18 C\C=C\CC(O)CCCC Amb28457872 [1,1,0,0,0,0|1,0,1]=4 1111 B9R0.18 C\C=C\C[C@H](O)CCCC Amb28050754 [1,1,0,0,0,0|1,0,1]=4 1112 B9R0.18 OC\C=C\[C@@H](O)CCCO Amb28064019 [1,1,0,0,0,0|1,0,1]=4 1113 B9R0.46 C=C(C=O)CCCCC=O Amb28049873 [1,1,0,0,0,0|1,0,0]=3 1114 B9R0.46 C=C(C=O)CCCCCC Amb8392631 [1,1,0,0,0,0|0,0,2]=4 1115 B9R0.46 C=C(C=O)CC\C=C/CC Amb26462856 [1,1,0,0,0,0|0,0,1]=3 1116 B9R0.46 C=C(C=O)CC\C=C\CC Amb27422502 [1,1,0,0,0,0|0,0,1]=3 1117 B9R0.46 C=CC(=O)CC\C=C/CC Amb27945136 [1,1,0,0,0,0|0,0,2]=4 1118 B9R0.46 C=CC(Cl)CCCCCC Amb26636765 [1,1,0,0,0,0|1,0,1]=4 1119 B9R0.46 C=CC(N)CCCOCC Amb27654779 [1,1,0,0,0,0|2,0,0]=4 1120 B9R0.46 C=CC(O)CCCCCC Amb8515213 [1,1,0,0,0,0|1,0,1]=4 1121 B9R0.46 C=CC(O)CCCOCC Amb27766080 [1,1,0,0,0,0|2,0,0]=4 1122 B9R0.46 C=CC(O)CC\C=C\CO Amb27839272 [1,1,0,0,0,0|1,0,1]=4 1123 B9R0.46 C=CCCCCC(=C)C=O Amb27622105 [1,1,0,0,0,0|2,0,0]=4 1124 B9R0.46 C=CCCCCC(=O)OC Amb27617093 [1,1,0,0,0,0|2,0,0]=4 1125 B9R0.46 C=CCCCCC(Cl)C=O Amb27636303 [1,1,0,0,0,0|0,0,2]=4 1126 B9R0.46 C=CCCCCC(Cl)CC Amb28182453 [1,1,0,0,0,0|1,0,1]=4 1127 B9R0.46 C=CCCCNC(=O)CC Amb27835179 [1,1,0,0,0,0|1,0,1]=4 1128 B9R0.46 C=CCCC\C=C(/C)CBr Amb27816467 [1,1,0,0,0,0|1,0,1]=4 1129 B9R0.46 C=CCCC\C=C(/C)CCl Amb27832391 [1,1,0,0,0,0|1,0,1]=4 1130 B9R0.46 C=CCCNCC(=C)CC Amb27836869 [1,1,0,0,0,0|2,0,0]=4 1131 B9R0.46 C=C[C@@H](O)CCCCCC Amb27197186 [1,1,0,0,0,0|1,0,1]=4 1132 B9R0.46 C=C\C(C)=C/CCCC=O Amb25887767 [1,1,0,0,0,0|0,0,2]=4 1133 B9R0.46 C=C\C(C)=C\CCCC=O Amb28287331 [1,1,0,0,0,0|0,0,2]=4 1134 B9R0.46 CC(C=O)CCCCC=O Amb27614225 [1,1,0,0,0,0|1,0,1]=4 1135 B9R0.46 CC(C=O)CC\C=C/C#N Amb18643169 [1,1,0,0,0,0|1,0,1]=4 1136 B9R0.46 CC(C=O)CC\C=C\C#N Amb26539753 [1,1,0,0,0,0|1,0,1]=4 1137 B9R0.46 CCC(=O)CCCCC#N Amb27170911 [1,1,0,0,0,0|1,0,1]=4 1138 B9R0.46 CCC(=O)CCCCCO Amb27627259 [1,1,0,0,0,0|0,0,2]=4 1139 B9R0.46 CCC(=O)NCCCCF Amb28313877 [1,1,0,0,0,0|2,0,0]=4 1140 B9R0.46 CCC(=O)NCCCCI Amb27839559 [1,1,0,0,0,0|2,0,0]=4 1141 B9R0.46 CCC(=O)NCCCCN Amb17053701 [1,1,0,0,0,0|2,0,0]=4 1142 B9R0.46 CCC(=O)NCCOC=O Amb27779565 [1,1,0,0,0,0|2,0,0]=4 1143 B9R0.46 CCC(=O)OCCCCBr Amb28120684 [1,1,0,0,0,0|2,0,0]=4 1144 B9R0.46 CCC(=O)OCCCCCl Amb27494048 [1,1,0,0,0,0|2,0,0]=4 1145 B9R0.46 CCC(=O)OCCCCO Amb26485117 [1,1,0,0,0,0|1,0,1]=4 1146 B9R0.46 CCC(=S)SCCCCCl Amb27477889 [1,1,0,0,0,0|2,0,0]=4 1147 B9R0.46 CCC(C)CCCCC=O Amb28077640 [1,1,0,0,0,0|0,0,1]=3 1148 B9R0.46 CCC(C)CSCCC=O Amb27809578 [1,1,0,0,0,0|1,0,1]=4 1149 B9R0.46 CCC(O)CCCNC=O Amb27785123 [1,1,0,0,0,0|1,0,1]=4 1150 B9R0.46 CCCCCCC(=O)C=O Amb28422342 [1,1,0,0,0,0|0,0,2]=4 1151 B9R0.46 CCCCCCC(=O)CC Amb2720775 [1,1,0,0,0,0|0,0,2]=4 1152 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [1,1,0,0,0,0|0,0,1]=3 1153 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [1,1,0,0,0,0|0,0,1]=3 1154 B9R0.46 CCCCCNC(=O)CC Amb17736727 [1,1,0,0,0,0|1,0,1]=4 1155 B9R0.46 CCCCC\C=C(\C)CN Amb27249901 [1,1,0,0,0,0|1,0,1]=4 1156 B9R0.46 CCCCC\C=C(\Cl)CCl Amb27632425 [1,1,0,0,0,0|1,0,1]=4 1157 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [1,1,0,0,0,0|1,0,1]=4 1158 B9R0.46 CCCCOCC(O)C=O Amb27646119 [1,1,0,0,0,0|1,0,1]=4 1159 B9R0.46 CCCCSCC(C)C=O Amb27837938 [1,1,0,0,0,0|1,0,1]=4 1160 B9R0.46 CCOCCOC(C)C=O Amb27599434 [1,1,0,0,0,0|2,0,0]=4 1161 B9R0.46 CC[C@@H](C)CCCCC=O Amb28247098 [1,1,0,0,0,0|0,0,1]=3 1162 B9R0.46 CC[C@H](C)CC\C=C\CO Amb27410556 [1,1,0,0,0,0|1,0,1]=4 1163 B9R0.46 CC\C(C)=C\CCCCBr Amb27253547 [1,1,0,0,0,0|1,0,0]=3 1164 B9R0.46 CC\C=C/CCC(=O)CC Amb27192561 [1,1,0,0,0,0|0,0,2]=4 1165 B9R0.46 CC\C=C/CCC(C)C=O Amb27797306 [1,1,0,0,0,0|0,0,0]=2 1166 B9R0.46 CC\C=C/CCC(N)CC Amb27429546 [1,1,0,0,0,0|0,0,1]=3 1167 B9R0.46 CC\C=C/CC[C@@H](Cl)C=O Amb27268394 [1,1,0,0,0,0|0,0,0]=2 1168 B9R0.46 CC\C=C\CCC(=O)CC Amb28198289 [1,1,0,0,0,0|0,0,2]=4 1169 B9R0.46 CC\C=C\CNC(C)CO Amb28200613 [1,1,0,0,0,0|1,0,1]=4 1170 B9R0.46 CC\C=C\OCC(O)CO Amb28070548 [1,1,0,0,0,0|1,0,1]=4 1171 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [1,1,0,0,0,0|1,0,0]=3 1172 B9R0.46 CNC(=O)CCCNC=O Amb27959411 [1,1,0,0,0,0|2,0,0]=4 1173 B9R0.46 CNC(=O)CSCCC=O Amb27602014 [1,1,0,0,0,0|2,0,0]=4 1174 B9R0.46 COC(=O)CCCCC=O Amb16233585 [1,1,0,0,0,0|1,0,0]=3 1175 B9R0.46 COC(=O)CCCNC=O Amb27615072 [1,1,0,0,0,0|2,0,0]=4 1176 B9R0.46 C[C@@H](CBr)CCCCC=O Amb27223928 [1,1,0,0,0,0|1,0,1]=4 1177 B9R0.46 C\C(=C/CCCCCl)CCl Amb28247217 [1,1,0,0,0,0|2,0,0]=4 1178 B9R0.46 C\C(C#N)=C\CCCC=O Amb27838121 [1,1,0,0,0,0|1,0,1]=4 1179 B9R0.46 C\C=C\CCCC(=O)CC Amb26388423 [1,1,0,0,0,0|1,0,1]=4 1180 B9R0.46 C\C=C\CCCC(C)C=O Amb18643631 [1,1,0,0,0,0|0,0,0]=2 1181 B9R0.46 C\C=C\CCCC(O)CC Amb27969085 [1,1,0,0,0,0|1,0,1]=4 1182 B9R0.46 O=CCCCOC(=O)CBr Amb27841814 [1,1,0,0,0,0|2,0,0]=4 1183 B9R0.46 O=CCCCOC(=O)CCl Amb28072931 [1,1,0,0,0,0|2,0,0]=4 1184 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [0,2,0,0,0,0|0,0,2]=4 1185 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [0,2,0,0,0,0|0,0,2]=4 1186 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [0,2,0,0,0,0|0,0,2]=4 1187 B11R0.2 CCCCCCC(N)CC(N)=O Amb32787662 [0,2,0,0,0,0|0,0,2]=4 1188 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [0,2,0,0,0,0|0,0,2]=4 1189 B11R0.4 C=CCCCCCC(=O)OCC Amb6298912 [0,2,0,0,0,0|1,0,1]=4 1190 B11R0.4 CCOC(=O)CCCCCC=O Amb8471024 [0,2,0,0,0,0|0,0,1]=3 1191 B11R0.155 C=CCCCC(N)C(=O)OCC Amb32697565 [0,2,0,0,0,0|2,0,0]=4 1192 B11R0.176 C=C(Br)CCCCC(=O)OCC Amb6298919 [0,2,0,0,0,0|2,0,0]=4 1193 B11R0.176 C=C(C)CCCCC(=O)OCC Amb6298923 [0,2,0,0,0,0|2,0,0]=4 1194 B11R0.176 C=C(Cl)CCCCC(=O)OCC Amb6298915 [0,2,0,0,0,0|2,0,0]=4 1195 B11R0.176 CCCC(=O)CCCCC(=O)O Amb6305241 [0,2,0,0,0,0|0,0,1]=3 1196 B11R0.176 CCCC(=O)NCCCC(=O)O Amb5741969 [0,2,0,0,0,0|1,0,1]=4 1197 B11R0.176 CCOC(=O)CCCCC(=O)O Amb3939942 [0,2,0,0,0,0|1,0,0]=3 1198 B11R0.176 CCOC(=O)CCCCC(N)=O Amb33623115 [0,2,0,0,0,0|1,0,0]=3 1199 B11R0.176 CCOC(=O)CCCOC(C)=O Amb17613918 [0,2,0,0,0,0|2,0,0]=4 1200 B11R0.176 CCOC(=O)NCCCC(=O)O Amb6249852 [0,2,0,0,0,0|2,0,0]=4 1201 B11R0.30 CC(C)CCCCCCC(=O)[O-] Amb33513097 [0,2,0,0,0,0|0,0,2]=4 1202 B11R0.30 CC(C)COCCCCC(=O)O Amb9207793 [0,2,0,0,0,0|1,0,1]=4 1203 B11R0.30 CC(C)\C=C/CCCCC(=O)O Amb2724658 [0,2,0,0,0,0|0,0,0]=2 1204 B11R0.30 CC(C)\C=C\CCCCC(=O)O Amb4477197 [0,2,0,0,0,0|0,0,0]=2 1205 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [0,2,0,0,0,0|0,0,2]=4 1206 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [0,2,0,0,0,0|0,0,2]=4 1207 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [0,2,0,0,0,0|0,0,2]=4 1208 B11R0.42 CC(C)N(C)CCCCCC=O Amb33424050 [0,2,0,0,0,0|1,0,1]=4 1209 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [0,2,0,0,0,0|0,0,2]=4 1210 B11R0.42 CCCCCCCC(N)C(N)=O Amb18794469 [0,2,0,0,0,0|0,0,2]=4 1211 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [0,2,0,0,0,0|0,0,2]=4 1212 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [0,2,0,0,0,0|0,0,2]=4 1213 B11R0.42 CCCCCC\C=C(/C)C(C)O Amb22546750 [0,2,0,0,0,0|1,0,1]=4 1214 B11R0.42 CCC\C=C\CCC(C)C(=O)O Amb33373744 [0,2,0,0,0,0|0,0,2]=4 1215 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [0,2,0,0,0,0|0,0,2]=4 1216 B11R0.46 CCCCCC(C)CCC(=O)[O-] Amb33513096 [0,2,0,0,0,0|0,0,2]=4 1217 B11R0.46 CCC\C=C\C(N)CCC(=O)O Amb33327182 [0,2,0,0,0,0|0,0,2]=4 1218 B11R0.46 CC\C=C/C[C@H](O)C#CC(=O)O Amb28342230 [0,2,0,0,0,0|0,0,2]=4 1219 B11R0.111 CCC(=O)CCCCCC(=O)O Amb6305228 [0,2,0,0,0,0|0,0,1]=3 1220 B11R0.111 COC(=O)CCCCCC(=O)O Amb13887311 [0,2,0,0,0,0|1,0,1]=4 1221 B11R0.111 COC(=O)CCCCCC(=O)[O-] Amb34915140 [0,2,0,0,0,0|1,0,1]=4 1222 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [0,2,0,0,0,0|0,0,2]=4 1223 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,2,0,0,0,0|0,0,2]=4 1224 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [0,2,0,0,0,0|0,0,2]=4 1225 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [0,2,0,0,0,0|0,0,2]=4 1226 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [0,2,0,0,0,0|0,0,2]=4 1227 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [0,2,0,0,0,0|0,0,2]=4 1228 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [0,2,0,0,0,0|0,0,2]=4 1229 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,2,0,0,0,0|0,0,2]=4 1230 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,2,0,0,0,0|0,0,2]=4 1231 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,2,0,0,0,0|0,0,2]=4 1232 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,2,0,0,0,0|0,0,2]=4 1233 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [0,2,0,0,0,0|0,0,0]=2 1234 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [0,2,0,0,0,0|1,0,1]=4 1235 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [0,2,0,0,0,0|1,0,1]=4 1236 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [0,2,0,0,0,0|1,0,1]=4 1237 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,2,0,0,0,0|0,0,2]=4 1238 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,2,0,0,0,0|0,0,2]=4 1239 B11R0.3 C=CCCCCCCCCC=O Amb8513533 [0,2,0,0,0,0|0,0,2]=4 1240 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [0,2,0,0,0,0|0,0,2]=4 1241 B11R0.3 CCCC\C=C\CCCCCC Amb22546624 [0,2,0,0,0,0|1,0,1]=4 1242 B11R0.3 CCOCCOCCOCC=O Amb32669837 [0,2,0,0,0,0|1,0,1]=4 1243 B11R0.3 CC\C=C\CCCC\C=C\CC Amb9134735 [0,2,0,0,0,0|1,0,0]=3 1244 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [0,2,0,0,0,0|0,0,2]=4 1245 B11R0.140 C=CCCCN(C)C\C=C\CN Amb33033515 [0,2,0,0,0,0|2,0,0]=4 1246 B9R1.5 C=C1CCCCCC1C Amb35681188 [1,0,0,1,0,0|1,0,1]=4 1247 B9R1.5 CC1=CC=CCCC1=O Amb27803075 [1,0,0,1,0,0|0,0,2]=4 1248 B9R1.5 CC1=CCCCCC1O Amb27184844 [1,0,0,1,0,0|0,0,2]=4 1249 B9R1.5 CC1C=CC=CCC1=O Amb27206986 [1,0,0,1,0,0|0,0,2]=4 1250 B9R1.5 CC1C=CCCCC1=O Amb27600759 [1,0,0,1,0,0|0,0,0]=2 1251 B9R1.5 CC1CCCCCC1=O Amb26348270 [1,0,0,1,0,0|0,0,1]=3 1252 B9R1.5 CC1CCNCCC1=O Amb22886271 [1,0,0,1,0,0|1,0,1]=4 1253 B9R1.5 CC1NCCCNC1=O Amb33545017 [1,0,0,1,0,0|2,0,0]=4 1254 B9R1.5 CC1SCCCCC1=O Amb28048147 [1,0,0,1,0,0|1,0,0]=3 1255 B9R1.5 CN1CCCCCC1=O Amb2779825 [1,0,0,1,0,0|1,0,1]=4 1256 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [1,0,0,1,0,0|1,0,1]=4 1257 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [1,0,0,1,0,0|2,0,0]=4 1258 B9R1.5 C[C@H]1C=CCCC[C@@H]1O Amb27852529 [1,0,0,1,0,0|0,0,1]=3 1259 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [1,0,0,1,0,0|2,0,0]=4 1260 B9R1.5 NC1CCCC=CC1O Amb27209173 [1,0,0,1,0,0|2,0,0]=4 1261 B9R1.5 NC1CCCCCC1=O Amb18276126 [1,0,0,1,0,0|1,0,1]=4 1262 B9R1.5 NC1CCCCCC1=O Amb28934932 [1,0,0,1,0,0|1,0,1]=4 1263 B9R1.5 O=C1CCCCC=C1Br Amb27482990 [1,0,0,1,0,0|1,0,0]=3 1264 B9R1.5 O=C1CCCCC=C1F Amb27835100 [1,0,0,1,0,0|1,0,0]=3 1265 B9R1.5 O=C1CCCCCC1=O Amb17593310 [1,0,0,1,0,0|1,0,1]=4 1266 B9R1.5 O=C1CCCCCC1Br Amb18325296 [1,0,0,1,0,0|1,0,1]=4 1267 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [1,0,0,1,0,0|1,0,1]=4 1268 B9R1.5 O=C1CCCCCC1F Amb21965071 [1,0,0,1,0,0|1,0,1]=4 1269 B9R1.5 O=C1CCCCCC1O Amb25284997 [1,0,0,1,0,0|1,0,1]=4 1270 B9R1.5 O=C1CCCCCC1S Amb28199868 [1,0,0,1,0,0|1,0,1]=4 1271 B9R1.5 