0 B10R0.71 BrCCCCCCCCCBr Amb8513101 [0,0,0,0,0,0|2,0,1]=3 1 B10R0.71 BrCCCCOCCCCBr Amb24064682 [0,0,0,0,0,0|3,0,1]=4 2 B10R0.71 C#CCCC#CCCCCC Amb8389990 [0,0,0,0,0,0|1,0,3]=4 3 B10R0.71 C#CCCCCCCCCO Amb16231465 [0,0,0,0,0,0|2,0,1]=3 4 B10R0.71 C=CCCCCCCCC=O Amb22734770 [0,0,0,0,0,0|0,0,2]=2 5 B10R0.71 C=CCCCCCCCCBr Amb9786895 [0,0,0,0,0,0|2,0,0]=2 6 B10R0.71 C=CCCCCCCCCN Amb28652858 [0,0,0,0,0,0|2,0,0]=2 7 B10R0.71 C=CCCCCCCCCN Amb32653011 [0,0,0,0,0,0|2,0,0]=2 8 B10R0.71 C=CCCCCCCCCO Amb6364973 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.71 C=COCCOCCOCC Amb4035046 [0,0,0,0,0,0|4,0,0]=4 10 B10R0.71 CCC#CCCCCCCCl Amb22052713 [0,0,0,0,0,0|1,0,3]=4 11 B10R0.71 CCCCC#CCCNC=O Amb27272587 [0,0,0,0,0,0|1,0,2]=3 12 B10R0.71 CCCCCCCC#CCO Amb17774678 [0,0,0,0,0,0|0,0,4]=4 13 B10R0.71 CCCCCCCCCC=O Amb3940437 [0,0,0,0,0,0|0,0,0]=0 14 B10R0.71 CCCCCCCCCCBr Amb2721517 [0,0,0,0,0,0|1,0,1]=2 15 B10R0.71 CCCCCCCCCCCl Amb8513081 [0,0,0,0,0,0|1,0,1]=2 16 B10R0.71 CCCCCCCCCCF Amb2688085 [0,0,0,0,0,0|1,0,1]=2 17 B10R0.71 CCCCCCCCCCI Amb3940280 [0,0,0,0,0,0|1,0,1]=2 18 B10R0.71 CCCCCCCCCCN Amb3940460 [0,0,0,0,0,0|1,0,1]=2 19 B10R0.71 CCCCCCCCCCO Amb3940390 [0,0,0,0,0,0|0,0,2]=2 20 B10R0.71 CCCCCCCCCCS Amb9787174 [0,0,0,0,0,0|0,1,1]=2 21 B10R0.71 CCCCCCCCCNC Amb10609826 [0,0,0,0,0,0|2,0,0]=2 22 B10R0.71 CCCCCCCCCNC Amb7761761 [0,0,0,0,0,0|2,0,0]=2 23 B10R0.71 CCCCCCCCN=C=O Amb3940552 [0,0,0,0,0,0|1,0,1]=2 24 B10R0.71 CCCCCCCCN=C=S Amb6572519 [0,0,0,0,0,0|1,1,1]=3 25 B10R0.71 CCCCCCCCNC=O Amb9787543 [0,0,0,0,0,0|1,0,0]=1 26 B10R0.71 CCCCCCCCOCC Amb9787535 [0,0,0,0,0,0|2,0,1]=3 27 B10R0.71 CCCCCCCCOCCl Amb22230404 [0,0,0,0,0,0|2,0,1]=3 28 B10R0.71 CCCCCCCCSCC Amb17672979 [0,0,0,0,0,0|2,0,1]=3 29 B10R0.71 CCCCCCCNCCC Amb4313521 [0,0,0,0,0,0|2,0,1]=3 30 B10R0.71 CCCCCCCNCCO Amb7809068 [0,0,0,0,0,0|1,0,2]=3 31 B10R0.71 CCCCCCCOCCO Amb8515986 [0,0,0,0,0,0|1,0,2]=3 32 B10R0.71 CCCCCCCSCCN Amb7794934 [0,0,0,0,0,0|2,0,1]=3 33 B10R0.71 CCCCCCCSCCO Amb7968786 [0,0,0,0,0,0|1,0,2]=3 34 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [0,0,0,0,0,0|0,0,2]=2 35 B10R0.71 CCCCCCNCCC#N Amb2688717 [0,0,0,0,0,0|2,0,1]=3 36 B10R0.71 CCCCCCNCCCC Amb6730566 [0,0,0,0,0,0|2,0,1]=3 37 B10R0.71 CCCCCCNCCCN Amb17315272 [0,0,0,0,0,0|2,0,1]=3 38 B10R0.71 CCCCCCNCCCO Amb7758124 [0,0,0,0,0,0|1,0,2]=3 39 B10R0.71 CCCCCCNCCOC Amb7760715 [0,0,0,0,0,0|3,0,0]=3 40 B10R0.71 CCCCCCOCCC#N Amb7792025 [0,0,0,0,0,0|2,0,1]=3 41 B10R0.71 CCCCCCOCCCN Amb7764734 [0,0,0,0,0,0|2,0,1]=3 42 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [0,0,0,0,0,0|0,0,4]=4 43 B10R0.71 CCCCCNCCCCC Amb3941371 [0,0,0,0,0,0|2,0,1]=3 44 B10R0.71 CCCCCNCCCOC Amb6730381 [0,0,0,0,0,0|3,0,0]=3 45 B10R0.71 CCCCCSCCCCC Amb4020127 [0,0,0,0,0,0|2,0,1]=3 46 B10R0.71 CCCCCSCCCCN Amb17500943 [0,0,0,0,0,0|2,0,1]=3 47 B10R0.71 CCCCC\C=C\C=C\C=O Amb8392854 [0,0,0,0,0,0|0,0,4]=4 48 B10R0.71 CCCCC\C=C\CCC=O Amb33512982 [0,0,0,0,0,0|0,0,2]=2 49 B10R0.71 CCCCNCCNCCO Amb32454894 [0,0,0,0,0,0|2,0,2]=4 50 B10R0.71 CCCCNCCOCCO Amb6736236 [0,0,0,0,0,0|2,0,2]=4 51 B10R0.71 CCCCOCCOCCCl Amb8828497 [0,0,0,0,0,0|3,0,1]=4 52 B10R0.71 CCCCOCCOCCN Amb7790849 [0,0,0,0,0,0|3,0,1]=4 53 B10R0.71 CCCCOCCOCCO Amb8513428 [0,0,0,0,0,0|2,0,2]=4 54 B10R0.71 CCCCOCCSCCO Amb9787502 [0,0,0,0,0,0|2,0,2]=4 55 B10R0.71 CCCCSCCOCCN Amb17501984 [0,0,0,0,0,0|3,0,1]=4 56 B10R0.71 CCCCSCCOCCO Amb9786123 [0,0,0,0,0,0|2,0,2]=4 57 B10R0.71 CCCNCCCCCOC Amb18797681 [0,0,0,0,0,0|3,0,0]=3 