O=C1CCCCOC1=O Amb27227093 [1,0,0,1,0,0|2,0,0]=4 1272 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [1,0,0,1,0,0|1,0,1]=4 1273 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [1,0,0,1,0,0|1,0,1]=4 1274 B9R1.8 BrCC=C1CCCCC1 Amb27841870 [1,0,0,1,0,0|1,0,1]=4 1275 B9R1.8 BrCCC1=CCCCC1 Amb26032382 [1,0,0,1,0,0|1,0,1]=4 1276 B9R1.8 BrCCC1CC=CCC1 Amb24711406 [1,0,0,1,0,0|1,0,0]=3 1277 B9R1.8 Br\C=C\C1CC=CCC1 Amb33134827 [1,0,0,1,0,0|1,0,1]=4 1278 B9R1.8 C#CCC1CC=CCC1 Amb33203478 [1,0,0,1,0,0|0,0,2]=4 1279 B9R1.8 C=CCC1CCCCC1 Amb3940551 [1,0,0,1,0,0|1,0,1]=4 1280 B9R1.8 C=CCC1CCNCC1 Amb24744402 [1,0,0,1,0,0|2,0,0]=4 1281 B9R1.8 C=CCC1CCOCC1 Amb27769214 [1,0,0,1,0,0|2,0,0]=4 1282 B9R1.8 CCCC1=NCCCC1 Amb27266018 [1,0,0,1,0,0|1,0,1]=4 1283 B9R1.8 CCCC1C=CCCC1 Amb27644637 [1,0,0,1,0,0|1,0,1]=4 1284 B9R1.8 CCCC1CC=CCN1 Amb27195040 [1,0,0,1,0,0|1,0,1]=4 1285 B9R1.8 CCCC1CCC=CO1 Amb27423642 [1,0,0,1,0,0|1,0,1]=4 1286 B9R1.8 CCCN1CC=CCC1 Amb32455985 [1,0,0,1,0,0|1,0,1]=4 1287 B9R1.8 CCNC1CC=CCC1 Amb27648453 [1,0,0,1,0,0|1,0,1]=4 1288 B9R1.8 CCOC1=CCCCC1 Amb8471211 [1,0,0,1,0,0|1,0,0]=3 1289 B9R1.8 CCOC1=NCCCC1 Amb19889297 [1,0,0,1,0,0|2,0,0]=4 1290 B9R1.8 CNCC1=CCCCC1 Amb28246319 [1,0,0,1,0,0|1,0,1]=4 1291 B9R1.8 CNCC1CC=CCC1 Amb6718986 [1,0,0,1,0,0|1,0,1]=4 1292 B9R1.8 C\C=C/[C@@H]1CCCCN1 Amb27640688 [1,0,0,1,0,0|1,0,1]=4 1293 B9R1.8 C\C=C/[C@H]1CCCCN1 Amb27196218 [1,0,0,1,0,0|1,0,1]=4 1294 B9R1.8 C\C=C\C1=NCCCC1 Amb27435806 [1,0,0,1,0,0|1,0,1]=4 1295 B9R1.8 C\C=C\C1CCCCC1 Amb34915057 [1,0,0,1,0,0|1,0,1]=4 1296 B9R1.8 C\C=C\C1CCCCN1 Amb28398073 [1,0,0,1,0,0|1,0,1]=4 1297 B9R1.8 C\C=C\[C@H]1CCCCN1 Amb28245384 [1,0,0,1,0,0|1,0,1]=4 1298 B9R1.8 N#CCC1CC=CCC1 Amb18642018 [1,0,0,1,0,0|1,0,1]=4 1299 B9R1.8 NCC=C1CCCCC1 Amb17605580 [1,0,0,1,0,0|1,0,1]=4 1300 B9R1.8 NCCC1=CCCCC1 Amb3939984 [1,0,0,1,0,0|1,0,1]=4 1301 B9R1.8 NCCC1CC=CCC1 Amb26355165 [1,0,0,1,0,0|1,0,0]=3 1302 B9R1.8 NCCC1CC=CCC1 Amb32434790 [1,0,0,1,0,0|1,0,0]=3 1303 B9R1.8 NCCC1CCC=CO1 Amb25743698 [1,0,0,1,0,0|2,0,0]=4 1304 B9R1.8 NCCN1CC=CCC1 Amb18636668 [1,0,0,1,0,0|2,0,0]=4 1305 B9R1.8 NCCN1CC=CCC1 Amb28935015 [1,0,0,1,0,0|2,0,0]=4 1306 B9R1.8 NNCC1CC=CCC1 Amb24501458 [1,0,0,1,0,0|2,0,0]=4 1307 B9R1.8 NOCC1CC=CCC1 Amb33316325 [1,0,0,1,0,0|2,0,0]=4 1308 B9R1.8 O=C=NC1CC=CCC1 Amb19148065 [1,0,0,1,0,0|1,0,1]=4 1309 B9R1.8 O=CCC1CC=CCC1 Amb18642222 [1,0,0,1,0,0|0,0,0]=2 1310 B9R1.8 O=CCC1CCCCC1 Amb10070777 [1,0,0,1,0,0|0,0,1]=3 1311 B9R1.8 O=CCC1CCCCN1 Amb18203260 [1,0,0,1,0,0|1,0,1]=4 1312 B9R1.8 O=CCC1CCCCO1 Amb25888588 [1,0,0,1,0,0|1,0,1]=4 1313 B9R1.8 O=CCC1CCCOC1 Amb22411365 [1,0,0,1,0,0|1,0,1]=4 1314 B9R1.8 O=CCC1CCCSC1 Amb27433487 [1,0,0,1,0,0|1,0,1]=4 1315 B9R1.8 O=CCC1CCOCC1 Amb33542150 [1,0,0,1,0,0|1,0,0]=3 1316 B9R1.8 O=CCC1CCSCC1 Amb2683358 [1,0,0,1,0,0|1,0,0]=3 1317 B9R1.8 O=CCN1CCCCC1 Amb20248700 [1,0,0,1,0,0|1,0,1]=4 1318 B9R1.8 O=CCN1CCCCC1 Amb32409629 [1,0,0,1,0,0|1,0,1]=4 1319 B9R1.8 O=CCN1CCNCC1 Amb18957932 [1,0,0,1,0,0|2,0,0]=4 1320 B9R1.8 O=CCN1CCOCC1 Amb2696304 [1,0,0,1,0,0|2,0,0]=4 1321 B9R1.8 O=CCN1CCOCC1 Amb33870488 [1,0,0,1,0,0|2,0,0]=4 1322 B9R1.8 O=CCN1CCSCC1 Amb27837482 [1,0,0,1,0,0|2,0,0]=4 1323 B9R1.8 OCC=C1CCCCC1 Amb25783847 [1,0,0,1,0,0|1,0,1]=4 1324 B9R1.8 OCCC1=CCCCC1 Amb17593322 [1,0,0,1,0,0|1,0,1]=4 1325 B9R1.8 OCCC1CC=CCC1 Amb17593319 [1,0,0,1,0,0|0,0,1]=3 1326 B9R1.8 OCCC1CCC=CO1 Amb24481996 [1,0,0,1,0,0|1,0,1]=4 1327 B9R1.8 ONCC1CC=CCC1 Amb24529066 [1,0,0,1,0,0|1,0,1]=4 1328 B9R1.8 SCCC1CC=CCC1 Amb33318637 [1,0,0,1,0,0|0,1,0]=3 1329 B9R1.8 [C-]#[N+]CC1CC=CCC1 Amb33314395 [1,0,0,1,0,0|1,0,1]=4 1330 B9R1.12 BrCCCC1CC=CC1 Amb32688152 [1,0,0,1,0,0|1,0,1]=4 1331 B9R1.12 BrC\C=C\C1CCCC1 Amb28057257 [1,0,0,1,0,0|1,0,1]=4 1332 B9R1.12 C#CCCC1CC=CC1 Amb30031117 [1,0,0,1,0,0|1,0,1]=4 1333 B9R1.12 C=CCCC1CC=CC1 Amb30031173 [1,0,0,1,0,0|1,0,0]=3 1334 B9R1.12 C=CCCC1CCCC1 Amb27838488 [1,0,0,1,0,0|1,0,1]=4 1335 B9R1.12 C=CCCC1CCNC1 Amb27231511 [1,0,0,1,0,0|2,0,0]=4 1336 B9R1.12 C=CCC[C@@H]1CCOC1 Amb28366112 [1,0,0,1,0,0|2,0,0]=4 1337 B9R1.12 C=CCNC1C=CCC1 Amb35713400 [1,0,0,1,0,0|1,0,1]=4 1338 B9R1.12 C=CCNC1CC=CC1 Amb28384037 [1,0,0,1,0,0|2,0,0]=4 1339 B9R1.12 CCCCC1C=CCN1 Amb10608225 [1,0,0,1,0,0|1,0,1]=4 1340 B9R1.12 CCCCC1C=CCN1 Amb22587190 [1,0,0,1,0,0|1,0,1]=4 1341 B9R1.12 CCCCC1CC=CC1 Amb30032420 [1,0,0,1,0,0|1,0,1]=4 1342 B9R1.12 CCCNC1C=CCC1 Amb35672230 [1,0,0,1,0,0|1,0,1]=4 1343 B9R1.12 CC\C=C\C1=NCCC1 Amb24563609 [1,0,0,1,0,0|1,0,1]=4 1344 B9R1.12 CC\C=C\C1CCCC1 Amb27267419 [1,0,0,1,0,0|0,0,1]=3 1345 B9R1.12 CC\C=C\C1CCCN1 Amb32954065 [1,0,0,1,0,0|1,0,0]=3 1346 B9R1.12 CC\C=C\C1CCNC1 Amb33474220 [1,0,0,1,0,0|1,0,1]=4 1347 B9R1.12 CC\C=C\C1OCCO1 Amb24359824 [1,0,0,1,0,0|1,0,1]=4 1348 B9R1.12 CC\C=C\N1CCCC1 Amb22266071 [1,0,0,1,0,0|1,0,1]=4 1349 B9R1.12 COCCC1CC=CC1 Amb30031560 [1,0,0,1,0,0|2,0,0]=4 1350 B9R1.12 ClCCCC1CC=CC1 Amb32688151 [1,0,0,1,0,0|1,0,1]=4 1351 B9R1.12 ClC\C=C\C1CCCC1 Amb27410192 [1,0,0,1,0,0|1,0,1]=4 1352 B9R1.12 FCCNC1C=CCC1 Amb35713401 [1,0,0,1,0,0|2,0,0]=4 1353 B9R1.12 NCCCC1C=CCC1 Amb26386566 [1,0,0,1,0,0|1,0,0]=3 1354 B9R1.12 NCCCC1CC=CC1 Amb30034364 [1,0,0,1,0,0|1,0,1]=4 1355 B9R1.12 NCCNC1C=CCC1 Amb30008520 [1,0,0,1,0,0|2,0,0]=4 1356 B9R1.12 NC\C=C\C1CCCC1 Amb27869342 [1,0,0,1,0,0|1,0,1]=4 1357 B9R1.12 NC\C=C\C1CCCO1 Amb33449857 [1,0,0,1,0,0|1,0,1]=4 1358 B9R1.12 NC\C=C\C1CCCS1 Amb33414473 [1,0,0,1,0,0|1,1,0]=4 1359 B9R1.12 NNCCC1CC=CC1 Amb29886094 [1,0,0,1,0,0|2,0,0]=4 1360 B9R1.12 O=C=NCC1C=CCC1 Amb24481865 [1,0,0,1,0,0|1,0,1]=4 1361 B9R1.12 O=CCCC1CCCC1 Amb8009615 [1,0,0,1,0,0|0,0,1]=3 1362 B9R1.12 O=CCCC1CCCO1 Amb22489681 [1,0,0,1,0,0|1,0,1]=4 1363 B9R1.12 O=CCCC1CCCS1 Amb33415402 [1,0,0,1,0,0|1,0,1]=4 1364 B9R1.12 O=CCCC1CCOC1 Amb20247596 [1,0,0,1,0,0|1,0,0]=3 1365 B9R1.12 O=CCCC1CCSC1 Amb24666919 [1,0,0,1,0,0|1,0,0]=3 1366 B9R1.12 O=CCCN1CCCC1 Amb27837417 [1,0,0,1,0,0|1,0,1]=4 1367 B9R1.12 O=CCC[N+]1=CCCC1 Amb27401168 [1,0,0,1,0,0|1,0,1]=4 1368 B9R1.12 O=CCOC1CCCC1 Amb27169387 [1,0,0,1,0,0|1,0,1]=4 1369 B9R1.12 O=CNCC1CCSC1 Amb27395543 [1,0,0,1,0,0|2,0,0]=4 1370 B9R1.12 OCCCC1CC=CC1 Amb28315438 [1,0,0,1,0,0|0,0,2]=4 1371 B9R1.12 OC\C=C\C1CCCC1 Amb33428704 [1,0,0,1,0,0|1,0,1]=4 1372 B9R1.12 OC\C=C\C1CCCO1 Amb33226990 [1,0,0,1,0,0|1,0,1]=4 1373 B9R1.12 OC\C=C\C1CCCS1 Amb33414579 [1,0,0,1,0,0|1,1,0]=4 1374 B9R1.14 C=C[C@@H]1CCC[C@@H]1C=O Amb28346572 [1,0,0,1,0,0|0,0,2]=4 1375 B9R1.14 CCC1CCC=C1CO Amb28049264 [1,0,0,1,0,0|1,0,1]=4 1376 B9R1.14 CCC1COCC1C=O Amb29882927 [1,0,0,1,0,0|1,0,1]=4 1377 B9R1.14 CO[C@@H]1CCC[C@@H]1C=O Amb28057513 [1,0,0,1,0,0|1,0,1]=4 1378 B9R1.14 CO[C@H]1CCC[C@@H]1C=O Amb27230343 [1,0,0,1,0,0|1,0,1]=4 1379 B9R1.14 O=CC1CCCC1C=O Amb28053995 [1,0,0,1,0,0|1,0,1]=4 1380 B9R1.15 C=C1CCCCC1CC Amb27952112 [1,0,0,1,0,0|1,0,1]=4 1381 B9R1.15 C=CC1=CCCCC1=O Amb27434250 [1,0,0,1,0,0|0,0,2]=4 1382 B9R1.15 C=CN1CCCCC1=O Amb3568877 [1,0,0,1,0,0|1,0,1]=4 1383 B9R1.15 C=C[C@@H]1CCC=C[C@@H]1O Amb28053736 [1,0,0,1,0,0|1,0,1]=4 1384 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [1,0,0,1,0,0|2,0,0]=4 1385 B9R1.15 CC1C=CCCC1CCl Amb27805564 [1,0,0,1,0,0|1,0,0]=3 1386 B9R1.15 CC1C=CCCC1CN Amb28046907 [1,0,0,1,0,0|1,0,0]=3 1387 B9R1.15 CC1CC=CCC1C=O Amb4034578 [1,0,0,1,0,0|0,0,2]=4 1388 B9R1.15 CC1CCCCC1C=O Amb18642449 [1,0,0,1,0,0|0,0,1]=3 1389 B9R1.15 CC1OCCCC1C=O Amb27872989 [1,0,0,1,0,0|1,0,0]=3 1390 B9R1.15 CC1SCCSC1C=O Amb27956572 [1,0,0,1,0,0|2,0,0]=4 1391 B9R1.15 CCC1=C(C)CCNC1 Amb24556041 [1,0,0,1,0,0|2,0,0]=4 1392 B9R1.15 CCC1=CCCCC1=O Amb27838623 [1,0,0,1,0,0|0,0,0]=2 1393 B9R1.15 CCC1=CCCCC1O Amb27808543 [1,0,0,1,0,0|0,0,1]=3 1394 B9R1.15 CCC1=[N+]([O-])CCCC1 Amb27201291 [1,0,0,1,0,0|1,0,1]=4 1395 B9R1.15 CCC1CCCCC1=O Amb22002104 [1,0,0,1,0,0|0,0,1]=3 1396 B9R1.15 CCC1CCCNC1=O Amb22276357 [1,0,0,1,0,0|1,0,1]=4 1397 B9R1.15 CCC1CCOCC1=O Amb33295409 [1,0,0,1,0,0|1,0,1]=4 1398 B9R1.15 CCC1CNCCC1=O Amb18642532 [1,0,0,1,0,0|1,0,1]=4 1399 B9R1.15 CCC1CNCCC1=O Amb23400918 [1,0,0,1,0,0|1,0,1]=4 1400 B9R1.15 CCC1COCCC1=O Amb25687037 [1,0,0,1,0,0|1,0,1]=4 1401 B9R1.15 CCC1NCCCC1=O Amb19888368 [1,0,0,1,0,0|1,0,1]=4 1402 B9R1.15 CCC1NCCCC1=O Amb28055859 [1,0,0,1,0,0|1,0,1]=4 1403 B9R1.15 CCN1CCCCC1=N Amb27242284 [1,0,0,1,0,0|2,0,0]=4 1404 B9R1.15 CCN1CCCNC1=O Amb15701510 [1,0,0,1,0,0|2,0,0]=4 1405 B9R1.15 CCN1CCNCC1=O Amb22227951 [1,0,0,1,0,0|2,0,0]=4 1406 B9R1.15 CCN1CCNCC1=O Amb9833685 [1,0,0,1,0,0|2,0,0]=4 1407 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [1,0,0,1,0,0|0,0,1]=3 1408 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [1,0,0,1,0,0|1,0,1]=4 1409 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [1,0,0,1,0,0|1,0,1]=4 1410 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [1,0,0,1,0,0|1,0,1]=4 1411 B9R1.15 CN1CCCC[C@H]1C=O Amb27798376 [1,0,0,1,0,0|1,0,1]=4 1412 B9R1.15 CNC1=CCCCC1=O Amb25743372 [1,0,0,1,0,0|1,0,0]=3 1413 B9R1.15 CNC1CCCC=C1C Amb27663676 [1,0,0,1,0,0|2,0,0]=4 1414 B9R1.15 CNC1CCCCC1=O Amb28984230 [1,0,0,1,0,0|1,0,1]=4 1415 B9R1.15 CNC1CCCCC1=O Amb3644506 [1,0,0,1,0,0|1,0,1]=4 1416 B9R1.15 COC1=CCCCC1=O Amb22755964 [1,0,0,1,0,0|1,0,0]=3 1417 B9R1.15 COC1=CCCCC1O Amb26050792 [1,0,0,1,0,0|1,0,1]=4 1418 B9R1.15 COC1CCCCC1=O Amb4606000 [1,0,0,1,0,0|1,0,1]=4 1419 B9R1.15 CON1CCCCC1=O Amb27669022 [1,0,0,1,0,0|2,0,0]=4 1420 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [1,0,0,1,0,0|1,0,1]=4 1421 B9R1.15 CO[C@H]1CCCCC1=O Amb8386937 [1,0,0,1,0,0|1,0,1]=4 1422 B9R1.15 CSC1=CCCCC1=O Amb27255244 [1,0,0,1,0,0|1,0,0]=3 1423 B9R1.15 CSC1CCCCC1=O Amb19267090 [1,0,0,1,0,0|1,0,1]=4 1424 B9R1.15 C[C@@H]1C=CCC[C@H]1C=O Amb28246398 [1,0,0,1,0,0|0,0,0]=2 1425 B9R1.15 C[C@@H]1CCCC[C@H]1C=O Amb28248314 [1,0,0,1,0,0|0,0,1]=3 1426 B9R1.15 C[C@@H]1CCCO[C@H]1C=O Amb28255632 [1,0,0,1,0,0|1,0,1]=4 1427 B9R1.15 C[C@H]1C=CCC[C@H]1CN Amb27420782 [1,0,0,1,0,0|1,0,0]=3 1428 B9R1.15 C[C@H]1CC=CC[C@H]1C=O Amb27467799 [1,0,0,1,0,0|0,0,2]=4 1429 B9R1.15 C\C=C1/CCCCC1=O Amb10558348 [1,0,0,1,0,0|0,0,0]=2 1430 B9R1.15 C\C=C1/CCCC[C@H]1N Amb26977852 [1,0,0,1,0,0|1,0,1]=4 1431 B9R1.15 C\C=C1\CCCCC1=O Amb24571944 [1,0,0,1,0,0|0,0,0]=2 1432 B9R1.15 C\C=C1\CCCCC1N Amb27237317 [1,0,0,1,0,0|1,0,1]=4 1433 B9R1.15 C\C=C1\CNCCC1=O Amb32649111 [1,0,0,1,0,0|1,0,0]=3 1434 B9R1.15 C\C=C1\COCCC1=O Amb27750956 [1,0,0,1,0,0|1,0,0]=3 1435 B9R1.15 C\C=C1\CSCCC1=O Amb32649112 [1,0,0,1,0,0|1,0,0]=3 1436 B9R1.15 ClCC1=C(Cl)CCCC1 Amb27595204 [1,0,0,1,0,0|2,0,0]=4 1437 B9R1.15 ClCC1=CCCCC1Cl Amb27493133 [1,0,0,1,0,0|2,0,0]=4 1438 B9R1.15 N#CC1=CCCCC1=O Amb27847881 [1,0,0,1,0,0|1,0,1]=4 1439 B9R1.15 NC1C=CCCC1CO Amb27841059 [1,0,0,1,0,0|1,0,1]=4 1440 B9R1.15 NC1CCCCC1C=O Amb27607940 [1,0,0,1,0,0|1,0,1]=4 1441 B9R1.15 NCC1=C(Cl)CCCC1 Amb18251295 [1,0,0,1,0,0|2,0,0]=4 1442 B9R1.15 NCC1CCCCC1=O Amb18203259 [1,0,0,1,0,0|1,0,1]=4 1443 B9R1.15 N[C@@H]1C=CCC[C@H]1CO Amb26464134 [1,0,0,1,0,0|1,0,1]=4 1444 B9R1.15 N[C@H]1C=CCC[C@H]1CO Amb25231204 [1,0,0,1,0,0|1,0,1]=4 1445 B9R1.15 N\C=C1/CCCCC1=O Amb28054309 [1,0,0,1,0,0|1,0,0]=3 1446 B9R1.15 N\C=C1\CCCCC1=O Amb25146068 [1,0,0,1,0,0|1,0,0]=3 1447 B9R1.15 O=C1CCCC=C1CBr Amb27180223 [1,0,0,1,0,0|1,0,0]=3 1448 B9R1.15 O=C1CCCC=C1CCl Amb27424688 [1,0,0,1,0,0|1,0,0]=3 1449 B9R1.15 O=C1CCCC=C1CO Amb24453147 [1,0,0,1,0,0|1,0,0]=3 1450 B9R1.15 O=C1CCCCC1CO Amb16231080 [1,0,0,1,0,0|1,0,1]=4 1451 B9R1.15 O=C1CCCCC1CS Amb27838753 [1,0,0,1,0,0|1,0,1]=4 1452 B9R1.15 O=C1CCCCN1CCl Amb2798048 [1,0,0,1,0,0|2,0,0]=4 1453 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [1,0,0,1,0,0|1,0,1]=4 1454 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [1,0,0,1,0,0|1,0,1]=4 1455 B9R1.15 O=C1CCCC\C1=C/O Amb33109815 [1,0,0,1,0,0|1,0,0]=3 1456 B9R1.15 O=C1CCCC\C1=C/[O-] Amb33541795 [1,0,0,1,0,0|1,0,0]=3 1457 B9R1.15 O=C1CCCC\C1=C\Br Amb27492896 [1,0,0,1,0,0|1,0,0]=3 1458 B9R1.15 O=C1CCCC\C1=C\Cl Amb27200151 [1,0,0,1,0,0|1,0,0]=3 1459 B9R1.15 O=C1CCCC\C1=C\O Amb20001480 [1,0,0,1,0,0|1,0,0]=3 1460 B9R1.15 O=C1CCCC\C1=C\[O-] Amb27247843 [1,0,0,1,0,0|1,0,0]=3 1461 B9R1.15 O=C1CCCC\C1=N\O Amb27780978 [1,0,0,1,0,0|2,0,0]=4 1462 B9R1.15 O=C1CCSC\C1=C\O Amb24736136 [1,0,0,1,0,0|2,0,0]=4 1463 B9R1.15 O=C1OCCC\C1=C\O Amb27465766 [1,0,0,1,0,0|2,0,0]=4 1464 B9R1.15 O=C1SCCC\C1=C\O Amb27652949 [1,0,0,1,0,0|2,0,0]=4 1465 B9R1.15 O=CC1=C(Br)CCCC1 Amb18522186 [1,0,0,1,0,0|2,0,0]=4 1466 B9R1.15 O=CC1=C(Cl)CCCC1 Amb2797788 [1,0,0,1,0,0|2,0,0]=4 1467 B9R1.15 O=CC1=C(S)CCCC1 Amb28074713 [1,0,0,1,0,0|1,1,0]=4 1468 B9R1.15 O=CC1CCCCC1=O Amb19651323 [1,0,0,1,0,0|1,0,1]=4 1469 B9R1.15 O=CC1CCCCC1F Amb24554787 [1,0,0,1,0,0|1,0,1]=4 1470 B9R1.15 O=CC1CCCCC1O Amb25350532 [1,0,0,1,0,0|1,0,1]=4 1471 B9R1.15 O=CN1CCCCC1=O Amb27861937 [1,0,0,1,0,0|2,0,0]=4 1472 B9R1.15 O=C[C@H]1CCC=C[C@H]1O Amb27854577 [1,0,0,1,0,0|1,0,0]=3 1473 B9R1.15 OC1CCCC=C1CCl Amb28060583 [1,0,0,1,0,0|1,0,1]=4 1474 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [1,0,0,1,0,0|2,0,0]=4 1475 B9R1.15 OC[C@@H]1CCC=C[C@@H]1O Amb27215271 [1,0,0,1,0,0|1,0,1]=4 1476 B9R1.15 OC[C@H]1CCC=C[C@H]1O Amb27218905 [1,0,0,1,0,0|1,0,1]=4 1477 B9R1.15 [N-]=[N+]=C1CCCCC1=O Amb25074525 [1,0,0,1,0,0|2,0,0]=4 1478 B9R1.16 CC1CC1CCCC=O Amb33143871 [1,0,0,1,0,0|0,0,1]=3 1479 B9R1.17 CC\C=C\CC1CNC1 Amb33268266 [1,0,0,1,0,0|1,0,1]=4 1480 B9R1.17 O=CCCCC1CCC1 Amb33197139 [1,0,0,1,0,0|0,0,1]=3 1481 B9R1.17 O=CNCCC1CCN1 Amb28286866 [1,0,0,1,0,0|2,0,0]=4 1482 B9R1.20 CCCCC1OC1C=O Amb26852359 [1,0,0,1,0,0|1,0,1]=4 1483 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [1,0,0,1,0,0|0,0,1]=3 1484 B9R1.20 CC\C=C\C1CC1CN Amb33267542 [1,0,0,1,0,0|1,0,0]=3 1485 B9R1.20 CC\C=C\C1OC1C=O Amb28194116 [1,0,0,1,0,0|1,0,0]=3 1486 B9R1.20 CC\C=C\C1OC1CO Amb27207668 [1,0,0,1,0,0|1,0,1]=4 1487 B9R1.20 CC\C=C\[C@@H]1C[C@H]1CN Amb33267543 [1,0,0,1,0,0|1,0,0]=3 1488 B9R1.20 CC\C=C\[C@H]1O[C@@H]1CO Amb27207853 [1,0,0,1,0,0|1,0,1]=4 1489 B9R1.20 C\C=C\CC1OC1C=O Amb28324398 [1,0,0,1,0,0|1,0,0]=3 1490 B9R1.20 O=C[C@H]1C[C@H]1CCCBr Amb27202574 [1,0,0,1,0,0|1,0,1]=4 1491 B9R1.33 C=CCC1CC=CC1O Amb28401040 [1,0,0,1,0,0|1,0,1]=4 1492 B9R1.33 C=CCC1CCCC1=O Amb27254600 [1,0,0,1,0,0|0,0,2]=4 1493 B9R1.33 C=CC[C@@H]1CCCC1=O Amb27227506 [1,0,0,1,0,0|0,0,2]=4 1494 B9R1.33 C=C\C=C1\CCCC1=O Amb25735080 [1,0,0,1,0,0|0,0,2]=4 1495 B9R1.33 CC1CCCC1NC=O Amb28430376 [1,0,0,1,0,0|1,0,1]=4 1496 B9R1.33 CC1CCC\C1=C/CN Amb27185789 [1,0,0,1,0,0|1,0,1]=4 1497 B9R1.33 CC1OCCC1CC=O Amb33427195 [1,0,0,1,0,0|1,0,0]=3 1498 B9R1.33 CC1SCCC1CC=O Amb28286972 [1,0,0,1,0,0|1,0,0]=3 1499 B9R1.33 CCCC1CCCC1=O Amb8503562 [1,0,0,1,0,0|0,0,1]=3 1500 B9R1.33 CCCC1COCC1=O Amb35639022 [1,0,0,1,0,0|1,0,1]=4 1501 B9R1.33 CCCN1CCCC1=O Amb15691721 [1,0,0,1,0,0|1,0,1]=4 1502 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [1,0,0,1,0,0|0,0,1]=3 1503 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [1,0,0,1,0,0|1,0,1]=4 1504 B9R1.33 CCNC1CCNC1=O Amb28249830 [1,0,0,1,0,0|2,0,0]=4 1505 B9R1.33 CCNC1CCNC1=O Amb28960288 [1,0,0,1,0,0|2,0,0]=4 1506 B9R1.33 CCNC1CCSC1=O Amb25706233 [1,0,0,1,0,0|2,0,0]=4 1507 B9R1.33 CCN[C@H]1CCOC1=O Amb28249000 [1,0,0,1,0,0|2,0,0]=4 1508 B9R1.33 CCOC1=CCCC1=O Amb27256367 [1,0,0,1,0,0|1,0,1]=4 1509 B9R1.33 CCOC1CCCC1=O Amb25147133 [1,0,0,1,0,0|1,0,0]=3 1510 B9R1.33 CCSC1=CCCC1=O Amb27861411 [1,0,0,1,0,0|1,0,1]=4 1511 B9R1.33 CCSC1CCNC1=O Amb27837709 [1,0,0,1,0,0|2,0,0]=4 1512 B9R1.33 CCSC1CCOC1=O Amb27975642 [1,0,0,1,0,0|2,0,0]=4 1513 B9R1.33 CC\C=C1/CC=CC1=O Amb28144042 [1,0,0,1,0,0|0,0,2]=4 1514 B9R1.33 CC\C=C1/CCCC1=O Amb27235548 [1,0,0,1,0,0|0,0,0]=2 1515 B9R1.33 CC\C=C1\CCCC1=O Amb26408836 [1,0,0,1,0,0|0,0,0]=2 1516 B9R1.33 CC\C=C1\CCOC1=O Amb25225082 [1,0,0,1,0,0|1,0,0]=3 1517 B9R1.33 CNCC1CCCC1=O Amb27202013 [1,0,0,1,0,0|1,0,1]=4 1518 B9R1.33 CN\C=C1\CCCC1=O Amb24477752 [1,0,0,1,0,0|1,0,0]=3 1519 B9R1.33 CN\C=C1\CCOC1=O Amb27214023 [1,0,0,1,0,0|2,0,0]=4 1520 B9R1.33 COCC1CCCC1=O Amb25766356 [1,0,0,1,0,0|1,0,1]=4 1521 B9R1.33 CO\C=C1\CCCC1=O Amb27640557 [1,0,0,1,0,0|1,0,0]=3 1522 B9R1.33 CSCC1CCCC1=O Amb27838797 [1,0,0,1,0,0|1,0,1]=4 1523 B9R1.33 CS\C=C1/CCCC1=O Amb27185670 [1,0,0,1,0,0|1,0,0]=3 1524 B9R1.33 CS\C=C1\CCCC1O Amb28315538 [1,0,0,1,0,0|1,0,1]=4 1525 B9R1.33 C\C=C/C1CCCC1=O Amb27594741 [1,0,0,1,0,0|0,0,0]=2 1526 B9R1.33 C\C=C\C1=CCCC1=O Amb26002515 [1,0,0,1,0,0|0,0,2]=4 1527 B9R1.33 C\C=C\C1CCCC1O Amb32944936 [1,0,0,1,0,0|0,0,2]=4 1528 B9R1.33 C\C=C\N1CCCC1=O Amb27767943 [1,0,0,1,0,0|1,0,0]=3 1529 B9R1.33 C\C=C\[C@@H]1CCC[C@@H]1O Amb28069459 [1,0,0,1,0,0|0,0,2]=4 1530 B9R1.33 C\C=C\[C@@H]1CCC[C@H]1O Amb27196803 [1,0,0,1,0,0|0,0,2]=4 1531 B9R1.33 NCCC1CCCC1=O Amb18832679 [1,0,0,1,0,0|1,0,1]=4 1532 B9R1.33 O=C1CCCC1CCBr Amb20623655 [1,0,0,1,0,0|1,0,1]=4 1533 B9R1.33 O=C1CCCC1CCF Amb33551119 [1,0,0,1,0,0|1,0,1]=4 1534 B9R1.33 O=C1CCCC1CCO Amb27221111 [1,0,0,1,0,0|1,0,1]=4 1535 B9R1.33 O=C1CCCN1\C=C\I Amb32665159 [1,0,0,1,0,0|2,0,0]=4 1536 B9R1.33 O=CC[C@@H]1CC=C[C@H]1O Amb27210535 [1,0,0,1,0,0|1,0,0]=3 1537 B9R1.33 O=COC1CCCC1=O Amb27844040 [1,0,0,1,0,0|2,0,0]=4 1538 B9R1.33 OCC[C@H]1CC=C[C@H]1O Amb27218968 [1,0,0,1,0,0|1,0,1]=4 1539 B9R1.39 O=C1CCC1CCCCl Amb32684692 [1,0,0,1,0,0|1,0,1]=4 1540 B9R1.50 BrC1=CCCC=CCC1 Amb27171357 [1,0,0,1,0,0|1,0,1]=4 1541 B9R1.50 BrC1C=CCCCC=C1 Amb27865465 [1,0,0,1,0,0|1,0,1]=4 1542 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [1,0,0,1,0,0|1,0,1]=4 1543 B9R1.50 BrC1CCC=CCCC1 Amb24355370 [1,0,0,1,0,0|1,0,0]=3 1544 B9R1.50 CC1C=CCCC=CC1 Amb22347896 [1,0,0,1,0,0|1,0,1]=4 1545 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [1,0,0,1,0,0|1,0,1]=4 1546 B9R1.50 ClC1CCC=CCCC1 Amb28118846 [1,0,0,1,0,0|1,0,0]=3 1547 B9R1.50 NC1C=CCCCCC1 Amb22410845 [1,0,0,1,0,0|1,0,1]=4 1548 B9R1.50 NC1C=CCCCCC1 Amb32652668 [1,0,0,1,0,0|1,0,1]=4 1549 B9R1.50 NC1CCC=CCCC1 Amb27814669 [1,0,0,1,0,0|1,0,0]=3 1550 B9R1.50 NC1CCC=CCCC1 Amb33307000 [1,0,0,1,0,0|1,0,0]=3 1551 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [1,0,0,1,0,0|1,0,1]=4 1552 B9R1.50 O=C1C=CC=CCCC1 Amb27164621 [1,0,0,1,0,0|0,0,2]=4 1553 B9R1.50 O=C1C=CCC=CCC1 Amb28207621 [1,0,0,1,0,0|0,0,2]=4 1554 B9R1.50 O=C1C=CCCC=CC1 Amb22365234 [1,0,0,1,0,0|0,0,2]=4 1555 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [1,0,0,1,0,0|0,0,2]=4 1556 B9R1.50 O=C1CC=CCC=CC1 Amb22365229 [1,0,0,1,0,0|0,0,2]=4 1557 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [1,0,0,1,0,0|1,0,0]=3 1558 B9R1.50 O=C1CCCCCCC1 Amb2721546 [1,0,0,1,0,0|0,0,1]=3 1559 B9R1.50 O=C1CCCCCCN1 Amb2780498 [1,0,0,1,0,0|1,0,1]=4 1560 B9R1.50 O=C1CCCCCCO1 Amb27468239 [1,0,0,1,0,0|1,0,1]=4 1561 B9R1.50 O=C1CCCSCCC1 Amb17593637 [1,0,0,1,0,0|1,0,1]=4 1562 B9R1.50 O=C1CCNCCCN1 Amb22263665 [1,0,0,1,0,0|2,0,0]=4 1563 B9R1.50 O=C1CCNCCCN1 Amb23403551 [1,0,0,1,0,0|2,0,0]=4 1564 B9R1.50 OC1C=CCCCC=C1 Amb27958555 [1,0,0,1,0,0|1,0,1]=4 1565 B9R1.50 OC1C=CCCCCC1 Amb22364937 [1,0,0,1,0,0|1,0,1]=4 1566 B9R1.50 OC1CCC=CCCC1 Amb21858009 [1,0,0,1,0,0|0,0,1]=3 1567 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [1,0,0,1,0,0|1,0,1]=4 1568 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [1,0,0,1,0,0|0,0,1]=3 1569 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [1,0,0,1,0,0|0,0,1]=3 1570 B9R1.83 BrCCCCC=C1CC1 Amb28141873 [1,0,0,1,0,0|1,0,0]=3 1571 B9R1.83 CCCCCCC1=CC1 Amb27793496 [1,0,0,1,0,0|1,0,1]=4 1572 B9R1.83 O=CCCCC=C1CC1 Amb27636935 [1,0,0,1,0,0|0,0,0]=2 1573 B9R1.83 O=CCCCCC1CC1 Amb33361884 [1,0,0,1,0,0|0,0,1]=3 1574 B9R1.83 O=CCCOCC1CC1 Amb26982387 [1,0,0,1,0,0|1,0,1]=4 1575 B9R1.83 O=CCC\C=C\C1CC1 Amb26067487 [1,0,0,1,0,0|0,0,2]=4 1576 B9R1.83 O=CCOCCC1CC1 Amb28049211 [1,0,0,1,0,0|1,0,1]=4 1577 B9R1.83 OCCCCC=C1CC1 Amb25889566 [1,0,0,1,0,0|0,0,1]=3 1578 B9R1.89 BrCC1CCC=CCC1 Amb25258005 [1,0,0,1,0,0|1,0,0]=3 1579 B9R1.89 C=CC1CCCCCC1 Amb25068667 [1,0,0,1,0,0|1,0,1]=4 1580 B9R1.89 CCC1=NCCCCN1 Amb27627181 [1,0,0,1,0,0|2,0,0]=4 1581 B9R1.89 COC1=CCCCCC1 Amb26014503 [1,0,0,1,0,0|1,0,1]=4 1582 B9R1.89 CSC1=CCCCCN1 Amb27395313 [1,0,0,1,0,0|2,0,0]=4 1583 B9R1.89 ClCC1CCC=CCC1 Amb32688179 [1,0,0,1,0,0|1,0,0]=3 1584 B9R1.89 NCC1=CCCCCC1 Amb27403312 [1,0,0,1,0,0|1,0,1]=4 1585 B9R1.89 NCC1CCC=CCC1 Amb25319588 [1,0,0,1,0,0|1,0,0]=3 1586 B9R1.89 NCC1CCC=CCC1 Amb30585194 [1,0,0,1,0,0|1,0,0]=3 1587 B9R1.89 O=CC1CCCCCC1 Amb9786985 [1,0,0,1,0,0|0,0,1]=3 1588 B9R1.89 O=CC1CCCOCC1 Amb18832626 [1,0,0,1,0,0|1,0,0]=3 1589 B9R1.89 O=CC1CCCSCC1 Amb18202390 [1,0,0,1,0,0|1,0,0]=3 1590 B9R1.89 O=CN1CCCNCC1 Amb1155085 [1,0,0,1,0,0|2,0,0]=4 1591 B9R1.89 O=C[C@H]1C=CCC=CC1 Amb27876323 [1,0,0,1,0,0|0,0,2]=4 1592 B9R1.89 OCC1=CCCCCC1 Amb27424682 [1,0,0,1,0,0|1,0,1]=4 1593 B9R1.89 OCC1CCC=CCC1 Amb25100187 [1,0,0,1,0,0|0,0,1]=3 1594 B9R1.103 C1=CCOCCCCC1 Amb29838311 [1,0,0,1,0,0|0,0,2]=4 1595 B11R1.4 BrCC\C=C\CC1CCCC1 Amb27987221 [0,1,0,1,0,0|1,0,1]=4 1596 B11R1.4 BrCC\C=C\CC1CCCO1 Amb27987219 [0,1,0,1,0,0|0,0,2]=4 1597 B11R1.4 C#CCCCCC1=CCCC1 Amb28080629 [0,1,0,1,0,0|1,0,1]=4 1598 B11R1.4 CCC\C=C\CC1CCCN1 Amb33327171 [0,1,0,1,0,0|1,0,1]=4 1599 B11R1.4 CCC\C=C\CC1CCNC1 Amb33327132 [0,1,0,1,0,0|2,0,0]=4 1600 B11R1.4 CC\C=C/CCC1OCCO1 Amb27401401 [0,1,0,1,0,0|0,0,2]=4 1601 B11R1.4 CC\C=C\CCC1OCCO1 Amb27862904 [0,1,0,1,0,0|0,0,2]=4 1602 B11R1.4 ClCC\C=C\CC1CCCC1 Amb27987209 [0,1,0,1,0,0|1,0,1]=4 1603 B11R1.4 ClCC\C=C\CC1CCCO1 Amb27987204 [0,1,0,1,0,0|0,0,2]=4 1604 B11R1.4 NCC\C=C\CC1CCCO1 Amb27987820 [0,1,0,1,0,0|0,0,2]=4 1605 B11R1.4 O=CCCCCC1CCCC1 Amb33358714 [0,1,0,1,0,0|0,0,2]=4 1606 B11R1.4 O=CCCCCN1CCCC1 Amb33225870 [0,1,0,1,0,0|0,0,2]=4 1607 B11R1.4 O=CCCCCc1cccs1 Amb18048615 [0,1,0,1,0,0|0,0,2]=4 1608 B11R1.4 O=CCCCCc1ccsc1 Amb33449957 [0,1,0,1,0,0|0,0,2]=4 1609 B11R1.4 O=CCCCCn1cccn1 Amb32727340 [0,1,0,1,0,0|1,0,1]=4 1610 B11R1.4 O=CNCCCC1CCCN1 Amb27989289 [0,1,0,1,0,0|1,0,1]=4 1611 B11R1.4 O=CNCCCC1CCNC1 Amb27989293 [0,1,0,1,0,0|1,0,1]=4 1612 B11R1.16 C=CCC(O)C1CC=CCC1 Amb28141570 [0,1,0,1,0,0|1,0,0]=3 1613 B11R1.16 CC(CCN)C1CC=CCC1 Amb33314954 [0,1,0,1,0,0|1,0,1]=4 1614 B11R1.16 CC(CON)C1CC=CCC1 Amb33203488 [0,1,0,1,0,0|2,0,0]=4 1615 B11R1.16 CC(N=C=O)C1CC=CCC1 Amb33314938 [0,1,0,1,0,0|1,0,1]=4 1616 B11R1.16 