58 B10R0.71 CCNCCCNCCCO Amb20171980 [0,0,0,0,0,0|2,0,2]=4 59 B10R0.71 CCNCCCNCCOC Amb18797912 [0,0,0,0,0,0|4,0,0]=4 60 B10R0.71 CCOCCCNCCC#N Amb8827837 [0,0,0,0,0,0|3,0,1]=4 61 B10R0.71 CCOCCCNCCCN Amb17315298 [0,0,0,0,0,0|3,0,1]=4 62 B10R0.71 CNCCCNCCCOC Amb20171986 [0,0,0,0,0,0|4,0,0]=4 63 B10R0.71 COCCCNCCCOC Amb17232378 [0,0,0,0,0,0|4,0,0]=4 64 B10R0.71 COCCCOCCCCBr Amb32688353 [0,0,0,0,0,0|3,0,1]=4 65 B10R0.71 COCCCOCCCCCl Amb18184963 [0,0,0,0,0,0|3,0,1]=4 66 B10R0.71 COCCCOCCCOC Amb22348099 [0,0,0,0,0,0|4,0,0]=4 67 B10R0.71 COCCOCCCCCBr Amb32688356 [0,0,0,0,0,0|3,0,1]=4 68 B10R0.71 COCCOCCCCCCl Amb9001656 [0,0,0,0,0,0|3,0,1]=4 69 B10R0.71 COCCOCCOCC=O Amb32668382 [0,0,0,0,0,0|3,0,0]=3 70 B10R0.71 COCOCCCCCCCl Amb22641573 [0,0,0,0,0,0|3,0,1]=4 71 B10R0.71 CSCCCCCCN=C=S Amb32751204 [0,0,0,0,0,0|2,1,1]=4 72 B10R0.71 C\C=C/C\C=C/CCCCC Amb22546768 [0,0,0,0,0,0|1,0,3]=4 73 B10R0.71 C\C=C\C=C\CCCCCC Amb22546597 [0,0,0,0,0,0|1,0,3]=4 74 B10R0.71 C\C=C\CNCCCCCO Amb32454907 [0,0,0,0,0,0|3,0,1]=4 75 B10R0.71 ClCCCCCCCCCCl Amb8513111 [0,0,0,0,0,0|2,0,1]=3 76 B10R0.71 ClCCCCOCCCCCl Amb2700588 [0,0,0,0,0,0|3,0,1]=4 77 B10R0.71 ICCCCCCCCCI Amb20242392 [0,0,0,0,0,0|2,0,1]=3 78 B10R0.71 N#CCCCCCCCCO Amb22641582 [0,0,0,0,0,0|2,0,1]=3 79 B10R0.71 NCCCCCCCCCN Amb8513818 [0,0,0,0,0,0|2,0,1]=3 80 B10R0.71 NCCCCCCCCCO Amb34183942 [0,0,0,0,0,0|1,0,2]=3 81 B10R0.71 NCCCCNCCCCN Amb31031073 [0,0,0,0,0,0|3,0,1]=4 82 B10R0.71 NOCCCCCCCON Amb33483158 [0,0,0,0,0,0|4,0,0]=4 83 B10R0.71 OCCCCCCCCCBr Amb2694968 [0,0,0,0,0,0|1,0,2]=3 84 B10R0.71 OCCCCCCCCCI Amb32410519 [0,0,0,0,0,0|1,0,2]=3 85 B10R0.71 OCCCCCCCCCO Amb2721246 [0,0,0,0,0,0|1,0,2]=3 86 B10R0.71 OCCCCNCCCCO Amb21858890 [0,0,0,0,0,0|2,0,2]=4 87 B10R0.71 OCCCCOCCCCCl Amb32663942 [0,0,0,0,0,0|2,0,2]=4 88 B10R0.71 OCCOCCCCCCCl Amb33719365 [0,0,0,0,0,0|2,0,2]=4 89 B10R0.71 SCCCCCCCCCS Amb8513270 [0,0,0,0,0,0|1,1,1]=3 90 B10R0.71 [N-]=[N+]=NCCCCCCCN Amb34913458 [0,0,0,0,0,0|4,0,0]=4 91 B10R0.71 [N-]=[N+]=NCCCCCCCO Amb34913457 [0,0,0,0,0,0|4,0,0]=4 92 B9R0.45 BrCCCCCCCCBr Amb2725461 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.45 C#CCCCCCCC=C Amb27268975 [1,0,0,0,0,0|0,0,3]=4 94 B9R0.45 C#CCCCCCCCC Amb2721541 [1,0,0,0,0,0|0,0,2]=3 95 B9R0.45 C#CCCCCCCCF Amb27845935 [1,0,0,0,0,0|1,0,2]=4 96 B9R0.45 C#CCCCCCCCN Amb24117276 [1,0,0,0,0,0|1,0,2]=4 97 B9R0.45 C#CCCCCCCCO Amb10563785 [1,0,0,0,0,0|0,0,3]=4 98 B9R0.45 C#CCCCCCCNC Amb28204575 [1,0,0,0,0,0|1,0,2]=4 99 B9R0.45 C#CCCCCCNC=O Amb27214635 [1,0,0,0,0,0|1,0,2]=4 100 B9R0.45 C#CCCCNCCCC Amb27413122 [1,0,0,0,0,0|1,0,2]=4 101 B9R0.45 C#CCCNCCCCC Amb27770336 [1,0,0,0,0,0|1,0,2]=4 102 B9R0.45 C#CCNCCCCCC Amb5262804 [1,0,0,0,0,0|1,0,2]=4 103 B9R0.45 C#CCSCCCCCC Amb28349721 [1,0,0,0,0,0|1,0,2]=4 104 B9R0.45 C=C=CCCCCCCN Amb28188554 [1,0,0,0,0,0|1,0,2]=4 105 B9R0.45 C=C=CCCCCCCO Amb28050724 [1,0,0,0,0,0|1,0,2]=4 106 B9R0.45 C=CCCCCCCC#N Amb6298893 [1,0,0,0,0,0|1,0,2]=4 107 B9R0.45 C=CCCCCCCC=C Amb2721547 [1,0,0,0,0,0|0,0,3]=4 108 B9R0.45 C=CCCCCCCC=O Amb28193259 [1,0,0,0,0,0|0,0,2]=3 109 B9R0.45 C=CCCCCCCCBr Amb19895211 [1,0,0,0,0,0|1,0,1]=3 110 B9R0.45 C=CCCCCCCCC Amb3940503 [1,0,0,0,0,0|0,0,1]=2 111 B9R0.45 C=CCCCCCCCCl Amb6298880 [1,0,0,0,0,0|1,0,1]=3 112 B9R0.45 C=CCCCCCCCN Amb24763980 [1,0,0,0,0,0|1,0,1]=3 113 B9R0.45 C=CCCCCCCCN Amb32653343 [1,0,0,0,0,0|1,0,1]=3 114 B9R0.45 C=CCCCCCCCO Amb22733549 [1,0,0,0,0,0|1,0,1]=3 115 B9R0.45 C=CCCCCCCNC Amb28120535 [1,0,0,0,0,0|1,0,1]=3 116 B9R0.45 C=CCCCCCSCC Amb27396740 [1,0,0,0,0,0|1,0,1]=3 117 B9R0.45 C=CCCCCNCCC Amb26576689 [1,0,0,0,0,0|1,0,1]=3 118 B9R0.45 C=CCCCNCCCC Amb27799206 [1,0,0,0,0,0|1,0,1]=3 119 B9R0.45 C=CCCCNCCNC Amb27466769 [1,0,0,0,0,0|2,0,1]=4 120 B9R0.45 C=CCCCSCCOC Amb27424920 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.45 C=CCCNCCCCC Amb27838999 [1,0,0,0,0,0|1,0,1]=3 122 B9R0.45 C=CCCNCCCCO Amb28141464 [1,0,0,0,0,0|2,0,1]=4 123 B9R0.45 C=CCCNCCCOC Amb28126721 [1,0,0,0,0,0|2,0,1]=4 124 B9R0.45 C=CCCNCCCSC Amb27838985 [1,0,0,0,0,0|2,0,1]=4 125 B9R0.45 C=CCCNCCOCC Amb28126723 [1,0,0,0,0,0|2,0,1]=4 126 B9R0.45 C=CCCOCCCNC Amb27768715 [1,0,0,0,0,0|2,0,1]=4 127 B9R0.45 C=CCCSCCCOC Amb28280277 [1,0,0,0,0,0|2,0,1]=4 128 B9R0.45 C=CCCSCCSCC Amb27197363 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.45 C=CCNCCCCCC Amb7756950 [1,0,0,0,0,0|1,0,1]=3 130 B9R0.45 C=CCNCCCCCF Amb27219940 [1,0,0,0,0,0|2,0,1]=4 131 B9R0.45 C=CCNCCCCNC Amb27251520 [1,0,0,0,0,0|2,0,1]=4 132 B9R0.45 C=CCOCCCCCC Amb17933923 [1,0,0,0,0,0|1,0,1]=3 133 B9R0.45 C=CCOCCCSCC Amb28187852 [1,0,0,0,0,0|2,0,1]=4 134 B9R0.45 C=CCOCCNCCC Amb27866133 [1,0,0,0,0,0|2,0,1]=4 135 B9R0.45 C=CCSCCCCCBr Amb27985767 [1,0,0,0,0,0|2,0,1]=4 136 B9R0.45 C=CCSCCCCCC Amb22733767 [1,0,0,0,0,0|1,0,1]=3 137 B9R0.45 C=CCSCCCCCF Amb28315981 [1,0,0,0,0,0|2,0,1]=4 138 B9R0.45 C=CCSCCCCCN Amb28435037 [1,0,0,0,0,0|2,0,1]=4 139 B9R0.45 C=CCSCCCCCS Amb27828255 [1,0,0,0,0,0|2,0,1]=4 140 B9R0.45 C=CCSCCCCNC Amb28397579 [1,0,0,0,0,0|2,0,1]=4 141 B9R0.45 C=CCSCCCCOC Amb27599202 [1,0,0,0,0,0|2,0,1]=4 142 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [1,0,0,0,0,0|0,0,3]=4 143 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [1,0,0,0,0,0|0,0,3]=4 144 B9R0.45 C=COCCCCCCO Amb26931083 [1,0,0,0,0,0|2,0,1]=4 145 B9R0.45 C=COCCNCCCC Amb28364273 [1,0,0,0,0,0|2,0,1]=4 146 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [1,0,0,0,0,0|0,0,3]=4 147 B9R0.45 CC#CCCCCCC=O Amb28198592 [1,0,0,0,0,0|0,0,2]=3 148 B9R0.45 CC#CCCCCCCC Amb2721539 [1,0,0,0,0,0|0,0,3]=4 149 B9R0.45 CC#CCCCCCCO Amb27478697 [1,0,0,0,0,0|0,0,3]=4 150 B9R0.45 CCC#CCCCCCC Amb2721540 [1,0,0,0,0,0|0,0,3]=4 151 B9R0.45 CCC#CCCCCCO Amb28050678 [1,0,0,0,0,0|0,0,3]=4 152 B9R0.45 CCCC#CCCCCC Amb2721550 [1,0,0,0,0,0|0,0,3]=4 153 B9R0.45 CCCCC#CCCC=O Amb27790685 [1,0,0,0,0,0|0,0,2]=3 154 B9R0.45 CCCCC#CCCCC Amb2721554 [1,0,0,0,0,0|0,0,3]=4 155 B9R0.45 CCCCC#CCCCCl Amb2721557 [1,0,0,0,0,0|1,0,2]=4 156 B9R0.45 CCCCC#CCCCN Amb26348518 [1,0,0,0,0,0|1,0,2]=4 157 B9R0.45 CCCCCC#CCCN Amb25146331 [1,0,0,0,0,0|1,0,2]=4 158 B9R0.45 CCCCCC#CCCO Amb2721746 [1,0,0,0,0,0|0,0,3]=4 159 B9R0.45 CCCCCCC#CCBr Amb26974428 [1,0,0,0,0,0|1,0,2]=4 160 B9R0.45 CCCCCCC#CCN Amb28313948 [1,0,0,0,0,0|1,0,2]=4 161 B9R0.45 CCCCCCC#CCO Amb2721748 [1,0,0,0,0,0|0,0,3]=4 162 B9R0.45 CCCCCCCCC#N Amb7764626 [1,0,0,0,0,0|1,0,1]=3 163 B9R0.45 CCCCCCCCCBr Amb3940224 [1,0,0,0,0,0|1,0,0]=2 164 B9R0.45 CCCCCCCCCC Amb7757835 [1,0,0,0,0,0|0,0,1]=2 165 B9R0.45 CCCCCCCCCCl Amb6652537 [1,0,0,0,0,0|1,0,0]=2 166 B9R0.45 CCCCCCCCCF Amb8515361 [1,0,0,0,0,0|1,0,0]=2 167 B9R0.45 CCCCCCCCCI Amb3940284 [1,0,0,0,0,0|1,0,0]=2 168 B9R0.45 CCCCCCCCCN Amb3987584 [1,0,0,0,0,0|1,0,0]=2 169 B9R0.45 CCCCCCCCCO Amb3940342 [1,0,0,0,0,0|0,0,1]=2 170 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [1,0,0,0,0,0|1,0,0]=2 171 B9R0.45 CCCCCCCCNC Amb7757640 [1,0,0,0,0,0|1,0,1]=3 172 B9R0.45 CCCCCCCCNN Amb7786451 [1,0,0,0,0,0|2,0,0]=3 173 B9R0.45 CCCCCCCCNO Amb28069968 [1,0,0,0,0,0|1,0,1]=3 174 B9R0.45 CCCCCCCCON Amb2818885 [1,0,0,0,0,0|2,0,0]=3 175 B9R0.45 CCCCCCCCSC Amb10553780 [1,0,0,0,0,0|1,0,1]=3 176 B9R0.45 CCCCCCCN=C=O Amb3940866 [1,0,0,0,0,0|1,0,1]=3 177 B9R0.45 CCCCCCCN=C=S Amb6860842 [1,0,0,0,0,0|1,1,1]=4 178 B9R0.45 CCCCCCCN=[N+]=[N-] Amb17939437 [1,0,0,0,0,0|3,0,0]=4 179 B9R0.45 CCCCCCCNC=O Amb27170738 [1,0,0,0,0,0|1,0,0]=2 180 B9R0.45 CCCCCCCOC=O Amb9787223 [1,0,0,0,0,0|1,0,0]=2 181 B9R0.45 CCCCCCCOCC Amb26332517 [1,0,0,0,0,0|1,0,1]=3 182 B9R0.45 CCCCCCCSC#N Amb17939431 [1,0,0,0,0,0|2,0,1]=4 183 B9R0.45 CCCCCCC\C=N\N Amb28193253 [1,0,0,0,0,0|2,0,1]=4 184 B9R0.45 CCCCCCNCCC Amb6730565 [1,0,0,0,0,0|1,0,1]=3 185 B9R0.45 CCCCCCNCCCl Amb27175028 [1,0,0,0,0,0|2,0,0]=3 186 B9R0.45 CCCCCCNCCN Amb33611669 [1,0,0,0,0,0|2,0,0]=3 187 B9R0.45 CCCCCCNCCN Amb9786764 [1,0,0,0,0,0|2,0,0]=3 188 B9R0.45 CCCCCCNCCO Amb2720857 [1,0,0,0,0,0|1,0,1]=3 189 B9R0.45 CCCCCCOCC#N Amb7792031 [1,0,0,0,0,0|2,0,1]=4 190 B9R0.45 CCCCCCOCC=O Amb26624223 [1,0,0,0,0,0|1,0,0]=2 191 B9R0.45 CCCCCCOCCC Amb27838831 [1,0,0,0,0,0|1,0,1]=3 192 B9R0.45 CCCCCCOCCCl Amb8828502 [1,0,0,0,0,0|2,0,0]=3 193 B9R0.45 CCCCCCOCCO Amb9787183 [1,0,0,0,0,0|1,0,1]=3 194 B9R0.45 CCCCCCO\C=C/Cl Amb27984890 [1,0,0,0,0,0|2,0,1]=4 195 B9R0.45 CCCCCCPCCN Amb28121064 [1,0,0,0,0,0|2,0,0]=3 196 B9R0.45 CCCCCCSCCCl Amb22228746 [1,0,0,0,0,0|2,0,0]=3 197 B9R0.45 CCCCCCSCCN Amb7794935 [1,0,0,0,0,0|2,0,0]=3 198 B9R0.45 CCCCCC\C=C/CO Amb10807383 [1,0,0,0,0,0|0,0,3]=4 199 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [1,0,0,0,0,0|0,0,2]=3 200 B9R0.45 CCCCCC\C=C\CO Amb22168300 [1,0,0,0,0,0|0,0,3]=4 201 B9R0.45 CCCCCNCCC#N Amb2690074 [1,0,0,0,0,0|2,0,1]=4 202 B9R0.45 CCCCCNCCCBr Amb27171159 [1,0,0,0,0,0|2,0,0]=3 203 B9R0.45 CCCCCNCCCC Amb6688183 [1,0,0,0,0,0|1,0,1]=3 204 B9R0.45 CCCCCNCCCF Amb27757655 [1,0,0,0,0,0|2,0,0]=3 205 B9R0.45 CCCCCNCCCN Amb17315271 [1,0,0,0,0,0|2,0,0]=3 206 B9R0.45 CCCCCNCCCO Amb6733807 [1,0,0,0,0,0|1,0,1]=3 207 B9R0.45 CCCCCNCCNC Amb2691992 [1,0,0,0,0,0|2,0,1]=4 208 B9R0.45 CCCCCNCCOC Amb6708081 [1,0,0,0,0,0|2,0,1]=4 209 B9R0.45 CCCCCOCCC=O Amb27628424 [1,0,0,0,0,0|1,0,0]=2 210 B9R0.45 CCCCCSCCCF Amb28204722 [1,0,0,0,0,0|2,0,0]=3 211 B9R0.45 CCCCCSCCCN Amb17500694 [1,0,0,0,0,0|2,0,0]=3 212 B9R0.45 CCCCCSCCCO Amb17502837 [1,0,0,0,0,0|1,0,1]=3 213 B9R0.45 CCCCCSCCSC Amb28282346 [1,0,0,0,0,0|2,0,1]=4 214 B9R0.45 CCCCC\C=C/CCBr Amb27781314 [1,0,0,0,0,0|1,0,2]=4 215 B9R0.45 CCCCC\C=C/CCO Amb9825885 [1,0,0,0,0,0|0,0,3]=4 216 B9R0.45 CCCCC\C=C\CCBr Amb27864879 [1,0,0,0,0,0|1,0,2]=4 217 B9R0.45 CCCCC\C=C\CCN Amb25123460 [1,0,0,0,0,0|1,0,2]=4 218 B9R0.45 CCCCC\C=C\CCO Amb27953070 [1,0,0,0,0,0|0,0,3]=4 219 B9R0.45 CCCCNCCCC#N Amb6709574 [1,0,0,0,0,0|2,0,1]=4 220 B9R0.45 CCCCNCCCCBr Amb27403712 [1,0,0,0,0,0|2,0,0]=3 221 B9R0.45 CCCCNCCCNC Amb24502382 [1,0,0,0,0,0|2,0,1]=4 222 B9R0.45 CCCCNCCCOC Amb6730310 [1,0,0,0,0,0|2,0,1]=4 223 B9R0.45 CCCCNCCOCC Amb9241010 [1,0,0,0,0,0|2,0,1]=4 224 B9R0.45 CCCCOCCCC#N Amb8895274 [1,0,0,0,0,0|2,0,1]=4 225 B9R0.45 CCCCOCCCCBr Amb8895240 [1,0,0,0,0,0|2,0,0]=3 226 B9R0.45 CCCCOCCCCCl Amb18798377 [1,0,0,0,0,0|2,0,0]=3 227 B9R0.45 CCCCOCCCCO Amb19375051 [1,0,0,0,0,0|1,0,1]=3 228 B9R0.45 CCCCOCCCON Amb27212384 [1,0,0,0,0,0|3,0,0]=4 229 B9R0.45 CCCCOCCOCC Amb25248413 [1,0,0,0,0,0|2,0,1]=4 230 B9R0.45 CCCCOCCOCCl Amb28399346 [1,0,0,0,0,0|3,0,0]=4 231 B9R0.45 CCCCSCCCCN