CCOC(=O)C1C=CCCC1 Amb26317877 [0,1,0,1,0,0|2,0,0]=4 1617 B11R1.16 CC\C=C(\C)C1CCCNC1 Amb35736992 [0,1,0,1,0,0|2,0,0]=4 1618 B11R1.16 CNCC(O)C1CC=CCC1 Amb27407701 [0,1,0,1,0,0|2,0,0]=4 1619 B11R1.16 COCC(O)C1CC=CCC1 Amb27204366 [0,1,0,1,0,0|2,0,0]=4 1620 B11R1.16 C[C@@H](CC=O)C1CCCCC1 Amb27794629 [0,1,0,1,0,0|0,0,2]=4 1621 B11R1.16 N#CCC(O)C1CC=CCC1 Amb25788220 [0,1,0,1,0,0|1,0,1]=4 1622 B11R1.16 NC(CCO)C1CC=CCC1 Amb24485786 [0,1,0,1,0,0|0,0,2]=4 1623 B11R1.16 NCCC(F)C1CC=CCC1 Amb33203491 [0,1,0,1,0,0|1,0,1]=4 1624 B11R1.16 NCCC(O)C1CC=CCC1 Amb26598543 [0,1,0,1,0,0|1,0,1]=4 1625 B11R1.16 NCC[C@@H](O)C1CC=CCC1 Amb33203494 [0,1,0,1,0,0|1,0,1]=4 1626 B11R1.16 NCC[C@H](O)C1CC=CCC1 Amb33203493 [0,1,0,1,0,0|1,0,1]=4 1627 B11R1.24 C=CCCN1CCC=C(C)C1 Amb27162257 [0,1,0,1,0,0|2,0,0]=4 1628 B11R1.24 C=CCC[C@H]1CCCC(=O)C1 Amb27802471 [0,1,0,1,0,0|1,0,1]=4 1629 B11R1.24 CCNCC1CCCC(=O)N1 Amb32721818 [0,1,0,1,0,0|1,0,1]=4 1630 B11R1.24 CCOCC1CCCC(=O)C1 Amb28073558 [0,1,0,1,0,0|1,0,1]=4 1631 B11R1.24 CCSCC1CCCC(=O)C1 Amb35699380 [0,1,0,1,0,0|1,0,1]=4 1632 B11R1.24 CC\C=C\[C@H]1CCC[C@H](C)N1 Amb27633547 [0,1,0,1,0,0|1,0,1]=4 1633 B11R1.24 CN1CCCC(CCC=O)C1 Amb26384287 [0,1,0,1,0,0|1,0,1]=4 1634 B11R1.24 CO\C=C\C1CCCC(=O)N1 Amb27602248 [0,1,0,1,0,0|1,0,0]=3 1635 B11R1.24 O=C1CCCC(\C=C\CBr)C1 Amb25967977 [0,1,0,1,0,0|1,0,0]=3 1636 B11R1.24 O=CCCN1CCC=C(Br)C1 Amb35688321 [0,1,0,1,0,0|1,0,0]=3 1637 B11R1.24 O=CCCN1CCC=C(Cl)C1 Amb35695891 [0,1,0,1,0,0|1,0,0]=3 1638 B11R1.24 O=CCCN1CCNC(=O)C1 Amb18787623 [0,1,0,1,0,0|2,0,0]=4 1639 B11R1.24 O=CCCN1CCOC(=O)C1 Amb27613218 [0,1,0,1,0,0|2,0,0]=4 1640 B11R1.24 O=C\C=C\C1CCCC(=O)C1 Amb27205239 [0,1,0,1,0,0|1,0,1]=4 1641 B11R1.26 C=CC1OCCC=CCC1O Amb28400813 [0,1,0,1,0,0|2,0,0]=4 1642 B11R1.26 CCC1CCCCCCC1=O Amb28284886 [0,1,0,1,0,0|0,0,2]=4 1643 B11R1.26 CC[C@@H]1C=CCCCC[C@H]1O Amb25332502 [0,1,0,1,0,0|0,0,2]=4 1644 B11R1.26 CNC1CCC=CCCC1O Amb27176303 [0,1,0,1,0,0|2,0,0]=4 1645 B11R1.26 CNC1CCCC=CCC1O Amb27817705 [0,1,0,1,0,0|2,0,0]=4 1646 B11R1.26 COC1CCC=CCCC1Br Amb26399072 [0,1,0,1,0,0|2,0,0]=4 1647 B11R1.26 C\C=C1\CCCCCCC1=O Amb25967372 [0,1,0,1,0,0|0,0,2]=4 1648 B11R1.26 N#CC1CCC=CCCC1O Amb32655300 [0,1,0,1,0,0|1,0,1]=4 1649 B11R1.30 CCOC(=O)CC1C=CCC1 Amb25379923 [0,1,0,1,0,0|2,0,0]=4 1650 B11R1.30 C\C(=C/C=O)CC1C=CCC1 Amb27411881 [0,1,0,1,0,0|0,0,2]=4 1651 B11R1.30 C\C=C\C(=O)CC1C=CCC1 Amb26497532 [0,1,0,1,0,0|1,0,1]=4 1652 B11R1.66 O=C1CCCCC(=O)C1=C[O-] Amb27650177 [0,1,0,1,0,0|1,0,1]=4 1653 B11R1.81 C=CC[C@@H]1CCC(C)=CC1O Amb27213853 [0,1,0,1,0,0|2,0,0]=4 1654 B11R1.81 C=C\C=C1\CCC(C)CC1=O Amb28052244 [0,1,0,1,0,0|0,0,2]=4 1655 B11R1.81 CCCN1CCC(N)CC1=O Amb27812176 [0,1,0,1,0,0|1,0,1]=4 1656 B11R1.81 CC\C=C1\CCC(C)CC1=O Amb28052203 [0,1,0,1,0,0|0,0,0]=2 1657 B11R1.81 CC\C=C1\CC[C@@H](C)CC1=O Amb28386604 [0,1,0,1,0,0|0,0,0]=2 1658 B11R1.101 CC1CCC=CCCCNC1 Amb27411878 [0,1,0,1,0,0|1,0,1]=4 1659 B11R1.101 ClC1C=CCCCCCCC1 Amb28285392 [0,1,0,1,0,0|1,0,1]=4 1660 B11R1.101 O=C1CC=CCCC=CCC1 Amb28288884 [0,1,0,1,0,0|0,0,1]=3 1661 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [0,1,0,1,0,0|0,0,2]=4 1662 B11R1.101 O=C1CCC=CCCCCC1 Amb4034899 [0,1,0,1,0,0|0,0,0]=2 1663 B11R1.101 O=C1CCCC=C=CCCC1 Amb27854575 [0,1,0,1,0,0|0,0,2]=4 1664 B11R1.101 O=C1CCCCCCCCC1 Amb2778532 [0,1,0,1,0,0|0,0,2]=4 1665 B11R1.101 O=C1CCCCCCCCN1 Amb4034840 [0,1,0,1,0,0|0,0,2]=4 1666 B11R1.101 O=C1CCNCCCCCN1 Amb32679586 [0,1,0,1,0,0|1,0,1]=4 1667 B11R1.101 OC1C=CCCCC=CCC1 Amb27218493 [0,1,0,1,0,0|0,0,2]=4 1668 B11R1.101 O[C@H]1C=CCCCCCCC1 Amb28206118 [0,1,0,1,0,0|1,0,1]=4 1669 B11R1.101 O[C@H]1CCCC=CCCCC1 Amb28079246 [0,1,0,1,0,0|0,0,2]=4 1670 B11R1.107 CC1=CCCCCCC(=O)C1 Amb28381149 [0,1,0,1,0,0|0,0,2]=4 1671 B11R1.107 CC1CCC=CCCC(=O)N1 Amb26922309 [0,1,0,1,0,0|1,0,0]=3 1672 B11R1.107 CC1CCCCCCC(=O)C1 Amb28200023 [0,1,0,1,0,0|0,0,2]=4 1673 B11R1.107 O=C1C=CCCCCC(=O)C1 Amb28144181 [0,1,0,1,0,0|0,0,1]=3 1674 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [0,1,0,1,0,0|0,0,2]=4 1675 B11R1.110 CCOC1=CC(=O)NCCC1 Amb8496564 [0,1,0,1,0,0|2,0,0]=4 1676 B11R1.110 CN\N=C1/CCCCC(=O)C1 Amb27226971 [0,1,0,1,0,0|2,0,0]=4 1677 B11R1.110 CN\N=C1\CCCCC(=O)C1 Amb27974027 [0,1,0,1,0,0|2,0,0]=4 1678 B11R1.117 CNCC1=CCCCCCC1 Amb28045096 [0,1,0,1,0,0|1,0,1]=4 1679 B11R1.117 OCCC1=CCCCCCC1 Amb24439590 [0,1,0,1,0,0|1,0,1]=4 1680 B11R1.117 [N-]=[N+]=NC1CCC=CCCC1 Amb27839728 [0,1,0,1,0,0|2,0,0]=4 1681 B11R1.123 CC1=C(C=O)[C@H](CC=O)CC1 Amb27257869 [0,1,0,1,0,0|1,0,1]=4 1682 B11R1.123 CCC1C(=O)OCC1CC=O Amb26041348 [0,1,0,1,0,0|1,0,1]=4 1683 B11R1.123 CC[C@@H]1C(=O)OC[C@@H]1CC=O Amb8395847 [0,1,0,1,0,0|1,0,1]=4 1684 B11R1.123 CC[C@H]1C(=O)OC[C@H]1CC=O Amb28201030 [0,1,0,1,0,0|1,0,1]=4 1685 B11R1.135 CN1CCCC(CC=O)CC1 Amb27962399 [0,1,0,1,0,0|1,0,1]=4 1686 B11R1.135 O=CNC1CCNC(=O)CC1 Amb27813631 [0,1,0,1,0,0|2,0,0]=4 1687 B11R1.145 O=C1CCCOC(=O)CCC1 Amb28074815 [0,1,0,1,0,0|1,0,1]=4 1688 B11R1.180 C=CCCCC1C=CCC1O Amb27673934 [0,1,0,1,0,0|1,0,0]=3 1689 B11R1.180 C=CCCCC1CCCC1=O Amb27271584 [0,1,0,1,0,0|1,0,1]=4 1690 B11R1.180 C=CCCC[C@@H]1CCCC1=O Amb28080270 [0,1,0,1,0,0|1,0,1]=4 1691 B11R1.180 CC1OCCC1CCCC=O Amb33426812 [0,1,0,1,0,0|0,0,2]=4 1692 B11R1.180 CCC#CCC1CCCC1=O Amb27791342 [0,1,0,1,0,0|0,0,2]=4 1693 B11R1.180 CCC#C\C=C1/CCCC1=O Amb28126587 [0,1,0,1,0,0|0,0,2]=4 1694 B11R1.180 CCC#C\C=C1\CCCC1=O Amb27409596 [0,1,0,1,0,0|0,0,2]=4 1695 B11R1.180 CCCCCC1CCCC1=O Amb534714 [0,1,0,1,0,0|0,0,2]=4 1696 B11R1.180 CCCCCC1COCC1=O Amb27672690 [0,1,0,1,0,0|0,0,2]=4 1697 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [0,1,0,1,0,0|0,0,2]=4 1698 B11R1.180 CCCC\C=C1\CCCC1=O Amb533060 [0,1,0,1,0,0|0,0,2]=4 1699 B11R1.180 CCCOCC1CCCC1=O Amb27987801 [0,1,0,1,0,0|0,0,2]=4 1700 B11R1.180 CCNCCC1CCNC1=O Amb27674171 [0,1,0,1,0,0|1,0,1]=4 1701 B11R1.180 CCSCCC1CCCC1=O Amb27269774 [0,1,0,1,0,0|0,0,2]=4 1702 B11R1.180 CCSCCC1CSCC1=O Amb27271770 [0,1,0,1,0,0|1,0,1]=4 1703 B11R1.180 CC\C=C/CC1=CCCC1=O Amb25767724 [0,1,0,1,0,0|0,0,1]=3 1704 B11R1.180 CC\C=C/CC1C=CCC1=O Amb27954194 [0,1,0,1,0,0|0,0,1]=3 1705 B11R1.180 CC\C=C/CC1CCCC1=O Amb27272751 [0,1,0,1,0,0|0,0,0]=2 1706 B11R1.180 CC\C=C/CC1CCCC1O Amb25123974 [0,1,0,1,0,0|0,0,2]=4 1707 B11R1.180 CC\C=C\CC1=C(C)CCC1 Amb24518599 [0,1,0,1,0,0|1,0,0]=3 1708 B11R1.180 CC\C=C\CC1CC=CC1=O Amb26528317 [0,1,0,1,0,0|0,0,1]=3 1709 B11R1.180 CC\C=C\CC1CCCC1=O Amb26923884 [0,1,0,1,0,0|0,0,0]=2 1710 B11R1.180 CC\C=C\CC1CCCC1O Amb27637395 [0,1,0,1,0,0|0,0,2]=4 1711 B11R1.180 CN1CCCC1CCCC=O Amb33320340 [0,1,0,1,0,0|0,0,2]=4 1712 B11R1.180 CSCCSC1CCCC1=O Amb28079899 [0,1,0,1,0,0|1,0,1]=4 1713 B11R1.180 C\C=C\COC1CCCC1=O Amb28194475 [0,1,0,1,0,0|0,0,2]=4 1714 B11R1.180 Cc1ccoc1CCCC=O Amb33343118 [0,1,0,1,0,0|0,0,2]=4 1715 B11R1.180 Cc1ccsc1CCCC=O Amb18126559 [0,1,0,1,0,0|0,0,2]=4 1716 B11R1.180 Cc1cscc1CCCC=O Amb33146516 [0,1,0,1,0,0|0,0,2]=4 1717 B11R1.180 Cc1occc1CCCC=O Amb33274348 [0,1,0,1,0,0|0,0,2]=4 1718 B11R1.180 Cn1cccc1CCCC=O Amb33203973 [0,1,0,1,0,0|0,0,2]=4 1719 B11R1.180 Cn1ccnc1CCCC=O Amb28386928 [0,1,0,1,0,0|1,0,1]=4 1720 B11R1.180 Cn1cncc1CCCC=O Amb26083437 [0,1,0,1,0,0|1,0,1]=4 1721 B11R1.180 Cn1nccc1CCCC=O Amb24761835 [0,1,0,1,0,0|1,0,1]=4 1722 B11R1.180 NC\C=C\CN1CCNC1=O Amb27619110 [0,1,0,1,0,0|2,0,0]=4 1723 B11R1.180 O=C1CCCC1CCCCBr Amb27672177 [0,1,0,1,0,0|0,0,2]=4 1724 B11R1.180 O=C1CCCC1CCCCF Amb27267015 [0,1,0,1,0,0|0,0,2]=4 1725 B11R1.180 O=C1CCCC1CCCCO Amb27986534 [0,1,0,1,0,0|0,0,2]=4 1726 B11R1.180 O=C1CCCC1SCCCO Amb27271109 [0,1,0,1,0,0|1,0,1]=4 1727 B11R1.180 O=C1CCCN1C\C=C\CCl Amb27617415 [0,1,0,1,0,0|1,0,0]=3 1728 B11R1.180 O=C1NCCN1C\C=C\CCl Amb35678468 [0,1,0,1,0,0|2,0,0]=4 1729 B11R1.180 O=C1NCCN1C\C=C\CS Amb35603487 [0,1,0,1,0,0|2,0,0]=4 1730 B11R1.180 O=C1OCCN1C\C=C\CCl Amb27668733 [0,1,0,1,0,0|2,0,0]=4 1731 B11R1.180 O=C1OCCN1C\C=C\CS Amb27766994 [0,1,0,1,0,0|2,0,0]=4 1732 B11R1.180 O=CCCCC1CCOC1=O Amb27673678 [0,1,0,1,0,0|1,0,0]=3 1733 B11R1.180 O[C@H]1CCC[C@H]1\C=C\CCCl Amb27444656 [0,1,0,1,0,0|0,0,2]=4 1734 B11R1.189 CCOC1CCCC(C=O)O1 Amb27624566 [0,1,0,1,0,0|1,0,1]=4 1735 B11R1.199 CCCC(=O)C1CCCC1=O Amb17940809 [0,1,0,1,0,0|0,0,1]=3 1736 B11R1.199 CCOC(=O)C1CCCC1=O Amb9752735 [0,1,0,1,0,0|1,0,0]=3 1737 B11R1.199 CCOC(=O)C1CCCC1=S Amb27945738 [0,1,0,1,0,0|1,1,0]=4 1738 B11R1.199 CCOC(=O)C1CCNC1=O Amb8631143 [0,1,0,1,0,0|2,0,0]=4 1739 B11R1.199 CCOC(=O)C1CCOC1=O Amb22490517 [0,1,0,1,0,0|2,0,0]=4 1740 B11R1.199 CCOC(=O)C1CNCC1=O Amb21857705 [0,1,0,1,0,0|2,0,0]=4 1741 B11R1.199 CCOC(=O)C1COCC1=O Amb21963949 [0,1,0,1,0,0|2,0,0]=4 1742 B11R1.199 CCOC(=O)C1CSCC1=O Amb20075892 [0,1,0,1,0,0|2,0,0]=4 1743 B11R1.199 CCOC(=O)C1SCCC1=O Amb22289193 [0,1,0,1,0,0|2,0,0]=4 1744 B11R1.199 CCOC(=O)[C@@H]1CCCC1=O Amb27260446 [0,1,0,1,0,0|1,0,0]=3 1745 B11R1.199 CCOC(=S)C1CCCC1=O Amb27260487 [0,1,0,1,0,0|1,0,0]=3 1746 B11R1.199 COCC(=O)C1CCCC1=O Amb25150163 [0,1,0,1,0,0|1,0,1]=4 1747 B11R1.199 C\C=C\C(=O)[C@H]1CCOC1=O Amb27164649 [0,1,0,1,0,0|1,0,1]=4 1748 B11R1.199 C\C=C\[C@H](C)[C@H]1CCCC1=O Amb28351531 [0,1,0,1,0,0|0,0,2]=4 1749 B11R1.200 C=CC1CCC1C(=O)OCC Amb26081652 [0,1,0,1,0,0|2,0,0]=4 1750 B11R1.229 CC\C=C/C=C/[C@@H]1C[C@@H]1C=O Amb24766801 [0,1,0,1,0,0|0,0,1]=3 1751 B11R1.230 C=CCCC1CC(=O)C=C1C Amb27972916 [0,1,0,1,0,0|1,0,1]=4 1752 B11R1.230 CC1=CC(=O)OC1CCC=O Amb27799786 [0,1,0,1,0,0|1,0,1]=4 1753 B11R1.230 CC\C=C\C1CC(=O)OC1=O Amb33269426 [0,1,0,1,0,0|1,0,1]=4 1754 B11R1.356 CC(CCCCC=O)C1CC1 Amb32729549 [0,1,0,1,0,0|0,0,2]=4 1755 B11R1.560 C[C@H]1CCCC[C@@H](C)C(=O)C1 Amb28411238 [0,1,0,1,0,0|0,0,2]=4 1756 B11R1.774 CCSC1(C)CCCCC1=O Amb27972943 [0,1,0,1,0,0|1,0,1]=4 1757 B11R1.27 C=CCCCC1=CC(=O)CC1 Amb27987936 [0,1,0,1,0,0|1,0,1]=4 1758 B11R1.27 C=CCCNC1C=CC(O)C1 Amb27673307 [0,1,0,1,0,0|2,0,0]=4 1759 B11R1.27 C=CCOCC1C=CC(Cl)C1 Amb17940003 [0,1,0,1,0,0|2,0,0]=4 1760 B11R1.27 C=C\C=C\CC1CCC(=O)N1 Amb27202628 [0,1,0,1,0,0|0,0,2]=4 1761 B11R1.27 CCCCCC1CCC(=O)O1 Amb569744 [0,1,0,1,0,0|0,0,2]=4 1762 B11R1.27 CCCCC[C@@H]1CCC(=O)C1 Amb27673726 [0,1,0,1,0,0|0,0,2]=4 1763 B11R1.27 CCCCC[C@H]1CCC(=O)C1 Amb28080151 [0,1,0,1,0,0|0,0,2]=4 1764 B11R1.27 CCCCC[C@H]1CCC(=O)N1 Amb28080184 [0,1,0,1,0,0|0,0,2]=4 1765 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [0,1,0,1,0,0|0,0,2]=4 1766 B11R1.27 CCCNCC1CCC(=O)N1 Amb25382477 [0,1,0,1,0,0|1,0,1]=4 1767 B11R1.27 CCCOCC1CCC(=O)C1 Amb27987809 [0,1,0,1,0,0|1,0,1]=4 1768 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 Amb27673440 [0,1,0,1,0,0|1,0,1]=4 1769 B11R1.27 C[C@@H]1CCC(CCCC=O)O1 Amb32730446 [0,1,0,1,0,0|0,0,2]=4 1770 B11R1.27 C\C=C\CCC1CCC(=O)N1 Amb26622093 [0,1,0,1,0,0|0,0,2]=4 1771 B11R1.27 Cc1ccc(CCCC=O)o1 Amb24766702 [0,1,0,1,0,0|0,0,2]=4 1772 B11R1.27 Cc1ccc(CCCC=O)s1 Amb33375429 [0,1,0,1,0,0|0,0,2]=4 1773 B11R1.27 Cn1ccc(CCCC=O)c1 Amb18224282 [0,1,0,1,0,0|1,0,1]=4 1774 B11R1.27 Cn1ccc(CCCC=O)n1 Amb24750701 [0,1,0,1,0,0|1,0,1]=4 1775 B11R1.27 O=CCCCC1=CC(=O)CC1 Amb18644515 [0,1,0,1,0,0|0,0,1]=3 1776 B11R1.27 O=CCCC[C@@H]1CCC(=O)N1 Amb28080117 [0,1,0,1,0,0|1,0,0]=3 1777 B11R1.27 O=CCCOC1=CC(=O)CC1 Amb27673694 [0,1,0,1,0,0|1,0,1]=4 1778 B11R1.53 CC(=O)C1CCCC=C1C#N Amb26501772 [0,1,0,1,0,0|1,0,1]=4 1779 B11R1.53 CC(C)C1CCCCC1C=O Amb27452838 [0,1,0,1,0,0|0,0,2]=4 1780 B11R1.53 CCC1=C(C(=O)Cl)CCCC1 Amb28324256 [0,1,0,1,0,0|0,0,2]=4 1781 B11R1.53 CCC1=C(C(=O)O)CCCO1 Amb24528967 [0,1,0,1,0,0|1,0,1]=4 1782 B11R1.53 CCC1C=CCCC1C(=O)O Amb28384133 [0,1,0,1,0,0|0,0,2]=4 1783 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,1,0,1,0,0|0,0,2]=4 1784 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [0,1,0,1,0,0|0,0,2]=4 1785 B11R1.53 CCC1NCCCC1C(=O)O Amb27858957 [0,1,0,1,0,0|1,0,1]=4 1786 B11R1.53 CCC1OCCCC1C(=O)O Amb26441727 [0,1,0,1,0,0|1,0,1]=4 1787 B11R1.53 CCC1OCCCC1C(N)=O Amb27752806 [0,1,0,1,0,0|1,0,1]=4 1788 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [0,1,0,1,0,0|1,0,1]=4 1789 B11R1.53 CCN1CCCCC1C(=O)O Amb9299667 [0,1,0,1,0,0|1,0,1]=4 1790 B11R1.53 CCN1CCCC[C@@H]1C(=O)O Amb27400269 [0,1,0,1,0,0|1,0,1]=4 1791 B11R1.53 CCN1CCCC[C@H]1C(=O)O Amb28244690 [0,1,0,1,0,0|1,0,1]=4 1792 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [0,1,0,1,0,0|0,0,2]=4 1793 B11R1.53 CC[C@@H]1NCCC[C@H]1C(=O)O Amb18199984 [0,1,0,1,0,0|1,0,1]=4 1794 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(=O)O Amb27858544 [0,1,0,1,0,0|1,0,1]=4 1795 B11R1.57 CC(=O)CC1CCC=C1C=O Amb27983559 [0,1,0,1,0,0|1,0,1]=4 1796 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [0,1,0,1,0,0|1,0,1]=4 1797 B11R1.57 CCN1CCCC1CC(=O)O Amb33550833 [0,1,0,1,0,0|1,0,1]=4 1798 B11R1.57 CC[C@@H]1NCC[C@H]1CC(=O)O Amb18199980 [0,1,0,1,0,0|1,0,1]=4 1799 B11R1.57 CC[C@H]1NCC[C@@H]1CC(=O)O Amb28429151 [0,1,0,1,0,0|1,0,1]=4 1800 B11R1.86 CC(=O)CC1CCC=CC1=O Amb27256554 [0,1,0,1,0,0|1,0,1]=4 1801 B11R1.86 CC(=O)NC1CCC=CC1O Amb27879613 [0,1,0,1,0,0|2,0,0]=4 1802 B11R1.86 CC(=O)N[C@@H]1CCC=C[C@@H]1O Amb27790639 [0,1,0,1,0,0|2,0,0]=4 1803 B11R1.86 CC(=O)OC1CCC=CC1O Amb25150513 [0,1,0,1,0,0|2,0,0]=4 1804 B11R1.86 CC(=O)O[C@@H]1CCC=C[C@@H]1O Amb27207723 [0,1,0,1,0,0|2,0,0]=4 1805 B11R1.86 CC(=O)O[C@H]1CCC=C[C@@H]1Cl Amb27648375 [0,1,0,1,0,0|2,0,0]=4 1806 B11R1.86 CC(C)CC1=CCCCC1=O Amb27972941 [0,1,0,1,0,0|0,0,2]=4 1807 B11R1.86 CC(C)CC1CCCCC1=O Amb18177374 [0,1,0,1,0,0|0,0,2]=4 1808 B11R1.86 CC(C)CN1CCCCC1=O Amb22394918 [0,1,0,1,0,0|1,0,1]=4 1809 B11R1.86 CC(C)NC1=CCCCC1=O Amb27642405 [0,1,0,1,0,0|1,0,1]=4 1810 B11R1.86 CC(C)NN1CCCCC1=O Amb27835640 [0,1,0,1,0,0|2,0,0]=4 1811 B11R1.86 CC(C)\C=C1/CCC=CC1=O Amb27867025 [0,1,0,1,0,0|0,0,2]=4 1812 B11R1.86 CC(C)\C=C1/CCCCC1=O Amb22823238 [0,1,0,1,0,0|0,0,0]=2 1813 B11R1.86 CC(C)\C=C1/CSCCC1=O Amb27229582 [0,1,0,1,0,0|1,0,0]=3 1814 B11R1.86 CC(C)\C=C1\CCC=CC1=O Amb28201168 [0,1,0,1,0,0|0,0,2]=4 1815 B11R1.86 CC(C)\C=C1\CCCCC1=O Amb534175 [0,1,0,1,0,0|0,0,0]=2 1816 B11R1.86 CC(C)\C=C1\CCCCC1Cl Amb28343075 [0,1,0,1,0,0|1,0,1]=4 1817 B11R1.86 CC(O)CC1CCC=CC1C Amb27207730 [0,1,0,1,0,0|0,0,2]=4 1818 B11R1.86 CC(O)CN1CCCCC1=O Amb18791807 [0,1,0,1,0,0|1,0,1]=4 1819 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [0,1,0,1,0,0|0,0,2]=4 1820 B11R1.86 CC1CCCCC1CC(N)=O Amb27232827 [0,1,0,1,0,0|0,0,2]=4 1821 B11R1.86 CC1CNCCC1CC(=O)O Amb8387925 [0,1,0,1,0,0|1,0,1]=4 1822 B11R1.86 CC1NCCCC1CC(=O)O Amb32662853 [0,1,0,1,0,0|1,0,1]=4 1823 B11R1.86 CC1NCCCC1CC(=O)O Amb8387928 [0,1,0,1,0,0|1,0,1]=4 1824 B11R1.86 CC1NCCCC1CC(N)=O Amb27186162 [0,1,0,1,0,0|1,0,1]=4 1825 B11R1.86 CC1SCCCC1CC(=O)O Amb27235116 [0,1,0,1,0,0|1,0,1]=4 1826 B11R1.86 CN(C)\C=C1/CCCCC1=O Amb22505737 [0,1,0,1,0,0|1,0,0]=3 1827 B11R1.86 CN(C)\C=C1/COCCC1=O Amb22723425 [0,1,0,1,0,0|2,0,0]=4 1828 B11R1.86 CN(C)\C=C1\CCCCC1=O Amb7092354 [0,1,0,1,0,0|1,0,0]=3 1829 B11R1.86 CN(C)\C=C1\COCCC1=O Amb26477790 [0,1,0,1,0,0|2,0,0]=4 1830 B11R1.86 CN(C)\C=C1\CSCCC1=O Amb29848187 [0,1,0,1,0,0|2,0,0]=4 1831 B11R1.86 CN(C)\N=C1\CCCCC1=O Amb27861186 [0,1,0,1,0,0|2,0,0]=4 1832 B11R1.90 CC(=O)CCC1CCOC1C Amb33426815 [0,1,0,1,0,0|1,0,1]=4 1833 B11R1.90 CC(C)=CCC1CCCC1=O Amb18787452 [0,1,0,1,0,0|0,0,2]=4 1834 B11R1.90 CC(C)=C\C=C1/CCCC1=O Amb28132191 [0,1,0,1,0,0|0,0,2]=4 1835 B11R1.90 CC(C)CCC1CCCC1=O Amb18177373 [0,1,0,1,0,0|0,0,2]=4 1836 B11R1.90 CC(C)C\C=C1\CCCC1=O Amb26396178 [0,1,0,1,0,0|0,0,2]=4 1837 B11R1.90 CC(C)O\C=C1\CCCC1=O Amb26546053 [0,1,0,1,0,0|1,0,1]=4 1838 B11R1.90 CC(O)CCC1CCCC1=O Amb28410791 [0,1,0,1,0,0|0,0,2]=4 1839 B11R1.90 CC(O)\C=C\N1CCOC1=O Amb28292120 [0,1,0,1,0,0|2,0,0]=4 1840 B11R1.90 CC1OCCC1CCC(=O)O Amb33427953 [0,1,0,1,0,0|1,0,1]=4 1841 B11R1.90 CN(C)\N=C\C1CCCC1=O Amb27261101 [0,1,0,1,0,0|2,0,0]=4 1842 B11R1.90 C[C@H]1CCC[C@@H]1CCC(=O)O Amb28455731 [0,1,0,1,0,0|0,0,2]=4 1843 B11R1.90 C\C(Cl)=C/CC1CCCC1=O Amb27440096 [0,1,0,1,0,0|0,0,2]=4 1844 B11R1.91 C=C(C)CNC1CC=CCC1 Amb27267763 [0,1,0,1,0,0|2,0,0]=4 1845 B11R1.91 CC(=O)CCC1CC=CCC1 Amb24456632 [0,1,0,1,0,0|0,0,0]=2 1846 B11R1.91 CC(=O)CCC1CCCCC1 Amb9031564 [0,1,0,1,0,0|0,0,2]=4 1847 B11R1.91 CC(=O)CCC1CCCNC1 Amb25041564 [0,1,0,1,0,0|1,0,1]=4 1848 B11R1.91 CC(=O)CCC1CCCOC1 Amb26058874 [0,1,0,1,0,0|1,0,1]=4 1849 B11R1.91 CC(=O)CCC1CCCSC1 Amb32726147 [0,1,0,1,0,0|1,0,1]=4 1850 B11R1.91 CC(=O)CCC1CCNCC1 Amb24377330 [0,1,0,1,0,0|1,0,1]=4 1851 B11R1.91 CC(=O)CCC1CCOCC1 Amb18182100 [0,1,0,1,0,0|1,0,1]=4 1852 B11R1.91 CC(=O)CCN1CC=CCC1 Amb27840280 [0,1,0,1,0,0|1,0,0]=3 1853 B11R1.91 CC(=O)NC[C@@H]1CCC=CO1 Amb28074130 [0,1,0,1,0,0|2,0,0]=4 1854 B11R1.91 CC(=O)\C=C\C1C=CCCC1 Amb25735805 [0,1,0,1,0,0|1,0,1]=4 1855 B11R1.91 CC(=O)\C=C\C1CC=CCC1 Amb26936607 [0,1,0,1,0,0|0,0,2]=4 1856 B11R1.91 CC(Br)\C=C\C1CCCCO1 Amb35637924 [0,1,0,1,0,0|0,0,2]=4 1857 B11R1.91 CC(Br)\C=C\C1CCCOC1 Amb27657068 [0,1,0,1,0,0|2,0,0]=4 1858 B11R1.91 CC(Cl)\C=C\C1CCCCO1 Amb35637923 [0,1,0,1,0,0|0,0,2]=4 1859 B11R1.91 CC(Cl)\C=C\C1CCCSC1 Amb27262135 [0,1,0,1,0,0|2,0,0]=4 1860 B11R1.91 CC(N)CCC1CC=CCC1 Amb33203482 [0,1,0,1,0,0|1,0,1]=4 1861 B11R1.91 CC(N)\C=C\C1CC=CCC1 Amb33374052 [0,1,0,1,0,0|1,0,1]=4 1862 B11R1.91 CC(N)\C=C\C1CCCCC1 Amb28368066 [0,1,0,1,0,0|1,0,1]=4 1863 B11R1.91 CC(N)\C=C\C1CCCCO1 Amb35622319 [0,1,0,1,0,0|0,0,2]=4 1864 B11R1.91 CC(N)\C=C\C1CCCOC1 Amb33080423 [0,1,0,1,0,0|2,0,0]=4 1865 B11R1.91 CC(N)\C=C\C1CCCSC1 Amb33358387 [0,1,0,1,0,0|2,0,0]=4 1866 B11R1.91 CC(O)CCC1CC=CCC1 Amb33227119 [0,1,0,1,0,0|0,0,2]=4 1867 B11R1.91 CC(O)\C=C\C1CCCCC1 Amb26897095 [0,1,0,1,0,0|1,0,1]=4 1868 B11R1.91 C[C@@H](N)CCC1CC=CCC1 Amb33203481 [0,1,0,1,0,0|1,0,1]=4 1869 B11R1.91 C[C@@H](O)CCC1CC=CCC1 Amb33314471 [0,1,0,1,0,0|0,0,2]=4 1870 B11R1.91 C[C@H](N)CCC1CC=CCC1 Amb33203480 [0,1,0,1,0,0|1,0,1]=4 1871 B11R1.91 C[C@H](O)CCC1CC=CCC1 Amb33314472 [0,1,0,1,0,0|0,0,2]=4 1872 B11R1.91 C\C(N)=N\CC1CC=CCC1 Amb27946614 [0,1,0,1,0,0|2,0,0]=4 1873 B11R1.91 NC(=O)CCC1CCCCC1 Amb6430126 [0,1,0,1,0,0|0,0,2]=4 1874 B11R1.91 NC(=O)CCC1CCCNC1 Amb10607788 [0,1,0,1,0,0|1,0,1]=4 1875 B11R1.91 NC(=O)CCC1CCCNC1 Amb13949150 [0,1,0,1,0,0|1,0,1]=4 1876 B11R1.91 NC(=O)CCC1CCCOC1 Amb28280723 [0,1,0,1,0,0|1,0,1]=4 1877 B11R1.91 NC(=O)CCC1CCNCC1 Amb8011291 [0,1,0,1,0,0|1,0,1]=4 1878 B11R1.91 NC(=O)CCC1CCNCC1 Amb8503428 [0,1,0,1,0,0|1,0,1]=4 1879 B11R1.91 NC(=O)CCC1CCOCC1 Amb28139505 [0,1,0,1,0,0|1,0,1]=4 1880 B11R1.91 NC(=O)CC[C@@H]1CCCNC1 Amb28043282 [0,1,0,1,0,0|1,0,1]=4 1881 B11R1.91 NC(=O)\C=C\C1CC=CCC1 Amb27627437 [0,1,0,1,0,0|0,0,2]=4 1882 B11R1.91 NC(=S)CCN1CC=CCC1 Amb18118549 [0,1,0,1,0,0|1,1,0]=4 1883 B11R1.91 O=C(Cl)CCC1CCCCC1 Amb2720380 [0,1,0,1,0,0|0,0,2]=4 1884 B11R1.91 O=C(O)C#CC1CC=CCC1 Amb27983766 [0,1,0,1,0,0|0,0,2]=4 1885 B11R1.91 O=C(O)CCC1CC=CCC1 Amb26491506 [0,1,0,1,0,0|0,0,0]=2 1886 B11R1.91 O=C(O)CCC1CCC=CO1 Amb27829016 [0,1,0,1,0,0|1,0,0]=3 1887 B11R1.91 O=C(O)CCC1CCCCC1 Amb3939828 [0,1,0,1,0,0|0,0,2]=4 1888 B11R1.91 O=C(O)CCC1CCCNC1 Amb10576190 [0,1,0,1,0,0|1,0,1]=4 1889 B11R1.91 O=C(O)CCC1CCCNC1 Amb1101056 [0,1,0,1,0,0|1,0,1]=4 1890 B11R1.91 O=C(O)CCC1CCCOC1 Amb33529911 [0,1,0,1,0,0|1,0,1]=4 1891 B11R1.91 O=C(O)CCC1CCCSC1 Amb18825218 [0,1,0,1,0,0|1,0,1]=4 1892 B11R1.91 O=C(O)CCC1CCC[NH2+]C1 Amb2694709 [0,1,0,1,0,0|1,0,1]=4 1893 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609864 [0,1,0,1,0,0|1,0,1]=4 1894 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609915 [0,1,0,1,0,0|1,0,1]=4 1895 B11R1.91 O=C(O)CCC1CCNCC1 Amb2696646 [0,1,0,1,0,0|1,0,1]=4 1896 B11R1.91 O=C(O)CCC1CCOCC1 Amb18990337 [0,1,0,1,0,0|1,0,1]=4 1897 B11R1.91 O=C(O)CCC1CCSCC1 Amb18197511 [0,1,0,1,0,0|1,0,1]=4 1898 B11R1.91 O=C(O)COC1CC=CCC1 Amb33318657 [0,1,0,1,0,0|1,0,0]=3 1899 B11R1.91 O=C(O)\C=C\C1CC=CCC1 Amb3992530 [0,1,0,1,0,0|0,0,2]=4 1900 B11R1.91 O=[N+]([O-])CCC1CC=CCC1 Amb33374108 [0,1,0,1,0,0|1,0,0]=3 1901 B11R1.99 O=CCCCCCCC1CC1 Amb33167104 [0,1,0,1,0,0|0,0,2]=4 1902 B11R1.143 CC(=O)C1=CCCCCC1=O Amb25244207 [0,1,0,1,0,0|0,0,1]=3 1903 B11R1.143 CC(=O)C1CCCCC=C1C Amb27261169 [0,1,0,1,0,0|0,0,2]=4 1904 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [0,1,0,1,0,0|0,0,2]=4 1905 B11R1.143 CC(C)C1=CC=CCCC1=O Amb27591512 [0,1,0,1,0,0|0,0,2]=4 1906 B11R1.143 CC(C)C1CCCCCC1=O Amb18181912 [0,1,0,1,0,0|0,0,2]=4 1907 B11R1.143 CC(O)C1=C(Cl)CCCCC1 Amb27662319 [0,1,0,1,0,0|1,0,1]=4 1908 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [0,1,0,1,0,0|1,0,1]=4 1909 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [0,1,0,1,0,0|1,0,1]=4 1910 B11R1.143 C[C@H](O)C1=CCCCCC1=O Amb27227235 [0,1,0,1,0,0|0,0,0]=2 1911 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [0,1,0,1,0,0|1,0,1]=4 1912 B11R1.161 CC1CCC1CCCC(=O)O Amb27266949 [0,1,0,1,0,0|0,0,2]=4 1913 B11R1.172 CC(=O)CCCC1CCCC1 Amb26076138 [0,1,0,1,0,0|0,0,2]=4 1914 B11R1.172 CC(=O)NCCC1C=CCC1 Amb27489522 [0,1,0,1,0,0|1,0,0]=3 1915 B11R1.172 CC(N)\C=C\CC1CCCC1 Amb33377994 [0,1,0,1,0,0|1,0,1]=4 1916 B11R1.172 NC(=O)CCCC1CCCO1 Amb27818759 [0,1,0,1,0,0|1,0,1]=4 1917 B11R1.172 O=C(O)CCCC1=CCCC1 Amb18125777 [0,1,0,1,0,0|0,0,2]=4 1918 B11R1.172 O=C(O)CCCC1CCCC1 Amb19149142 [0,1,0,1,0,0|0,0,2]=4 1919 B11R1.172 O=C(O)CCCC1CCCN1 Amb18199969 [0,1,0,1,0,0|1,0,1]=4 1920 B11R1.172 O=C(O)CCCC1CCCO1 Amb26990705 [0,1,0,1,0,0|1,0,1]=4 1921 B11R1.172 O=C(O)CCCC1CCCS1 Amb26659241 [0,1,0,1,0,0|1,0,1]=4 1922 B11R1.172 O=C(O)CCCC1CCOC1 Amb24755490 [0,1,0,1,0,0|1,0,1]=4 1923 B11R1.172 O=C(O)CCCC1CCSC1 Amb27989571 [0,1,0,1,0,0|1,0,1]=4 1924 B11R1.191 CC1(C)C=CCCC1CCO Amb28069556 [0,1,0,1,0,0|0,0,2]=4 1925 B11R1.193 CC(C)N1CCCC1CC=O Amb28140846 [0,1,0,1,0,0|1,0,1]=4 1926 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,1,0,1,0,0|0,0,2]=4 1927 B11R1.193 CCCN1CCCC1C(=O)O Amb9704298 [0,1,0,1,0,0|1,0,1]=4 1928 B11R1.193 CCCN1CCCC1C(N)=O Amb26327231 [0,1,0,1,0,0|1,0,1]=4 1929 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27591265 [0,1,0,1,0,0|1,0,1]=4 1930 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27839891 [0,1,0,1,0,0|1,0,1]=4 1931 B11R1.193 CCCN1CCC[C@H]1C(=O)O Amb25864864 [0,1,0,1,0,0|1,0,1]=4 1932 B11R1.193 CCCN1CCC[C@H]1C(N)=O Amb26480008 [0,1,0,1,0,0|1,0,1]=4 1933 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,1,0,1,0,0|0,0,2]=4 1934 B11R1.193 CCOC1=C(C(=O)O)CCC1 Amb24487805 [0,1,0,1,0,0|1,0,1]=4 