Amb9480126 [1,0,0,0,0,0|2,0,0]=3 232 B9R0.45 CCCCSCCCCS Amb28206440 [1,0,0,0,0,0|1,1,0]=3 233 B9R0.45 CCCCSCCCOC Amb27651352 [1,0,0,0,0,0|2,0,1]=4 234 B9R0.45 CCCCSCCOCC Amb10669603 [1,0,0,0,0,0|2,0,1]=4 235 B9R0.45 CCCCSSCCCC Amb8513071 [1,0,0,0,0,0|2,0,1]=4 236 B9R0.45 CCCC[Te][Te]CCCC Amb8515301 [1,0,0,0,0,0|2,0,1]=4 237 B9R0.45 CCCC\C=C/CCCC Amb27196227 [1,0,0,0,0,0|0,0,3]=4 238 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [1,0,0,0,0,0|0,0,2]=3 239 B9R0.45 CCCC\C=C\CCCC Amb2721542 [1,0,0,0,0,0|0,0,3]=4 240 B9R0.45 CCCNCCCCCBr Amb27614955 [1,0,0,0,0,0|2,0,0]=3 241 B9R0.45 CCCNCCCCCO Amb17334254 [1,0,0,0,0,0|1,0,1]=3 242 B9R0.45 CCCNCCCCSC Amb18798068 [1,0,0,0,0,0|2,0,1]=4 243 B9R0.45 CCCNCCCSCC Amb18177748 [1,0,0,0,0,0|2,0,1]=4 244 B9R0.45 CCCNCCNCCF Amb27945344 [1,0,0,0,0,0|3,0,0]=4 245 B9R0.45 CCCNCCNCCO Amb24644910 [1,0,0,0,0,0|2,0,1]=4 246 B9R0.45 CCCNCCOCCCl Amb27652262 [1,0,0,0,0,0|3,0,0]=4 247 B9R0.45 CCCNCCOCCF Amb27794080 [1,0,0,0,0,0|3,0,0]=4 248 B9R0.45 CCCNCCOCCO Amb6736235 [1,0,0,0,0,0|2,0,1]=4 249 B9R0.45 CCCNCCSCCN Amb28192624 [1,0,0,0,0,0|3,0,0]=4 250 B9R0.45 CCCOCCCCCBr Amb27494337 [1,0,0,0,0,0|2,0,0]=3 251 B9R0.45 CCCOCCCCCN Amb27869443 [1,0,0,0,0,0|2,0,0]=3 252 B9R0.45 CCCOCCCNC=O Amb27453700 [1,0,0,0,0,0|2,0,0]=3 253 B9R0.45 CCCOCCNCCBr Amb28281047 [1,0,0,0,0,0|3,0,0]=4 254 B9R0.45 CCCOCCOCCC Amb27441214 [1,0,0,0,0,0|2,0,1]=4 255 B9R0.45 CCCOCCOCCO Amb22351569 [1,0,0,0,0,0|2,0,1]=4 256 B9R0.45 CCCSCCCCC#N Amb18178253 [1,0,0,0,0,0|2,0,1]=4 257 B9R0.45 CCCSCCCCCBr Amb27603024 [1,0,0,0,0,0|2,0,0]=3 258 B9R0.45 CCCSCCCCCCl Amb9304986 [1,0,0,0,0,0|2,0,0]=3 259 B9R0.45 CCCSCCCCCS Amb27431515 [1,0,0,0,0,0|1,1,0]=3 260 B9R0.45 CCCSCCNCCN Amb27400239 [1,0,0,0,0,0|3,0,0]=4 261 B9R0.45 CCCSCCNCCO Amb27618844 [1,0,0,0,0,0|2,0,1]=4 262 B9R0.45 CCCSCCOCCCl Amb27764394 [1,0,0,0,0,0|3,0,0]=4 263 B9R0.45 CCCSCCOCCN Amb17501983 [1,0,0,0,0,0|3,0,0]=4 264 B9R0.45 CCCSCCOCCS Amb27833892 [1,0,0,0,0,0|2,1,0]=4 265 B9R0.45 CCCSCCSCCC Amb4019972 [1,0,0,0,0,0|2,0,1]=4 266 B9R0.45 CCCSCCSCCCl Amb28076466 [1,0,0,0,0,0|3,0,0]=4 267 B9R0.45 CCCSCCSCCO Amb27433297 [1,0,0,0,0,0|2,0,1]=4 268 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [1,0,0,0,0,0|0,0,2]=3 269 B9R0.45 CCC\C=C\CCCCC Amb22231673 [1,0,0,0,0,0|0,0,3]=4 270 B9R0.45 CCC\C=C\CCCCN Amb33373745 [1,0,0,0,0,0|1,0,2]=4 271 B9R0.45 CCNCCCCCCN Amb25855319 [1,0,0,0,0,0|2,0,0]=3 272 B9R0.45 CCNCCCCCOC Amb28186272 [1,0,0,0,0,0|2,0,1]=4 273 B9R0.45 CCNCCCCCSC Amb27167121 [1,0,0,0,0,0|2,0,1]=4 274 B9R0.45 CCNCCCCNCC Amb20621746 [1,0,0,0,0,0|2,0,1]=4 275 B9R0.45 CCNCCCNCCBr Amb27411819 [1,0,0,0,0,0|3,0,0]=4 276 B9R0.45 CCNCCCNCCO Amb27770477 [1,0,0,0,0,0|2,0,1]=4 277 B9R0.45 CCNCCCOCCCl Amb28068633 [1,0,0,0,0,0|3,0,0]=4 278 B9R0.45 CCOCCCCCCS Amb27834959 [1,0,0,0,0,0|1,1,0]=3 279 B9R0.45 CCOCCCCNC=O Amb27634560 [1,0,0,0,0,0|2,0,0]=3 280 B9R0.45 CCOCCCCOCC Amb10807403 [1,0,0,0,0,0|2,0,1]=4 281 B9R0.45 CCOCCCNCCBr Amb27822856 [1,0,0,0,0,0|3,0,0]=4 282 B9R0.45 CCOCCCNCCI Amb27393933 [1,0,0,0,0,0|3,0,0]=4 283 B9R0.45 CCOCCCNCCS Amb27412412 [1,0,0,0,0,0|2,1,0]=4 284 B9R0.45 CCOCCCOCCN Amb27849613 [1,0,0,0,0,0|3,0,0]=4 285 B9R0.45 CCOCCNCCCBr Amb28049448 [1,0,0,0,0,0|3,0,0]=4 286 B9R0.45 CCOCCNCCCN Amb27391621 [1,0,0,0,0,0|3,0,0]=4 287 B9R0.45 CCOCCOCCC=O Amb27167183 [1,0,0,0,0,0|2,0,0]=3 288 B9R0.45 CCOCCOCCCBr Amb8828207 [1,0,0,0,0,0|3,0,0]=4 289 B9R0.45 CCOCCOCCCN Amb6246853 [1,0,0,0,0,0|3,0,0]=4 