1935 B11R1.193 N#C\C=C1/CCCC1C(=O)Cl Amb28058051 [0,1,0,1,0,0|1,0,1]=4 1936 B11R1.193 N#C\C=C1/CCCC1C(=O)O Amb27491623 [0,1,0,1,0,0|1,0,1]=4 1937 B11R1.193 N#C\C=C1\CCCC1C(=O)O Amb26880284 [0,1,0,1,0,0|1,0,1]=4 1938 B11R1.193 NC\C=C1\CCCC1C(=O)O Amb27263894 [0,1,0,1,0,0|1,0,0]=3 1939 B11R1.204 CCONC1CCC1C(=O)O Amb28386717 [0,1,0,1,0,0|2,0,0]=4 1940 B11R1.233 CC1(C)C=CC=C1CCC=O Amb28198583 [0,1,0,1,0,0|0,0,2]=4 1941 B11R1.233 CC1(C)SCCC1CCC=O Amb33441275 [0,1,0,1,0,0|1,0,1]=4 1942 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [0,1,0,1,0,0|0,0,2]=4 1943 B11R1.706 CC(=O)C1=CCC=CCCC1 Amb25713503 [0,1,0,1,0,0|0,0,2]=4 1944 B11R1.706 CC(=O)C1=CCCCCC=C1 Amb26569390 [0,1,0,1,0,0|1,0,1]=4 1945 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [0,1,0,1,0,0|0,0,2]=4 1946 B11R1.706 CC(C)C1=C=CCCCCC1 Amb24754335 [0,1,0,1,0,0|1,0,1]=4 1947 B11R1.706 CC(C)C1=CCCCCCC1 Amb27950122 [0,1,0,1,0,0|1,0,1]=4 1948 B11R1.706 CN(C)C1CCC=CCCC1 Amb22368002 [0,1,0,1,0,0|2,0,0]=4 1949 B11R1.706 NC(=O)C1CCC=CCNC1 Amb6893908 [0,1,0,1,0,0|1,0,0]=3 1950 B11R1.706 O=C(Cl)C1CCC=CCCC1 Amb24465111 [0,1,0,1,0,0|0,0,0]=2 1951 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [0,1,0,1,0,0|0,0,2]=4 1952 B11R1.706 O=C(O)C1CCC=CCCC1 Amb26853121 [0,1,0,1,0,0|0,0,0]=2 1953 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|0,0,2]=4 1954 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,1,0,1,0,0|1,0,1]=4 1955 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [0,1,0,1,0,0|0,0,2]=4 1956 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [0,1,0,1,0,0|1,0,1]=4 1957 B11R1.742 CC(=O)OC1CCC=CCC1 Amb22364710 [0,1,0,1,0,0|1,0,0]=3 1958 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [0,1,0,1,0,0|0,0,2]=4 1959 B11R1.742 NC(=O)CC1CCCNCC1 Amb24363656 [0,1,0,1,0,0|1,0,1]=4 1960 B11R1.742 NC(=O)CC1CCCNCC1 Amb26473933 [0,1,0,1,0,0|1,0,1]=4 1961 B11R1.742 NC(=O)CC1CCCNCC1 Amb32663654 [0,1,0,1,0,0|1,0,1]=4 1962 B11R1.742 O=C(O)CC1CCC=CCC1 Amb26054605 [0,1,0,1,0,0|0,0,0]=2 1963 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,1,0,1,0,0|0,0,2]=4 1964 B11R1.742 O=C(O)CC1CCCNCC1 Amb18199994 [0,1,0,1,0,0|1,0,1]=4 1965 B11R1.742 O=C(O)CC1CCCNCC1 Amb30584770 [0,1,0,1,0,0|1,0,1]=4 1966 B11R1.742 O=C(O)CC1CCCOCC1 Amb18199912 [0,1,0,1,0,0|1,0,1]=4 1967 B11R1.742 O=C(O)CC1CCCSCC1 Amb18197457 [0,1,0,1,0,0|1,0,1]=4 1968 B11R1.742 O=C(O)C[C@@H]1C=CC=CCC1 Amb27955842 [0,1,0,1,0,0|0,0,2]=4 1969 B11R1.753 CCC\C=C\C1CC1C(=O)O Amb33327169 [0,1,0,1,0,0|0,0,2]=4 1970 B11R1.753 CCC\C=C\[C@@H]1C[C@H]1C(=O)O Amb33327155 [0,1,0,1,0,0|0,0,2]=4 1971 B11R1.5 C=C\C=C1/CCCCCC1=O Amb28383036 [0,1,0,1,0,0|0,0,2]=4 1972 B11R1.5 CC1COCCCN1CC=O Amb28195623 [0,1,0,1,0,0|1,0,1]=4 1973 B11R1.5 CCCN1CCCNCC1=O Amb22549346 [0,1,0,1,0,0|1,0,1]=4 1974 B11R1.5 CCCN1CCNCCC1=O Amb22498695 [0,1,0,1,0,0|1,0,1]=4 1975 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [0,1,0,1,0,0|0,0,2]=4 1976 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [0,1,0,1,0,0|1,0,1]=4 1977 B11R1.5 NCCN1CCCCCC1=O Amb6252150 [0,1,0,1,0,0|1,0,1]=4 1978 B11R1.5 NCCN1CCCCCC1=O Amb7969849 [0,1,0,1,0,0|1,0,1]=4 1979 B11R1.5 O=C1CCCCCC1CCO Amb27395084 [0,1,0,1,0,0|0,0,2]=4 1980 B11R1.5 O=C1CCCCCN1CCO Amb9370344 [0,1,0,1,0,0|1,0,1]=4 1981 B11R1.17 C=CCOC1CC=CCC1O Amb27972350 [0,1,0,1,0,0|2,0,0]=4 1982 B11R1.17 C=CCO[C@@H]1CC=CC[C@H]1O Amb27662269 [0,1,0,1,0,0|2,0,0]=4 1983 B11R1.17 C=COCC1CC=CCC1C Amb27389666 [0,1,0,1,0,0|2,0,0]=4 1984 B11R1.17 C=C\C=C\C1CCCCC1=O Amb28142263 [0,1,0,1,0,0|0,0,2]=4 1985 B11R1.17 CC1=C(CCCN)CCCC1 Amb28140735 [0,1,0,1,0,0|1,0,1]=4 1986 B11R1.17 CC1=C(CCCO)CCCC1 Amb28194242 [0,1,0,1,0,0|1,0,1]=4 1987 B11R1.17 CC1CCCCC1OCC=O Amb18183071 [0,1,0,1,0,0|0,0,2]=4 1988 B11R1.17 CC1CNCCN1CCC=O Amb27419928 [0,1,0,1,0,0|1,0,1]=4 1989 B11R1.17 CC1CSCCN1CCC=O Amb27872905 [0,1,0,1,0,0|1,0,1]=4 1990 B11R1.17 CCC=C=C1CCCC[C@@H]1O Amb27761625 [0,1,0,1,0,0|0,0,2]=4 1991 B11R1.17 CCCCC1CCC=CC1O Amb27472611 [0,1,0,1,0,0|1,0,1]=4 1992 B11R1.17 CCCCC1CCCCC1=O Amb3940594 [0,1,0,1,0,0|0,0,2]=4 1993 B11R1.17 CCC\C=C1/CCCCC1=O Amb3372069 [0,1,0,1,0,0|0,0,0]=2 1994 B11R1.17 CCC\C=C1\CCCCC1C Amb24595530 [0,1,0,1,0,0|1,0,1]=4 1995 B11R1.17 CCC\C=C1\CCCC[C@@H]1O Amb27399799 [0,1,0,1,0,0|0,0,2]=4 1996 B11R1.17 CCN\C=C1\CCCCC1=O Amb17778149 [0,1,0,1,0,0|0,0,0]=2 1997 B11R1.17 CCOCC1CCCCC1=O Amb27399156 [0,1,0,1,0,0|0,0,2]=4 1998 B11R1.17 CCO\C=C1/CCCCC1=O Amb33291262 [0,1,0,1,0,0|0,0,0]=2 1999 B11R1.17 CCO\C=C1/COCCC1=O Amb33291264 [0,1,0,1,0,0|1,0,0]=3 2000 B11R1.17 CC\C=C\C1CNCCN1C Amb33268686 [0,1,0,1,0,0|2,0,0]=4 2001 B11R1.17 CN1CCCCC1CCC=O Amb33322456 [0,1,0,1,0,0|0,0,2]=4 2002 B11R1.17 CNCCN1CCCCC1=O Amb10607655 [0,1,0,1,0,0|1,0,1]=4 2003 B11R1.17 CNCCN1CCCCC1=O Amb8503381 [0,1,0,1,0,0|1,0,1]=4 2004 B11R1.17 COCC[C@H]1CCCCC1=O Amb27974073 [0,1,0,1,0,0|0,0,2]=4 2005 B11R1.17 COCOC1CCCCC1=O Amb27750289 [0,1,0,1,0,0|1,0,1]=4 2006 B11R1.17 COC\C=C1\CCCCC1O Amb27978569 [0,1,0,1,0,0|0,0,2]=4 2007 B11R1.17 C\C=C\C=C1\CCCCC1=O Amb27828972 [0,1,0,1,0,0|0,0,1]=3 2008 B11R1.17 C\C=C\CC1CCCNC1=O Amb26658441 [0,1,0,1,0,0|0,0,2]=4 2009 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [0,1,0,1,0,0|0,0,2]=4 2010 B11R1.17 NCCCN1CCCCC1=O Amb6751261 [0,1,0,1,0,0|1,0,1]=4 2011 B11R1.17 NC\C=C/C1=C(Cl)CCCC1 Amb28198918 [0,1,0,1,0,0|1,0,1]=4 2012 B11R1.17 O=C1CCCCC1CCCO Amb27481191 [0,1,0,1,0,0|0,0,2]=4 2013 B11R1.17 O=C1CCCCN1CCCCl Amb6751295 [0,1,0,1,0,0|1,0,1]=4 2014 B11R1.17 O=C1CCCCN1CCCO Amb9370460 [0,1,0,1,0,0|1,0,1]=4 2015 B11R1.17 O=CCCC1CCCCC1O Amb27166081 [0,1,0,1,0,0|0,0,2]=4 2016 B11R1.17 O=C\C=C\N1CCCCC1=O Amb25152722 [0,1,0,1,0,0|1,0,1]=4 2017 B11R1.18 C=CC1CCCC1\C=C\CO Amb27650246 [0,1,0,1,0,0|2,0,0]=4 2018 B11R1.18 C=C\C=C/[C@@H]1CCC[C@@H]1C=O Amb27449251 [0,1,0,1,0,0|0,0,2]=4 2019 B11R1.18 CCCC[C@H]1OCC[C@@H]1C=O Amb24765269 [0,1,0,1,0,0|0,0,2]=4 2020 B11R1.18 CCCC[C@H]1OCC[C@H]1C=O Amb24765268 [0,1,0,1,0,0|0,0,2]=4 2021 B11R1.18 CC\C=C/[C@@H]1CCO[C@@H]1C=O Amb27234655 [0,1,0,1,0,0|0,0,0]=2 2022 B11R1.18 CC\C=C/[C@H]1C=CC[C@H]1C=O Amb27449265 [0,1,0,1,0,0|0,0,1]=3 2023 B11R1.18 CC\C=C/[C@H]1CCC[C@H]1C=O Amb28122412 [0,1,0,1,0,0|0,0,0]=2 2024 B11R1.18 CC\C=C\C1CCOC1C=O Amb28318221 [0,1,0,1,0,0|0,0,0]=2 2025 B11R1.18 CC\C=C\C1CCOC1CO Amb28365797 [0,1,0,1,0,0|0,0,2]=4 2026 B11R1.18 CC\C=C\[C@@H]1CCC[C@H]1CO Amb27213810 [0,1,0,1,0,0|0,0,2]=4 2027 B11R1.18 CC\C=C\[C@@H]1CCO[C@@H]1CO Amb27651825 [0,1,0,1,0,0|0,0,2]=4 2028 B11R1.18 CC\C=C\[C@H]1CCC[C@H]1CO Amb27451943 [0,1,0,1,0,0|0,0,2]=4 2029 B11R1.18 CCc1ccsc1CCC=O Amb32729037 [0,1,0,1,0,0|0,0,2]=4 2030 B11R1.18 COC1CCCC1CCC=O Amb28079946 [0,1,0,1,0,0|0,0,2]=4 2031 B11R1.18 COCCN1CCCC1C=O Amb23586304 [0,1,0,1,0,0|1,0,1]=4 2032 B11R1.28 BrCC\C=C\C1CCCCC1 Amb17571522 [0,1,0,1,0,0|1,0,1]=4 2033 B11R1.28 C=CCCCN1CC=CCC1 Amb27270325 [0,1,0,1,0,0|1,0,0]=3 2034 B11R1.28 CCCCCN1CC=CCC1 Amb28352146 [0,1,0,1,0,0|1,0,1]=4 2035 B11R1.28 CCCNCC1CC=CCC1 Amb6719089 [0,1,0,1,0,0|1,0,1]=4 2036 B11R1.28 CCC\C=C\C1CCCCC1 Amb27491636 [0,1,0,1,0,0|1,0,1]=4 2037 B11R1.28 CCC\C=C\C1CCCCN1 Amb33419573 [0,1,0,1,0,0|1,0,1]=4 2038 B11R1.28 CCC\C=C\C1CCCNC1 Amb33419572 [0,1,0,1,0,0|2,0,0]=4 2039 B11R1.28 CCNCCC1CC=CCC1 Amb32753680 [0,1,0,1,0,0|1,0,1]=4 2040 B11R1.28 CC\C=C\CC1CCCCN1 Amb24679063 [0,1,0,1,0,0|1,0,1]=4 2041 B11R1.28 CC\C=C\CC1CCCNC1 Amb33268265 [0,1,0,1,0,0|1,0,1]=4 2042 B11R1.28 CC\C=C\CC1CCNCC1 Amb33268693 [0,1,0,1,0,0|1,0,1]=4 2043 B11R1.28 CNC\C=C\C1CCCCC1 Amb27864700 [0,1,0,1,0,0|1,0,1]=4 2044 B11R1.28 CNC\C=C\C1CCCCO1 Amb35742230 [0,1,0,1,0,0|0,0,2]=4 2045 B11R1.28 C\C=C\CNC1CC=CCC1 Amb27797019 [0,1,0,1,0,0|1,0,1]=4 2046 B11R1.28 ClCC\C=C\C1CCCOC1 Amb28207318 [0,1,0,1,0,0|2,0,0]=4 2047 B11R1.28 FCCCCN1CC=CCC1 Amb27272082 [0,1,0,1,0,0|1,0,1]=4 2048 B11R1.28 FCCCNC1CC=CCC1 Amb27986346 [0,1,0,1,0,0|1,0,1]=4 2049 B11R1.28 NCCCCC1CC=CCC1 Amb33375582 [0,1,0,1,0,0|1,0,1]=4 2050 B11R1.28 NCCCCN1CC=CCC1 Amb18117252 [0,1,0,1,0,0|1,0,1]=4 2051 B11R1.28 NCCCNC1CC=CCC1 Amb27670594 [0,1,0,1,0,0|1,0,1]=4 2052 B11R1.28 NCCCOC1CC=CCC1 Amb33226961 [0,1,0,1,0,0|1,0,1]=4 2053 B11R1.28 NCC\C=C\C1CCCCC1 Amb17570017 [0,1,0,1,0,0|1,0,1]=4 2054 B11R1.28 NCC\C=C\C1CCCCO1 Amb35645485 [0,1,0,1,0,0|0,0,2]=4 2055 B11R1.28 O=C=NCCC1CC=CCC1 Amb33314940 [0,1,0,1,0,0|0,0,1]=3 2056 B11R1.28 O=CCCCC1=COCCC1 Amb33424235 [0,1,0,1,0,0|0,0,2]=4 2057 B11R1.28 O=CCCCC1CC=CCC1 Amb33375581 [0,1,0,1,0,0|0,0,0]=2 2058 B11R1.28 O=CCCCC1CCCCC1 Amb26998071 [0,1,0,1,0,0|0,0,2]=4 2059 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [0,1,0,1,0,0|0,0,2]=4 2060 B11R1.28 O=CCCCC1CCCOC1 Amb33323158 [0,1,0,1,0,0|0,0,2]=4 2061 B11R1.28 O=CCCCC1CCCSC1 Amb32726172 [0,1,0,1,0,0|0,0,2]=4 2062 B11R1.28 O=CCCCC1CCOCC1 Amb26076142 [0,1,0,1,0,0|0,0,2]=4 2063 B11R1.28 O=CCCCN1CCOCC1 Amb25385962 [0,1,0,1,0,0|1,0,1]=4 2064 B11R1.28 O=CCCOC1CCCOC1 Amb27673699 [0,1,0,1,0,0|1,0,1]=4 2065 B11R1.28 O=CCOCC1CCOCC1 Amb18797338 [0,1,0,1,0,0|1,0,1]=4 2066 B11R1.28 O=CNCCC1CCCCC1 Amb28293397 [0,1,0,1,0,0|0,0,2]=4 2067 B11R1.28 O=CNCCN1CC=CCC1 Amb27657663 [0,1,0,1,0,0|1,0,0]=3 2068 B11R1.28 OCCCCC1C=CCCO1 Amb27989629 [0,1,0,1,0,0|0,0,2]=4 2069 B11R1.28 OCCNCC1CC=CCC1 Amb33473141 [0,1,0,1,0,0|0,0,2]=4 2070 B11R1.28 OCCNCC1CC=CCC1 Amb7757026 [0,1,0,1,0,0|0,0,2]=4 2071 B11R1.28 OCC\C=C\C1CCCCC1 Amb26429123 [0,1,0,1,0,0|1,0,1]=4 2072 B11R1.28 SCCNCC1CC=CCC1 Amb27272063 [0,1,0,1,0,0|0,1,1]=4 2073 B11R1.28 [N-]=[N+]=NCCC1CC=CCC1 Amb24391683 [0,1,0,1,0,0|2,0,0]=4 2074 B11R1.41 C#CC1=C(OCC)CCCC1 Amb27758055 [0,1,0,1,0,0|2,0,0]=4 2075 B11R1.41 CCC1CCCCN1CC=O Amb18799608 [0,1,0,1,0,0|0,0,2]=4 2076 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [0,1,0,1,0,0|0,0,2]=4 2077 B11R1.41 CCCC1OCCCC1C=O Amb28132010 [0,1,0,1,0,0|0,0,2]=4 2078 B11R1.41 CCN1CCCCC1CC=O Amb27958566 [0,1,0,1,0,0|0,0,2]=4 2079 B11R1.41 CCOC1C=CCCC1C=O Amb27829513 [0,1,0,1,0,0|0,0,2]=4 2080 B11R1.41 CCSC1C=CCCC1C=O Amb27257863 [0,1,0,1,0,0|0,0,2]=4 2081 B11R1.41 CCSC1CCCCC1C=O Amb27431708 [0,1,0,1,0,0|0,0,2]=4 2082 B11R1.41 C\C=C/[C@@H]1CCCC[C@H]1C=O Amb25956926 [0,1,0,1,0,0|0,0,2]=4 2083 B11R1.41 O=CCC1CCCC=C1C=O Amb18125437 [0,1,0,1,0,0|1,0,1]=4 2084 B11R1.51 CCC1CCCCCC1C=O Amb35725693 [0,1,0,1,0,0|0,0,2]=4 2085 B11R1.51 CCN1CCCCCC1C=O Amb28135545 [0,1,0,1,0,0|0,0,2]=4 2086 B11R1.109 C=C\C=C1\CCCC1CC=O Amb26068525 [0,1,0,1,0,0|0,0,2]=4 2087 B11R1.109 CO\C=C1\CCCC1CC=O Amb26937975 [0,1,0,1,0,0|1,0,0]=3 2088 B11R1.203 O=CCCC1C=CCCCC1 Amb27176435 [0,1,0,1,0,0|0,0,2]=4 2089 B11R1.203 O=CCCC1CCCCCC1 Amb26946978 [0,1,0,1,0,0|0,0,2]=4 2090 B11R1.203 O=CCCN1CCCOCC1 Amb18177532 [0,1,0,1,0,0|1,0,1]=4 2091 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [0,1,0,1,0,0|0,0,2]=4 2092 B11R1.203 O=CNCC1CCCCCC1 Amb28193191 [0,1,0,1,0,0|0,0,2]=4 2093 B11R1.203 O=CNCC1CCCSCC1 Amb35637603 [0,1,0,1,0,0|1,0,1]=4 2094 B11R1.203 OCCCC1CCC=CCC1 Amb33213740 [0,1,0,1,0,0|0,0,2]=4 2095 B11R1.203 [N-]=[N+]=NCC1CCC=CCC1 Amb32683446 [0,1,0,1,0,0|2,0,0]=4 2096 B11R1.248 O=CC1CCCCCCCC1 Amb27215402 [0,1,0,1,0,0|0,0,2]=4 2097 B11R1.1 C=CCCN1CC=C(C)CC1 Amb27840182 [0,1,0,1,0,0|2,0,0]=4 2098 B11R1.1 CC1CCC(CCC=O)CC1 Amb27766980 [0,1,0,1,0,0|0,0,2]=4 2099 B11R1.1 CN1CCC(CCC=O)CC1 Amb24611054 [0,1,0,1,0,0|1,0,1]=4 2100 B11R1.13 CCCN1CCCC(O)C1=O Amb32697329 [0,1,0,1,0,0|1,0,1]=4 2101 B11R1.13 CN1C(=O)CCCC1CC=O Amb27401205 [0,1,0,1,0,0|1,0,1]=4 2102 B11R1.13 CO\C=C1\CCCC(C)C1=O Amb26624828 [0,1,0,1,0,0|1,0,0]=3 2103 B11R1.25 CC(C=O)CCC1CCCC1 Amb26069600 [0,1,0,1,0,0|0,0,2]=4 2104 B11R1.25 CC(C=O)CCC1CCOC1 Amb28080678 [0,1,0,1,0,0|1,0,1]=4 2105 B11R1.40 CC(C=O)CC1CCCCC1 Amb33546358 [0,1,0,1,0,0|0,0,2]=4 2106 B11R1.40 CC(C=O)CC1CCCOC1 Amb28120369 [0,1,0,1,0,0|1,0,1]=4 2107 B11R1.40 CC(C=O)CC1CCOCC1 Amb25189283 [0,1,0,1,0,0|1,0,1]=4 2108 B11R1.40 CC(CC1CC=CCC1)NN Amb30012137 [0,1,0,1,0,0|2,0,0]=4 2109 B11R1.40 CCC(=O)NC1C=CCCC1 Amb28255684 [0,1,0,1,0,0|2,0,0]=4 2110 B11R1.40 CCC(Cl)CC1CC=CCC1 Amb30018642 [0,1,0,1,0,0|1,0,1]=4 2111 B11R1.40 CCC(O)CC1CC=CCC1 Amb35725149 [0,1,0,1,0,0|1,0,1]=4 2112 B11R1.40 CN(C=O)CC1CC=CCC1 Amb30011951 [0,1,0,1,0,0|1,0,0]=3 2113 B11R1.40 CNC(C)CC1CC=CCC1 Amb30012111 [0,1,0,1,0,0|2,0,0]=4 2114 B11R1.40 NC(CO)CC1CC=CCC1 Amb25939047 [0,1,0,1,0,0|0,0,2]=4 2115 B11R1.40 NCC(O)CC1CC=CCC1 Amb33226979 [0,1,0,1,0,0|1,0,1]=4 2116 B11R1.40 O=CC(Cl)CC1CCCCC1 Amb27632421 [0,1,0,1,0,0|0,0,2]=4 2117 B11R1.59 CCC(=O)N1CCCC1C=O Amb24392858 [0,1,0,1,0,0|1,0,0]=3 2118 B11R1.59 COC(=O)C1CCCC1C=O Amb25874888 [0,1,0,1,0,0|1,0,1]=4 2119 B11R1.59 COC(=O)N1CCCC1C=O Amb25125257 [0,1,0,1,0,0|2,0,0]=4 2120 B11R1.59 COC(=O)N1CCC[C@H]1C=O Amb25756821 [0,1,0,1,0,0|2,0,0]=4 2121 B11R1.59 COC(=O)[C@H]1CCC[C@H]1C=O Amb24588894 [0,1,0,1,0,0|1,0,1]=4 2122 B11R1.144 O=C1CCC(=O)NCCCN1 Amb28077541 [0,1,0,1,0,0|2,0,0]=4 2123 B11R1.212 C=CCCC1CCC(=O)C1C Amb22753171 [0,1,0,1,0,0|1,0,1]=4 2124 B11R1.212 CC1C(CCC=O)COC1O Amb27966689 [0,1,0,1,0,0|1,0,1]=4 2125 B11R1.214 C=C[C@H]1CC[C@@H](\C=C\CO)C1 Amb28064052 [0,1,0,1,0,0|2,0,0]=4 2126 B11R1.214 CCCCC1CCC(C=O)O1 Amb27269452 [0,1,0,1,0,0|0,0,2]=4 2127 B11R1.214 CCOCC1CCC(C=O)O1 Amb27673680 [0,1,0,1,0,0|1,0,1]=4 2128 B11R1.222 C#CC(O)C1CCC=CC1C Amb28044005 [0,1,0,1,0,0|1,0,1]=4 2129 B11R1.222 CCC(=O)C1CCCCC1=O Amb9786088 [0,1,0,1,0,0|0,0,1]=3 2130 B11R1.222 CCC(=O)C1COCCC1=O Amb27475843 [0,1,0,1,0,0|1,0,1]=4 2131 B11R1.222 CCC(C)C1CCCCC1=O Amb4013148 [0,1,0,1,0,0|0,0,2]=4 2132 B11R1.222 CCC(O)C1=C(Cl)CCCC1 Amb28460696 [0,1,0,1,0,0|1,0,1]=4 2133 B11R1.222 CC[C@H](O)C1=CCCCC1=O Amb27854985 [0,1,0,1,0,0|0,0,2]=4 2134 B11R1.222 CC\C(S)=C1/CCCCC1=O Amb28052425 [0,1,0,1,0,0|0,0,0]=2 2135 B11R1.222 CN\C(C)=C1\CCCOC1=O Amb28387850 [0,1,0,1,0,0|2,0,0]=4 2136 B11R1.222 COC(=O)C1=C(C)CCCC1 Amb24593167 [0,1,0,1,0,0|2,0,0]=4 2137 B11R1.222 COC(=O)C1CCCCC1=O Amb8394279 [0,1,0,1,0,0|1,0,1]=4 2138 B11R1.222 COC(=O)[C@@H]1CCCCC1=O Amb26336345 [0,1,0,1,0,0|1,0,1]=4 2139 B11R1.222 CO\C(C)=C1/CCCCC1=O Amb27823653 [0,1,0,1,0,0|1,0,0]=3 2140 B11R1.222 C\C=C(/C)C1CCCCC1=O Amb28253942 [0,1,0,1,0,0|0,0,2]=4 2141 B11R1.222 O=C(CCl)N1CCCCC1=O Amb8834437 [0,1,0,1,0,0|2,0,0]=4 2142 B11R1.223 CCN(C)CCC1CCC1=O Amb32697983 [0,1,0,1,0,0|1,0,1]=4 2143 B11R1.228 C=C(CC)CC1CCCC1=O Amb28123243 [0,1,0,1,0,0|0,0,1]=3 2144 B11R1.228 C=C(CC)CC1COCC1=O Amb35639034 [0,1,0,1,0,0|1,0,1]=4 2145 B11R1.228 C=C\C(C)=C\C1CCCC1=O Amb27211891 [0,1,0,1,0,0|0,0,2]=4 2146 B11R1.228 CCC(=N)NC1CCNC1=O Amb35686005 [0,1,0,1,0,0|2,0,0]=4 2147 B11R1.228 CCC(=O)CN1CCCC1=O Amb18182974 [0,1,0,1,0,0|1,0,1]=4 2148 B11R1.228 CCC(=O)NC1CCNC1=O Amb29889975 [0,1,0,1,0,0|2,0,0]=4 2149 B11R1.228 CCC(=O)NC1CCOC1=O Amb24447418 [0,1,0,1,0,0|2,0,0]=4 2150 B11R1.228 CCC(=O)N[C@H]1CCNC1=O Amb35662969 [0,1,0,1,0,0|2,0,0]=4 2151 B11R1.228 CCC(=O)OC1CCCC1=O Amb24486346 [0,1,0,1,0,0|1,0,0]=3 2152 B11R1.228 CCC(=O)O[C@H]1CCNC1=O Amb28398714 [0,1,0,1,0,0|2,0,0]=4 2153 B11R1.228 COC(=O)CC1CCCC1=O Amb8388661 [0,1,0,1,0,0|1,0,1]=4 2154 B11R1.228 O=C(CO)CC1CCCC1=O Amb27599384 [0,1,0,1,0,0|1,0,1]=4 2155 B11R1.381 CCC1CCCCC(C)C1=O Amb28074813 [0,1,0,1,0,0|0,0,2]=4 2156 B11R1.381 CCN1CCCCC(N)C1=O Amb22492734 [0,1,0,1,0,0|1,0,1]=4 2157 B11R1.381 CCN1CCCC[C@H](N)C1=O Amb19883962 [0,1,0,1,0,0|1,0,1]=4 2158 B11R1.381 CCN1CCCC[C@H](N)C1=O Amb2684404 [0,1,0,1,0,0|1,0,1]=4 2159 B11R1.381 O=C1C(CO)=CCCCC1O Amb28253797 [0,1,0,1,0,0|1,0,0]=3 2160 B11R1.410 CC1(C=O)CCCCCCC1 Amb26884796 [0,1,0,1,0,0|0,0,2]=4 2161 B11R1.410 CC1(CBr)CCC=CCCC1 Amb32691347 [0,1,0,1,0,0|1,0,1]=4 2162 B11R1.410 CC1(CCl)CCC=CCCC1 Amb32691344 [0,1,0,1,0,0|1,0,1]=4 2163 B11R1.558 CC1C(=O)CCCCCN1C Amb27802504 [0,1,0,1,0,0|1,0,1]=4 2164 B11R1.558 C[C@@H]1CCCCC[C@@H](C)C1=O Amb28429577 [0,1,0,1,0,0|0,0,2]=4 2165 B11R1.852 CC(C=O)C1CCCCCC1 Amb26572856 [0,1,0,1,0,0|0,0,2]=4 2166 B11R1.29 O=CCCC(O)C1CCCO1 Amb27986419 [0,1,0,1,0,0|1,0,1]=4 2167 B11R1.182 C=C1CC[C@H](O)C\C1=C\CO Amb26023993 [0,1,0,1,0,0|2,0,0]=4 2168 B11R1.182 CCCN1CC(N)CCC1=O Amb19515734 [0,1,0,1,0,0|1,0,1]=4 2169 B11R1.182 C\C=C/C1=C[C@@H](O)CCC1=O Amb28202284 [0,1,0,1,0,0|0,0,2]=4 2170 B11R1.284 NC(CCC=O)CC1CCC1 Amb33036400 [0,1,0,1,0,0|0,0,2]=4 2171 B11R1.605 CNC=C1C(=O)CCCC1=O Amb2386505 [0,1,0,1,0,0|1,0,1]=4 2172 B11R1.756 CC\C=C\CC1(O)CCNC1 Amb33267551 [0,1,0,1,0,0|2,0,0]=4 2173 B11R1.900 C#CCCC1(N)CC=CCC1 Amb35606669 [0,1,0,1,0,0|1,0,1]=4 2174 B11R1.900 C=CCCC1(N)CC=CCC1 Amb30029657 [0,1,0,1,0,0|1,0,0]=3 2175 B11R1.900 CC1(CCC=O)CCCCC1 Amb33417934 [0,1,0,1,0,0|0,0,2]=4 2176 B11R1.900 CC1(CCC=O)CCOCC1 Amb33415592 [0,1,0,1,0,0|1,0,1]=4 2177 B11R1.900 CC\C=C\C1(N)CCCCC1 Amb33225040 [0,1,0,1,0,0|1,0,1]=4 2178 B11R1.900 C\C=C\CC1(N)CC=CCC1 Amb35592851 [0,1,0,1,0,0|1,0,1]=4 2179 B11R1.900 NC1(CCC=O)CCCCC1 Amb33036341 [0,1,0,1,0,0|0,0,2]=4 2180 B11R1.900 NC1(CCC=O)CCCSC1 Amb33036402 [0,1,0,1,0,0|1,0,1]=4 2181 B11R1.900 NC1(CCC=O)CCNCC1 Amb33036361 [0,1,0,1,0,0|1,0,1]=4 2182 B11R1.900 NC1(CCCF)CC=CCC1 Amb29870164 [0,1,0,1,0,0|1,0,1]=4 2183 B11R1.900 NC1(CCCO)CC=CCC1 Amb35606683 [0,1,0,1,0,0|0,0,2]=4 2184 B11R1.900 NC1(C\C=C\Cl)CC=CCC1 Amb30029406 [0,1,0,1,0,0|1,0,1]=4 2185 B11R1.900 O=CCCC1(Cl)CCCCC1 Amb27854592 [0,1,0,1,0,0|0,0,2]=4 2186 B11R1.900 O=CCCC1(O)CCCCC1 Amb28194590 [0,1,0,1,0,0|0,0,2]=4 2187 B11R1.900 O=CCCC1(O)CCCOC1 Amb27467394 [0,1,0,1,0,0|1,0,1]=4 2188 B11R1.956 CCN1CC(N)CCCC1=O Amb27427574 [0,1,0,1,0,0|1,0,1]=4 2189 B11R1.1133 CC1COCC1(N)CCC=O Amb33036374 [0,1,0,1,0,0|1,0,1]=4 2190 B11R1.1133 CC1COCC1(O)CCC=O Amb29882771 [0,1,0,1,0,0|1,0,1]=4 2191 B11R1.1133 CC1OCCC1(O)CCC=O Amb27768401 [0,1,0,1,0,0|1,0,1]=4 2192 B11R1.1133 CCCCC1(C)CCCC1=O Amb28194561 [0,1,0,1,0,0|0,0,2]=4 2193 B11R1.1133 CCCC[C@]1(C)CCCC1=O Amb27823640 [0,1,0,1,0,0|0,0,2]=4 2194 B11R2.10 CC1C=C2CCCCN2C1 Amb27839179 [0,0,0,2,0,0|2,0,0]=4 2195 B11R2.10 Cn1cc2c(n1)CCCC2 Amb27157979 [0,0,0,2,0,0|2,0,0]=4 2196 B11R2.10 O=C1CC2CC=CCC2C1 Amb26317314 [0,0,0,2,0,0|0,0,2]=4 2197 B11R2.10 O=C1CC2CCCCC2C1 Amb26871063 [0,0,0,2,0,0|0,0,2]=4 2198 B11R2.10 O=C1CC2CCNCC2C1 Amb33719137 [0,0,0,2,0,0|1,0,1]=4 2199 B11R2.10 O=C1C[C@@H]2CC=CC[C@H]2C1 Amb27217410 [0,0,0,2,0,0|0,0,2]=4 2200 B11R2.10 O=C1NC2CCC=CC2O1 Amb27838151 [0,0,0,2,0,0|2,0,0]=4 2201 B11R2.10 O=C1N[C@@H]2C=CCC[C@H]2O1 Amb27858509 [0,0,0,2,0,0|2,0,0]=4 2202 B11R2.10 O=C1N[C@H]2C=CCC[C@@H]2O1 Amb27440121 [0,0,0,2,0,0|2,0,0]=4 2203 B11R2.20 C1=C2CCCCN2CCC1 Amb27803664 [0,0,0,2,0,0|2,0,0]=4 2204 B11R2.20 C1=C2CCNCC2CCC1 Amb27964991 [0,0,0,2,0,0|1,0,1]=4 2205 B11R2.20 C1=CCC2CCCCC2C1 Amb8394169 [0,0,0,2,0,0|1,0,1]=4 2206 B11R2.20 C1=CCC2NCCCC2C1 Amb27195709 [0,0,0,2,0,0|1,0,1]=4 2207 B11R2.20 C1=CC[C@@H]2NCCC[C@H]2C1 Amb27216552 [0,0,0,2,0,0|1,0,1]=4 2208 B11R2.20 C1=CC[C@H]2CCCC[C@@H]2C1 Amb26633093 [0,0,0,2,0,0|1,0,1]=4 2209 B11R2.20 C1=CC[C@H]2CNCC[C@H]2C1 Amb28144973 [0,0,0,2,0,0|2,0,0]=4 2210 B11R2.20 C1CCC2=C(C1)CCCC2 Amb4477054 [0,0,0,2,0,0|1,0,1]=4 2211 B11R2.20 C1CCC2=C(C1)CCCN2 Amb28324508 [0,0,0,2,0,0|1,0,1]=4 2212 B11R2.20 C1CCC2=C(C1)CCCO2 Amb28132692 [0,0,0,2,0,0|0,0,2]=4 2213 B11R2.38 C[C@@H]1C[C@]12CCCCC2=O Amb27197678 [0,0,0,2,0,0|0,0,2]=4 2214 B11R2.47 CC1=CC2CCC1CC2=O Amb26590988 [0,0,0,2,0,0|0,0,2]=4 2215 B11R2.47 CC1=C[C@H]2CC[C@@H]1CC2=O Amb28324427 [0,0,0,2,0,0|0,0,2]=4 2216 B11R2.47 C[C@@H]1C[C@H]2CC[C@H]1CC2=O Amb27432509 [0,0,0,2,0,0|0,0,2]=4 2217 B11R2.48 O=C1C[C@@H]2CCC[C@H]1CC2 Amb28199906 [0,0,0,2,0,0|0,0,2]=4 2218 B11R2.55 O=C1CCCCC1C2CC2 Amb24271138 [0,0,0,2,0,0|0,0,2]=4 2219 B11R2.68 CC1CC2CC1CCC2=O Amb27164704 [0,0,0,2,0,0|0,0,2]=4 2220 B11R2.68 O=C1OC2CC1C=CC2O Amb27594683 [0,0,0,2,0,0|2,0,0]=4 2221 B11R2.68 O=C1O[C@H]2C[C@@H]1C=C[C@@H]2O Amb27210539 [0,0,0,2,0,0|2,0,0]=4 2222 B11R2.106 O=C1CCC=C2CCCN12 Amb28255555 [0,0,0,2,0,0|1,0,0]=3 2223 B11R2.106 O=C1CCCC2C=CCC12 Amb28121713 [0,0,0,2,0,0|0,0,0]=2 2224 B11R2.106 O=C1CCCC2CCCC12 Amb28070832 [0,0,0,2,0,0|0,0,2]=4 2225 B11R2.106 O=C1CCCC2CCCN12 Amb22371129 [0,0,0,2,0,0|1,0,1]=4 2226 B11R2.106 O=C1CCCC2CCOC12 Amb27859380 [0,0,0,2,0,0|1,0,1]=4 2227 B11R2.106 O=C1CCCC2CNCC12 Amb22754735 [0,0,0,2,0,0|1,0,1]=4 2228 B11R2.106 O=C1CCCC2CNCC12 Amb32410157 [0,0,0,2,0,0|1,0,1]=4 2229 B11R2.106 O=C1CCCC2CSCC12 Amb32668551 [0,0,0,2,0,0|1,0,1]=4 2230 B11R2.106 O=C1CCCC2SCC=C12 Amb27164586 [0,0,0,2,0,0|1,0,0]=3 2231 B11R2.106 O=C1CCCC2SCCC12 Amb27164705 [0,0,0,2,0,0|1,0,1]=4 2232 B11R2.106 O=C1CCC[C@@H]2SCC[C@H]12 Amb27433072 [0,0,0,2,0,0|1,0,1]=4 2233 B11R2.106 O=C1CCNC2CCCC12 Amb1085838 [0,0,0,2,0,0|1,0,1]=4 2234 B11R2.106 O=C1CCNC2CCCC12 Amb22283860 [0,0,0,2,0,0|1,0,1]=4 2235 B11R2.106 O=C1CCOC2CCCC12 Amb18831906 [0,0,0,2,0,0|1,0,1]=4 2236 B11R2.106 O=C1NCCN2CCC=C12 Amb27786321 [0,0,0,2,0,0|2,0,0]=4 2237 B11R2.246 CCC[C@H]1C[C@@H]2C[C@@H]2C1=O Amb28285868 [0,0,0,2,0,0|0,0,2]=4 2238 B11R2.248 BrCCC1CC2C=CC1C2 Amb27445031 [0,0,0,2,0,0|1,0,1]=4 2239 B11R2.248 BrCC[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb27428243 [0,0,0,2,0,0|1,0,1]=4 2240 B11R2.248 C#CCC1CC2C=CC1C2 Amb33380394 [0,0,0,2,0,0|1,0,1]=4 2241 B11R2.248 CNCC1CC2C=CC1C2 Amb9223254 [0,0,0,2,0,0|2,0,0]=4 2242 B11R2.248 ClCC[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb27493403 [0,0,0,2,0,0|1,0,1]=4 2243 B11R2.248 ClC\C=C1/C[C@H]2C=C[C@@H]1C2 Amb27614466 [0,0,0,2,0,0|2,0,0]=4 2244 B11R2.248 ClC\C=C1\CC2C=CC1C2 Amb27838159 [0,0,0,2,0,0|2,0,0]=4 2245 B11R2.248 Cl\C=C/C1CC2C=CC1C2 Amb27614862 [0,0,0,2,0,0|1,0,1]=4 2246 B11R2.248 N#CCC1CC2C=CC1C2 Amb27273250 [0,0,0,2,0,0|1,0,1]=4 2247 B11R2.248 NCCC1CC2C=CC1C2 Amb9781626 [0,0,0,2,0,0|1,0,1]=4 2248 B11R2.248 NCCC1C[C@@H]2C=C[C@H]1C2 Amb24570811 [0,0,0,2,0,0|1,0,1]=4 2249 B11R2.248 NCC[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb10607425 [0,0,0,2,0,0|1,0,1]=4 2250 B11R2.248 NCC[C@@H]1C[C@H]2C=C[C@H]1C2 Amb32665082 [0,0,0,2,0,0|1,0,1]=4 2251 B11R2.248 NCC[C@H]1C[C@@H]2C=C[C@H]1C2 Amb28069163 [0,0,0,2,0,0|1,0,1]=4 2252 B11R2.248 NNCC1CC2C=CC1C2 Amb33374631 [0,0,0,2,0,0|2,0,0]=4 2253 B11R2.248 NOCC1CC2C=CC1C2 Amb33374628 [0,0,0,2,0,0|2,0,0]=4 2254 B11R2.248 O=C=NC1CC2C=CC1C2 Amb25046673 [0,0,0,2,0,0|1,0,1]=4 2255 B11R2.248 O=C=N[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb27491486 [0,0,0,2,0,0|1,0,1]=4 2256 B11R2.248 O=C=N[C@@H]1C[C@H]2C=C[C@H]1C2 Amb27493405 [0,0,0,2,0,0|1,0,1]=4 2257 B11R2.248 O=CCC1CC2C=CC1C2 Amb27155689 [0,0,0,2,0,0|0,0,0]=2 2258 B11R2.248 O=CCC1CC2CCC1O2 Amb32874824 [0,0,0,2,0,0|1,0,1]=4 2259 B11R2.248 O=CC[C@@H]1C[C@H]2CC[C@H]1C2 Amb28248023 [0,0,0,2,0,0|0,0,2]=4 2260 B11R2.248 OCCC1CC2C=CC1C2 Amb25331129 [0,0,0,2,0,0|0,0,2]=4 2261 B11R2.248 OCC[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb27205594 [0,0,0,2,0,0|0,0,2]=4 2262 B11R2.248 OCC[C@H]1C[C@H]2C=C[C@H]1C2 Amb27978581 [0,0,0,2,0,0|0,0,2]=4 2263 B11R2.248 ONCC1CC2C=CC1C2 Amb25274782 [0,0,0,2,0,0|1,0,1]=4 2264 B11R2.248 SCCC1CC2C=CC1C2 Amb33378032 [0,0,0,2,0,0|0,1,1]=4 2265 B11R2.248 [C-]#[N+]CC1CC2C=CC1C2 Amb33374653 [0,0,0,2,0,0|2,0,0]=4 2266 B11R2.357 O=C1CCC2CC=CC1C2 Amb28049905 [0,0,0,2,0,0|0,0,0]=2 2267 B11R2.357 O=C1CCC2CCCC1C2 Amb26497599 [0,0,0,2,0,0|0,0,2]=4 2268 B11R2.357 O=C1CCC2CCCN1C2 Amb24419891 [0,0,0,2,0,0|1,0,1]=4 2269 B11R2.357 O=C1CCC2CCNC1C2 Amb33249781 [0,0,0,2,0,0|1,0,1]=4 2270 B11R2.357 O=C1CCC2CCNC1C2 Amb33249782 [0,0,0,2,0,0|1,0,1]=4 2271 B11R2.357 O=C1CCC2COCC1C2 Amb27770464 [0,0,0,2,0,0|1,0,1]=4 2272 B11R2.357 O=C1CC[C@@H]2CCC[C@@H]1C2 Amb27859411 [0,0,0,2,0,0|0,0,2]=4 2273 B11R2.357 O=C1CC[C@@H]2CCC[C@H]1C2 Amb27489027 [0,0,0,2,0,0|0,0,2]=4 2274 B11R2.370 O=C1CCCCC12CCC2 Amb26325424 [0,0,0,2,0,0|0,0,2]=4 2275 B11R2.565 O=C1C2C=CCC1CCC2 Amb28144186 [0,0,0,2,0,0|0,0,2]=4 2276 B11R2.565 O=C1C2CCCC1CCC2 Amb26478705 [0,0,0,2,0,0|0,0,2]=4 2277 B11R2.712 CC12CCCCC1CC2=O Amb27973083 [0,0,0,2,0,0|0,0,2]=4 2278 B11R2.712 C[C@]12CCCC[C@H]1CC2=O Amb28052424 [0,0,0,2,0,0|0,0,2]=4 2279 B11R2.988 CNC1C[C@@H]2CCC=C[C@H]12 Amb27461299 [0,0,0,2,0,0|2,0,0]=4 2280 B11R2.988 CN[C@@H]1C[C@@H]2CCC=C[C@@H]21 Amb27216654 [0,0,0,2,0,0|2,0,0]=4 2281 B11R2.8 CC1C(=O)C[C@@H]2CCC[C@H]12 Amb27427774 [0,0,0,2,0,0|0,0,2]=4 2282 B11R2.8 CN1N=C2CCCC2C1=O Amb22058956 [0,0,0,2,0,0|2,0,0]=4 2283 B11R2.8 C[C@@H]1C(=O)C[C@@H]2CCC[C@@H]21 Amb26426364 [0,0,0,2,0,0|0,0,2]=4 2284 B11R2.18 C1=CC2COCC2=CCC1 Amb8391942 [0,0,0,2,0,0|2,0,0]=4 2285 B11R2.18 C1=CCC2CNCC2CC1 Amb28071111 [0,0,0,2,0,0|2,0,0]=4 2286 B11R2.36 CC1=CCC2CC=CC2C1 Amb24478500 [0,0,0,2,0,0|1,0,1]=4 2287 B11R2.36 O=C1CC=C2CCCC2C1 Amb27627458 [0,0,0,2,0,0|0,0,2]=4 2288 B11R2.36 O=C1CCC2=C(CCN2)C1 Amb22015298 [0,0,0,2,0,0|1,0,1]=4 2289 B11R2.36 O=C1CCC2CCNC2C1 Amb18643450 [0,0,0,2,0,0|1,0,1]=4 2290 B11R2.36 O=C1CCC2CCOC2C1 Amb27796117 [0,0,0,2,0,0|1,0,1]=4 2291 B11R2.36 O=C1CCC2CNCC2C1 Amb33719130 [0,0,0,2,0,0|1,0,1]=4 2292 B11R2.36 O=C1CCC2NCCC2C1 Amb32794585 [0,0,0,2,0,0|1,0,1]=4 2293 B11R2.36 O=C1CCN2CCCC2C1 Amb18832027 [0,0,0,2,0,0|1,0,1]=4 2294 B11R2.36 O=C1CC[C@@H]2CCO[C@@H]2C1 Amb27261231 [0,0,0,2,0,0|1,0,1]=4 2295 B11R2.36 O=C1CC[C@H]2CSC[C@@H]2C1 Amb27427851 [0,0,0,2,0,0|1,0,1]=4 2296 B11R2.36 O=C1C[C@@H]2C=CC[C@@H]2CN1 Amb27833928 [0,0,0,2,0,0|1,0,0]=3 2297 B11R2.36 OC1CCC2CC=CC2C1 Amb27649224 [0,0,0,2,0,0|0,0,2]=4 2298 B11R2.76 OCC=C1C2C=CC1CC2 Amb27839401 [0,0,0,2,0,0|2,0,0]=4 2299 B11R2.163 O=CC1CC2C=CCC1C2 Amb28381260 [0,0,0,2,0,0|0,0,2]=4 2300 B11R2.191 O=CC1CCC2=C1CCC2 Amb28400731 [0,0,0,2,0,0|0,0,2]=4 2301 B11R2.191 O=C[C@H]1CC[C@@H]2CCCN21 Amb27209001 [0,0,0,2,0,0|1,0,1]=4 2302 B11R2.216 O=CC1=C(C2CC2)CCC1 Amb28239497 [0,0,0,2,0,0|0,0,2]=4 2303 B11R2.216 O=CC1CCCN1C2CC2 Amb27777372 [0,0,0,2,0,0|1,0,1]=4 2304 B11R2.282 O=CC1CCCC12CCC2 Amb27437710 [0,0,0,2,0,0|0,0,2]=4 2305 B11R2.1098 O=CC12CCCC1CCC2 Amb28049554 [0,0,0,2,0,0|0,0,2]=4 2306 B11R2.1098 O=CC12CCCC1OCC2 Amb32682515 [0,0,0,2,0,0|1,0,1]=4 2307 B11R2.1098 O=C[C@@]12CCC[C@@H]1OCC2 Amb32684906 [0,0,0,2,0,0|1,0,1]=4 2308 B11R2.54 CC1C(=O)[C@@H]2CCC=C[C@H]12 Amb28366853 [0,0,0,2,0,0|0,0,2]=4 2309 B11R2.54 CC1C(=O)[C@H]2CCCC[C@@H]12 Amb27970163 [0,0,0,2,0,0|0,0,2]=4 2310 B11R2.103 C[C@@H]1CC2CCC2CC1=O Amb28461192 [0,0,0,2,0,0|0,0,2]=4 2311 B11R2.108 CC12CCC1CCCC2=O Amb27267062 [0,0,0,2,0,0|0,0,2]=4 2312 B11R2.474 O=C1CCCC2CCC1O2 Amb22364978 [0,0,0,2,0,0|1,0,1]=4 2313 B11R2.474 O=C1CCC[C@H]2CC[C@@H]1C2 Amb27199066 [0,0,0,2,0,0|0,0,2]=4 2314 B11R2.474 O=C1CCC[C@H]2CC[C@@H]1O2 Amb27844151 [0,0,0,2,0,0|1,0,1]=4 2315 B11R2.513 O=C1CC=CCCC2CC12 Amb27212193 [0,0,0,2,0,0|0,0,2]=4 2316 B11R2.513 O=C1CCCC=CC2CC12 Amb28070855 [0,0,0,2,0,0|0,0,2]=4 2317 B11R2.513 O=C1CCCC=C[C@H]2C[C@@H]12 Amb25962680 [0,0,0,2,0,0|0,0,2]=4 2318 B11R2.513 O=C1CCCCC[C@H]2C[C@@H]12 Amb27213245 [0,0,0,2,0,0|0,0,2]=4 2319 B11R2.528 CC12CC=CC1CCC2=O Amb27409636 [0,0,0,2,0,0|0,0,2]=4 2320 B11R2.17 O=CC1CCC12CCCC2 Amb29874089 [0,0,0,2,0,0|0,0,2]=4 2321 B11R2.61 O=C1CC=C2CCC2CC1 Amb22365231 [0,0,0,2,0,0|0,0,2]=4 2322 B11R2.168 O=C1CC[C@H]2C(CCl)=C[C@@H]12 Amb28457514 [0,0,0,2,0,0|1,0,0]=3 2323 B11R2.1 O=C1C=C[C@H]2CC=CC[C@H]12 Amb28052443 [0,0,0,2,0,0|0,0,2]=4 2324 B11R2.1 O=C1CCC2CCCCC12 Amb22365209 [0,0,0,2,0,0|0,0,2]=4 2325 B11R2.1 O=C1CCN2CCCCC12 Amb10610141 [0,0,0,2,0,0|1,0,1]=4 2326 B11R2.1 O=C1CC[C@@H]2CCCC[C@H]12 Amb26053513 [0,0,0,2,0,0|0,0,2]=4 2327 B11R2.1 O=C1CC[C@H]2CC=CCN12 Amb28324743 [0,0,0,2,0,0|1,0,0]=3 2328 B11R2.1 O=C1CC[C@H]2CC=CC[C@@H]12 Amb27428192 [0,0,0,2,0,0|0,0,0]=2 2329 B11R2.1 O=C1NCC2CC=CCC12 Amb27876169 [0,0,0,2,0,0|1,0,0]=3 2330 B11R2.1 O=C1NC[C@@H]2CC=CC[C@H]12 Amb27188447 [0,0,0,2,0,0|1,0,0]=3 2331 B11R2.1 OC1CC[C@@H]2CC=CC[C@H]12 Amb27198069 [0,0,0,2,0,0|0,0,2]=4 2332 B11R2.1 O[C@@H]1CCC2CC=CC[C@@H]21 Amb27856759 [0,0,0,2,0,0|0,0,2]=4 2333 B11R2.1 O[C@H]1CC[C@H]2CC=CC[C@@H]12 Amb27207439 [0,0,0,2,0,0|0,0,2]=4 2334 B11R2.4 NC1CC1C2CC=CCC2 Amb33314933 [0,0,0,2,0,0|1,0,1]=4 2335 B11R2.4 N[C@@H]1C[C@H]1C2CC=CCC2 Amb33314935 [0,0,0,2,0,0|1,0,1]=4 2336 B11R2.12 O=C1CCC12C=CCCC2 Amb27854276 [0,0,0,2,0,0|0,0,2]=4 2337 B11R2.12 O=C1CCC12CCCCC2 Amb25694233 [0,0,0,2,0,0|0,0,2]=4 2338 B11R2.12 O=C1CCC12CCOCC2 Amb26568637 [0,0,0,2,0,0|1,0,1]=4 2339 B11R2.12 O=C1CCC12CCSCC2 Amb28370316 [0,0,0,2,0,0|1,0,1]=4 2340 B11R2.12 O=C1CC[C@@]12C=CCCC2 Amb28138041 [0,0,0,2,0,0|0,0,2]=4 2341 B11R2.13 O=CC1CC12CCCCC2 Amb25318827 [0,0,0,2,0,0|0,0,2]=4 2342 B11R2.13 O=CC1CC12CCCOC2 Amb26007477 [0,0,0,2,0,0|1,0,1]=4 2343 B11R2.13 O=CC1CC12CCOCC2 Amb25880721 [0,0,0,2,0,0|1,0,1]=4 2344 B11R2.13 O=CC1CC12CCSCC2 Amb25843005 [0,0,0,2,0,0|1,0,1]=4 2345 B11R2.164 O=CC1CC2C=CC1CC2 Amb24325143 [0,0,0,2,0,0|0,0,2]=4 2346 B11R2.164 O=CC1CC2CCC1CC2 Amb18643311 [0,0,0,2,0,0|0,0,2]=4 2347 B11R2.164 O=C[C@@H]1CC2CCC1CC2 Amb28457481 [0,0,0,2,0,0|0,0,2]=4 2348 B11R2.164 O=C[C@@H]1C[C@@H]2C=C[C@H]1CC2 Amb24512864 [0,0,0,2,0,0|0,0,2]=4 2349 B11R2.164 O=C[C@@H]1C[C@H]2C=C[C@H]1CC2 Amb28288030 [0,0,0,2,0,0|0,0,2]=4 2350 B11R2.238 C1=CCC(CC2CO2)CC1 Amb33203474 [0,0,0,2,0,0|0,0,2]=4 2351 B11R2.239 C1=CCC(C2CCN2)CC1 Amb25147251 [0,0,0,2,0,0|1,0,1]=4 2352 B11R2.239 C1=CCC(C2CNC2)CC1 Amb33314436 [0,0,0,2,0,0|2,0,0]=4 2353 B11R2.258 O=CCCC1[C@@H]2NCC[C@H]12 Amb27968292 [0,0,0,2,0,0|1,0,1]=4 2354 B11R2.635 O=CCC1C2CCCNC12 Amb27204753 [0,0,0,2,0,0|1,0,1]=4 2355 B11R2.635 O=CCC1[C@H]2CCCN[C@@H]12 Amb28196639 [0,0,0,2,0,0|1,0,1]=4 2356 B11R2.1261 C1=CCC2(CC1)CCCO2 Amb26346692 [0,0,0,2,0,0|0,0,2]=4 2357 B11R2.1261 C1=CCC2(CC1)CCNC2 Amb27641928 [0,0,0,2,0,0|2,0,0]=4 2358 B11R2.63 CC1=CCC2CCC1C2=O Amb28351518 [0,0,0,2,0,0|0,0,2]=4 2359 B11R2.63 CC1C=CC2CCC1C2=O Amb28121739 [0,0,0,2,0,0|0,0,0]=2 2360 B11R2.63 C[C@@H]1C=C[C@@H]2CC[C@H]1C2=O Amb28132033 [0,0,0,2,0,0|0,0,0]=2 2361 B11R2.63 O=C1C=CC2CCC1C2=O Amb27256539 [0,0,0,2,0,0|1,0,1]=4 2362 B11R2.199 O=C1C2CC=CCC1CC2 Amb27656478 [0,0,0,2,0,0|0,0,2]=4 2363 B11R2.199 O=C1C2CCCCC1CC2 Amb25046104 [0,0,0,2,0,0|0,0,2]=4 2364 B11R2.210 CCC12CC1CCCC2=O Amb27617095 [0,0,0,2,0,0|0,0,2]=4 2365 B11R2.219 OCC12CCC=CCC1C2 Amb27604443 [0,0,0,2,0,0|0,0,2]=4 2366 B11R2.219 OCC12CCCC=CC1C2 Amb27972417 [0,0,0,2,0,0|0,0,2]=4 2367 B11R2.219 OC[C@]12CCC=CC[C@H]1C2 Amb27420573 [0,0,0,2,0,0|0,0,2]=4 2368 B11R2.264 CCC1CCC2CC2C1=O Amb23594430 [0,0,0,2,0,0|0,0,2]=4 2369 B11R2.266 O=CC1CCC2CC1CO2 Amb32988608 [0,0,0,2,0,0|1,0,1]=4 2370 B11R2.266 O=CC1CCC2CCC1O2 Amb27866821 [0,0,0,2,0,0|1,0,1]=4 2371 B11R2.471 O=C1CCCCCC12CC2 Amb18203004 [0,0,0,2,0,0|0,0,2]=4 2372 B11R2.571 CC1C2C=CCCC1C2=O Amb27770453 [0,0,0,2,0,0|0,0,2]=4 2373 B11R2.711 O=C1CC2CCCCCC12 Amb27424796 [0,0,0,2,0,0|0,0,2]=4 2374 B11R2.711 O=C1NC2C=CCCCC12 Amb27596109 [0,0,0,2,0,0|1,0,0]=3 2375 B11R2.22 O=CC1CCC=CC12CC2 Amb27643472 [0,0,0,2,0,0|0,0,2]=4 2376 B11R2.3 O=C1CCCC12C=CCS2 Amb25719433 [0,0,0,2,0,0|1,0,0]=3 2377 B11R2.3 O=C1CCCC12CCCC2 Amb17593511 [0,0,0,2,0,0|0,0,2]=4 2378 B11R2.3 O=C1CCCC12CCCN2 Amb27473292 [0,0,0,2,0,0|1,0,1]=4 2379 B11R2.3 O=C1CCCC12CCCO2 Amb22737397 [0,0,0,2,0,0|1,0,1]=4 2380 B11R2.3 O=C1CCCC12CCNC2 Amb18832016 [0,0,0,2,0,0|1,0,1]=4 2381 B11R2.3 O=C1CCC[C@@]12C=CCO2 Amb28200077 [0,0,0,2,0,0|1,0,0]=3 2382 B11R2.3 O=C1CCC[C@@]12CCCS2 Amb27598013 [0,0,0,2,0,0|1,0,1]=4 2383 B11R2.3 O=C1CCC[C@]12CCCO2 Amb26492771 [0,0,0,2,0,0|1,0,1]=4 2384 B11R2.7 O=C1CCC1C2CCCC2 Amb27192908 [0,0,0,2,0,0|0,0,2]=4 2385 B11R2.32 O=CC1CC1C2CCCC2 Amb32669252 [0,0,0,2,0,0|0,0,2]=4 2386 B11R2.32 O=CC1CC1C2CCCO2 Amb23455533 [0,0,0,2,0,0|1,0,1]=4 2387 B11R2.32 O=CC1CC1C2CCOC2 Amb23455531 [0,0,0,2,0,0|1,0,1]=4 2388 B11R2.32 O=CC1CC1C2CCSC2 Amb32669277 [0,0,0,2,0,0|1,0,1]=4 2389 B11R2.41 C[C@@H]1CCC[C@@]12CCC2=O Amb27785521 [0,0,0,2,0,0|0,0,2]=4 2390 B11R2.60 CC1=CCC2C(=O)CCC12 Amb28324100 [0,0,0,2,0,0|0,0,2]=4 2391 B11R2.60 O=C1CC[C@@H]2C(=O)C=C[C@H]12 Amb28202051 [0,0,0,2,0,0|1,0,1]=4 2392 B11R2.115 O=C1CCCC1CC2CC2 Amb27867430 [0,0,0,2,0,0|0,0,2]=4 2393 B11R2.115 O=C1CCC\C1=C/C2CC2 Amb28422723 [0,0,0,2,0,0|0,0,2]=4 2394 B11R2.158 CCC1OC12CCCC2=O Amb28246547 [0,0,0,2,0,0|1,0,1]=4 2395 B11R2.350 CCC[C@H]1[C@@H]2CCC(=O)[C@H]12 Amb27432614 [0,0,0,2,0,0|0,0,2]=4 2396 B11R2.350 C\C=C\C1[C@@H]2CCC(=O)[C@H]12 Amb28202115 [0,0,0,2,0,0|0,0,2]=4 2397 B11R2.350 C\C=C\[C@@H]1[C@@H]2CCC(=O)[C@H]12 Amb28285457 [0,0,0,2,0,0|0,0,2]=4 2398 B11R2.350 C\C=C\[C@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27854990 [0,0,0,2,0,0|0,0,2]=4 2399 B11R2.459 O=C1CCCC1C2CCC2 Amb26555851 [0,0,0,2,0,0|0,0,2]=4 2400 B11R2.105 O=C1C=CC=C2CCC2C1 Amb27227089 [0,0,0,2,0,0|0,0,2]=4 2401 B11R2.82 O=CCC1CCC2CC2C1 Amb35704913 [0,0,0,2,0,0|0,0,2]=4 2402 B11R2.559 BrC1C2CCC=CCCC12 Amb26588330 [0,0,0,2,0,0|1,0,1]=4 2403 B11R2.559 Br[C@H]1[C@H]2CCC=CCC[C@@H]12 Amb27768755 [0,0,0,2,0,0|1,0,1]=4 2404 B11R2.559 ClC1C2CCC=CCCC12 Amb28320711 [0,0,0,2,0,0|1,0,1]=4 2405 B11R2.892 O=CCCC1CC12CCC2 Amb27865627 [0,0,0,2,0,0|0,0,2]=4 2406 B11R2.1242 C1=CCCC2(CC1)CCO2 Amb25722201 [0,0,0,2,0,0|0,0,2]=4 2407 B11R2.111 O=C1CCCC2CC2CC1 Amb25759559 [0,0,0,2,0,0|0,0,2]=4 2408 B11R2.111 O=C1CCC[C@@H]2C[C@H]2CC1 Amb27861310 [0,0,0,2,0,0|0,0,2]=4 2409 B11R2.148 OCCCC1CC1=C2CC2 Amb27805313 [0,0,0,2,0,0|0,0,2]=4 2410 B11R2.1387 O=CC1C2CCCCCC12 Amb26571464 [0,0,0,2,0,0|0,0,2]=4 2411 B11R2.1387 O=CC1[C@H]2CCCCC[C@@H]12 Amb28343194 [0,0,0,2,0,0|0,0,2]=4 2412 B11R2.195 ClCC1=CC[C@@H]2C[C@@H]2C=C1 Amb27420174 [0,0,0,2,0,0|2,0,0]=4