290 B9R0.45 CCOCCSCCCO Amb27830336 [1,0,0,0,0,0|2,0,1]=4 291 B9R0.45 CCOCOCCCCBr Amb28388750 [1,0,0,0,0,0|3,0,0]=4 292 B9R0.45 CCONCCCCCO Amb28245082 [1,0,0,0,0,0|2,0,1]=4 293 B9R0.45 CCSCCCCCCCl Amb18186755 [1,0,0,0,0,0|2,0,0]=3 294 B9R0.45 CCSCCCCSCC Amb4017492 [1,0,0,0,0,0|2,0,1]=4 295 B9R0.45 CCSCCCNCCBr Amb27442249 [1,0,0,0,0,0|3,0,0]=4 296 B9R0.45 CCSCCCNCCCl Amb27982314 [1,0,0,0,0,0|3,0,0]=4 297 B9R0.45 CCSCCCNCCN Amb27669366 [1,0,0,0,0,0|3,0,0]=4 298 B9R0.45 CCSCCNCCCBr Amb27171099 [1,0,0,0,0,0|3,0,0]=4 299 B9R0.45 CCSCCNCCCF Amb27165285 [1,0,0,0,0,0|3,0,0]=4 300 B9R0.45 CCSCCNCCCO Amb27797112 [1,0,0,0,0,0|2,0,1]=4 301 B9R0.45 CCSCCOCCCS Amb27971481 [1,0,0,0,0,0|2,1,0]=4 302 B9R0.45 CCSCCSCCCO Amb27489348 [1,0,0,0,0,0|2,0,1]=4 303 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [1,0,0,0,0,0|1,0,2]=4 304 B9R0.45 CC\C=C\CCCCCC Amb22231672 [1,0,0,0,0,0|0,0,3]=4 305 B9R0.45 CC\N=N\CCCCCO Amb27631929 [1,0,0,0,0,0|2,0,1]=4 306 B9R0.45 CNCCCCCCC#N Amb27192989 [1,0,0,0,0,0|2,0,1]=4 307 B9R0.45 CNCCCCCCNC Amb9826092 [1,0,0,0,0,0|2,0,1]=4 308 B9R0.45 CNCCCCNCCO Amb27630866 [1,0,0,0,0,0|2,0,1]=4 309 B9R0.45 CNCCCNCCCN Amb27617090 [1,0,0,0,0,0|3,0,0]=4 310 B9R0.45 CNCCSCCCCO Amb28193864 [1,0,0,0,0,0|2,0,1]=4 311 B9R0.45 COCCCCCCCCl Amb28066514 [1,0,0,0,0,0|2,0,0]=3 312 B9R0.45 COCCCCCCOC Amb10807404 [1,0,0,0,0,0|2,0,1]=4 313 B9R0.45 COCCCCNCCBr Amb27847371 [1,0,0,0,0,0|3,0,0]=4 314 B9R0.45 COCCCCNCCO Amb28368980 [1,0,0,0,0,0|2,0,1]=4 315 B9R0.45 COCCCCOCCN Amb28047109 [1,0,0,0,0,0|3,0,0]=4 316 B9R0.45 COCCCCSCCN Amb27951686 [1,0,0,0,0,0|3,0,0]=4 317 B9R0.45 COCCCNCCCN Amb17315264 [1,0,0,0,0,0|3,0,0]=4 318 B9R0.45 COCCCNCCCO Amb17308606 [1,0,0,0,0,0|2,0,1]=4 319 B9R0.45 COCCCOCCCN Amb28196278 [1,0,0,0,0,0|3,0,0]=4 320 B9R0.45 COCCCOCCCO Amb20242414 [1,0,0,0,0,0|2,0,1]=4 321 B9R0.45 COCCCSCCCCl Amb27393495 [1,0,0,0,0,0|3,0,0]=4 322 B9R0.45 COCCCSCCCS Amb28058832 [1,0,0,0,0,0|2,1,0]=4 323 B9R0.45 COCCOCCCCBr Amb8855450 [1,0,0,0,0,0|3,0,0]=4 324 B9R0.45 COCCOCCCCCl Amb18798737 [1,0,0,0,0,0|3,0,0]=4 325 B9R0.45 COCCOCCCCN Amb6250163 [1,0,0,0,0,0|3,0,0]=4 326 B9R0.45 COCCSCCCCF Amb28064856 [1,0,0,0,0,0|3,0,0]=4 327 B9R0.45 COCOCCCCCBr Amb27408460 [1,0,0,0,0,0|3,0,0]=4 328 B9R0.45 COCOCCCCCN Amb28291853 [1,0,0,0,0,0|3,0,0]=4 329 B9R0.45 COCOCCCCCO Amb27839456 [1,0,0,0,0,0|2,0,1]=4 330 B9R0.45 CONCCCCCCO Amb27952629 [1,0,0,0,0,0|2,0,1]=4 331 B9R0.45 CO\N=C\CCCCC=O Amb27422978 [1,0,0,0,0,0|2,0,1]=4 332 B9R0.45 CSCCCCCCCN Amb27860341 [1,0,0,0,0,0|2,0,0]=3 333 B9R0.45 CSCCCCCCSC Amb6366244 [1,0,0,0,0,0|2,0,1]=4 334 B9R0.45 CSCCCCCN=C=O Amb27658593 [1,0,0,0,0,0|2,0,1]=4 335 B9R0.45 CSCCCCCNC=O Amb27165514 [1,0,0,0,0,0|2,0,0]=3 336 B9R0.45 CSCCCCNCCF Amb27591973 [1,0,0,0,0,0|3,0,0]=4 337 B9R0.45 CSCCCCNCCN Amb27770492 [1,0,0,0,0,0|3,0,0]=4 338 B9R0.45 CSCCCNCCCBr Amb27235561 [1,0,0,0,0,0|3,0,0]=4 339 B9R0.45 CSCCCSCCCF Amb27171622 [1,0,0,0,0,0|3,0,0]=4 340 B9R0.45 CSCCCSCCCO Amb28132547 [1,0,0,0,0,0|2,0,1]=4 341 B9R0.45 CSCCOCCCCCl Amb28041418 [1,0,0,0,0,0|3,0,0]=4 342 B9R0.45 CSCCOCCCCS Amb27834483 [1,0,0,0,0,0|2,1,0]=4 343 B9R0.45 CSCCSCCCCBr Amb27758249 [1,0,0,0,0,0|3,0,0]=4 344 B9R0.45 CSCCSCCCCS Amb28382933 [1,0,0,0,0,0|2,1,0]=4 345 B9R0.45 C\C=C/CCCCCCC Amb26019969 [1,0,0,0,0,0|1,0,1]=3 346 B9R0.45 C\C=C\CCCCCCO Amb27980554 [1,0,0,0,0,0|0,0,3]=4 347 B9R0.45 C\C=C\CCCCCNC Amb26398871 [1,0,0,0,0,0|2,0,1]=4 348 B9R0.45 C\C=C\CCNCCCC Amb27789929 [1,0,0,0,0,0|2,0,1]=4 349 B9R0.45 ClCCCCCCCCCl Amb2721447 [1,0,0,0,0,0|2,0,0]=3 350 B9R0.45 ClCCCCCCOCCl Amb28126752 [1,0,0,0,0,0|3,0,0]=4 351 B9R0.45 FCCCCCCCCBr Amb27265588 [1,0,0,0,0,0|2,0,0]=3 352 B9R0.45 FCCCCCCCCCl Amb28067739 [1,0,0,0,0,0|2,0,0]=3 353 B9R0.45 FCCCCCCCCF Amb22641491 [1,0,0,0,0,0|2,0,0]=3 354 B9R0.45 FCCCCCNCCCl Amb28126872 [1,0,0,0,0,0|3,0,0]=4 355 B9R0.45 FCCCCCNCCF Amb28069963 [1,0,0,0,0,0|3,0,0]=4 356 B9R0.45 FCCCCCSCCCl Amb28063270 [1,0,0,0,0,0|3,0,0]=4 357 B9R0.45 FCCCCNCCCBr Amb27263407 [1,0,0,0,0,0|3,0,0]=4 358 B9R0.45 FCCCNCCCCBr Amb27199870 [1,0,0,0,0,0|3,0,0]=4 359 B9R0.45 FCCNCCCCCBr Amb27664326 [1,0,0,0,0,0|3,0,0]=4 360 B9R0.45 N#CCCCCCCC=O Amb26516252 [1,0,0,0,0,0|1,0,1]=3 361 B9R0.45 N#CCCCCCCCN Amb27867353 [1,0,0,0,0,0|2,0,1]=4 362 B9R0.45 NCCCCCCCCN Amb8387247 [1,0,0,0,0,0|2,0,0]=3 363 B9R0.45 NCCCCCCCCO Amb24116967 [1,0,0,0,0,0|1,0,1]=3 364 B9R0.45 NCCCCCCNC=O Amb28251393 [1,0,0,0,0,0|2,0,0]=3 365 B9R0.45 NCCCCCNCCCl Amb27804050 [1,0,0,0,0,0|3,0,0]=4 366 B9R0.45 NCCCCCNCCO Amb8394909 [1,0,0,0,0,0|2,0,1]=4 367 B9R0.45 NCCCCCOCCF Amb27242054 [1,0,0,0,0,0|3,0,0]=4 368 B9R0.45 NCCCCNCCCCl Amb24117237 [1,0,0,0,0,0|3,0,0]=4 369 B9R0.45 NCCCCNCCCCl Amb28067741 [1,0,0,0,0,0|3,0,0]=4 370 B9R0.45 NCCCCNCCCF Amb26506888 [1,0,0,0,0,0|3,0,0]=4 371 B9R0.45 NCCCCNCCCN Amb8514497 [1,0,0,0,0,0|3,0,0]=4 372 B9R0.45 NCCCCNCCCO Amb27473423 [1,0,0,0,0,0|2,0,1]=4 373 B9R0.45 NCCCCSCCCO Amb17500966 [1,0,0,0,0,0|2,0,1]=4 374 B9R0.45 NCCCNCCCC=O Amb27489145 [1,0,0,0,0,0|2,0,0]=3 375 B9R0.45 NCCCOCCCCO Amb28454517 [1,0,0,0,0,0|2,0,1]=4 376 B9R0.45 NCCCSCCCCF Amb27770557 [1,0,0,0,0,0|3,0,0]=4 377 B9R0.45 NCCNCCCCCF Amb27661429 [1,0,0,0,0,0|3,0,0]=4 378 B9R0.45 NCCOCCCCCF Amb27660390 [1,0,0,0,0,0|3,0,0]=4 379 B9R0.45 O=C=NCCCCCCO Amb27873254 [1,0,0,0,0,0|2,0,1]=4 380 B9R0.45 O=CCCCCCCC=O Amb27836602 [1,0,0,0,0,0|1,0,1]=3 381 B9R0.45 O=CCCCCCCCF Amb25075653 [1,0,0,0,0,0|1,0,0]=2 382 B9R0.45 O=CCCCCCCCO Amb25765567 [1,0,0,0,0,0|1,0,0]=2 383 B9R0.45 O=CCCCC\C=C\CF Amb27435440 [1,0,0,0,0,0|1,0,2]=4 384 B9R0.45 O=CCOCCOCCO Amb26024891 [1,0,0,0,0,0|3,0,0]=4 385 B9R0.45 OCCCCCCCCBr Amb4296902 [1,0,0,0,0,0|1,0,1]=3 386 B9R0.45 OCCCCCCCCCl Amb6366711 [1,0,0,0,0,0|1,0,1]=3 387 B9R0.45 OCCCCCCCCF Amb25330666 [1,0,0,0,0,0|1,0,1]=3 388 B9R0.45 OCCCCCCCCI Amb32411246 [1,0,0,0,0,0|1,0,1]=3 389 B9R0.45 OCCCCCCCCO Amb8383419 [1,0,0,0,0,0|1,0,1]=3 390 B9R0.45 OCCCCCCCCS Amb28046913 [1,0,0,0,0,0|1,0,1]=3 391 B9R0.45 OCCCCCOCCCl Amb28321747 [1,0,0,0,0,0|2,0,1]=4 392 B9R0.45 OCCCCCOCCO Amb27847385 [1,0,0,0,0,0|2,0,1]=4 393 B9R0.45 OCCCCCSCCO Amb18800854 [1,0,0,0,0,0|2,0,1]=4 394 B9R0.45 OCCCCOCCCO Amb27218138 [1,0,0,0,0,0|2,0,1]=4 395 B9R0.45 OCCCNCCCCF Amb27752581 [1,0,0,0,0,0|2,0,1]=4 396 B9R0.45 OCCCSCCCCF Amb28204584 [1,0,0,0,0,0|2,0,1]=4 397 B9R0.45 OCCCSCCCCS Amb27452872 [1,0,0,0,0,0|2,0,1]=4 398 B9R0.45 OCCNCCCCCF Amb27805496 [1,0,0,0,0,0|2,0,1]=4 399 B9R0.45 [C-]#[N+]CCCOCCCC Amb3973111 [1,0,0,0,0,0|2,0,1]=4 400 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [1,0,0,0,0,0|2,0,0]=3 401 B11R0.3 BrCCCCCCCCCCBr Amb2721556 [0,1,0,0,0,0|1,0,1]=3 402 B11R0.3 C#CCCCCCCCCCC Amb2721432 [0,1,0,0,0,0|1,0,1]=3 403 B11R0.3 C=CCCCCCCCCC=O Amb8513533 [0,1,0,0,0,0|0,0,1]=2 404 B11R0.3 C=CCCCCCCCCCBr Amb2691196 [0,1,0,0,0,0|1,0,0]=2 405 B11R0.3 C=CCCCCCCCCCC Amb3940486 [0,1,0,0,0,0|1,0,0]=2 406 B11R0.3 C=CCCCCCCCCCCl Amb2721562 [0,1,0,0,0,0|1,0,0]=2 407 B11R0.3 C=CCCCCCCCCCN Amb2721533 [0,1,0,0,0,0|1,0,0]=2 408 B11R0.3 C=CCCCCCCCCCO Amb2721673 [0,1,0,0,0,0|1,0,0]=2 409 B11R0.3 CCCCCCCCCCCBr Amb8514664 [0,1,0,0,0,0|1,0,1]=3 410 B11R0.3 CCCCCCCCCCCC Amb8513157 [0,1,0,0,0,0|1,0,1]=3 411 B11R0.3 CCCCCCCCCCCCl Amb9787117 [0,1,0,0,0,0|1,0,1]=3 412 B11R0.3 CCCCCCCCCCCN Amb3941511 [0,1,0,0,0,0|1,0,1]=3 413 B11R0.3 CCCCCCCCCCCO Amb6646062 [0,1,0,0,0,0|0,0,2]=3 414 B11R0.3 CCCCCCCCCCNC Amb33934687 [0,1,0,0,0,0|1,0,1]=3 415 B11R0.3 CCCCCCCCCCNC Amb9787067 [0,1,0,0,0,0|1,0,1]=3 416 B11R0.3 CCCCCCCCCN=C=S Amb2689944 [0,1,0,0,0,0|0,1,1]=3 417 B11R0.3 CCCCCCCCCN=[N+]=[N-] Amb18633019 [0,1,0,0,0,0|2,0,0]=3 418 B11R0.3 CCCCCCCCCNCC Amb7761767 [0,1,0,0,0,0|1,0,1]=3 419 B11R0.3 CCCCCCCCNCCN Amb18794624 [0,1,0,0,0,0|1,0,1]=3 420 B11R0.3 CCCCCCCCNCCN Amb22358941 [0,1,0,0,0,0|1,0,1]=3 421 B11R0.3 CCCCCCCCNCCO Amb7757629 [0,1,0,0,0,0|0,0,2]=3 422 B11R0.3 CCCCCCCCOCCN Amb7790956 [0,1,0,0,0,0|1,0,1]=3 423 B11R0.3 CCCCCCCCOCCO Amb9787110 [0,1,0,0,0,0|0,0,2]=3 424 B11R0.3 CCCCCCCCSCCN Amb7794933 [0,1,0,0,0,0|1,0,1]=3 425 B11R0.3 CCCCCCCCSCCO Amb33531593 [0,1,0,0,0,0|0,0,2]=3 426 B11R0.3 CCCCCCCCSCCS Amb9787630 [0,1,0,0,0,0|0,1,1]=3 427 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [0,1,0,0,0,0|0,0,1]=2 428 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [0,1,0,0,0,0|0,0,2]=3 429 B11R0.3 CCCCCCCNCCCC Amb4313708 [0,1,0,0,0,0|1,0,1]=3 430 B11R0.3 CCCCCCCNCCCN Amb18794637 [0,1,0,0,0,0|1,0,1]=3 431 B11R0.3 CCCCCCCNCCCO Amb4304117 [0,1,0,0,0,0|0,0,2]=3 432 B11R0.3 CCCCCCNCCCCC Amb6656070 [0,1,0,0,0,0|1,0,1]=3 433 B11R0.3 CCCCCCNCCCOC Amb7760836 [0,1,0,0,0,0|2,0,0]=3 434 B11R0.3 CCCCCSCCOCCN Amb17501985 [0,1,0,0,0,0|2,0,1]=4 435 B11R0.3 CCCCNCCCCCOC Amb33133268 [0,1,0,0,0,0|2,0,0]=3 436 B11R0.3 CCCCNCCNCCCC Amb20214589 [0,1,0,0,0,0|2,0,1]=4 437 B11R0.3 CCCCOCCOCCCC Amb22168138 [0,1,0,0,0,0|2,0,1]=4 438 B11R0.3 CCCCOCCOCCOC Amb24059881 [0,1,0,0,0,0|3,0,0]=4 439 B11R0.3 CCCCSCCSCCCC Amb9787613 [0,1,0,0,0,0|2,0,1]=4 440 B11R0.3 CCCC\C=C\CCCCCC Amb22546624 [0,1,0,0,0,0|1,0,2]=4 441 B11R0.3 CCCNCCCOCCOC Amb6734665 [0,1,0,0,0,0|3,0,0]=4 442 B11R0.3 CCCSCCCCSCCC Amb22366042 [0,1,0,0,0,0|2,0,1]=4 443 B11R0.3 CCNCCCCCCNCC Amb22733571 [0,1,0,0,0,0|2,0,1]=4 444 B11R0.3 CCOCCOCCOCC=O Amb32669837 [0,1,0,0,0,0|2,0,0]=3 445 B11R0.3 CCSCCCCCCSCC Amb9786285 [0,1,0,0,0,0|2,0,1]=4 446 B11R0.3 COCCCCCNCCOC Amb18804450 [0,1,0,0,0,0|3,0,0]=4 447 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [0,1,0,0,0,0|1,0,1]=3 448 B11R0.3 ClCCCCCCCCCCCl Amb8514864 [0,1,0,0,0,0|1,0,1]=3 449 B11R0.3 FCCCCCCCCCCF Amb33756851 [0,1,0,0,0,0|1,0,1]=3 450 B11R0.3 ICCCCCCCCCCI Amb10071532 [0,1,0,0,0,0|1,0,1]=3 451 B11R0.3 N#CCCCCCCCCC#N Amb8516779 [0,1,0,0,0,0|1,0,2]=4 452 B11R0.3 NCCCCCCCCCCN Amb33446968 [0,1,0,0,0,0|1,0,1]=3 453 B11R0.3 NCCCCCCCCCCN Amb798005 [0,1,0,0,0,0|1,0,1]=3 454 B11R0.3 NCCCCCCCCCCO Amb17607975 [0,1,0,0,0,0|0,0,2]=3 455 B11R0.3 NNCCCCCCCCNN Amb33339064 [0,1,0,0,0,0|3,0,0]=4 456 B11R0.3 NNCCCCCCCCNN Amb33465519 [0,1,0,0,0,0|3,0,0]=4 457 B11R0.3 NOCCCCCCCCON Amb33465512 [0,1,0,0,0,0|3,0,0]=4 458 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [0,1,0,0,0,0|0,0,0]=1 459 B11R0.3 OCCCCCCCCCCBr Amb2694963 [0,1,0,0,0,0|0,0,2]=3 460 B11R0.3 OCCCCCCCCCCCl Amb10844747 [0,1,0,0,0,0|0,0,2]=3 461 B11R0.3 OCCCCCCCCCCO Amb2721538 [0,1,0,0,0,0|0,0,2]=3 462 B11R0.3 [N-]=[N+]=NCCCCCCCCN Amb34913577 [0,1,0,0,0,0|3,0,0]=4 463 B11R0.3 [N-]=[N+]=NCCCCCCCCN Amb34913580 [0,1,0,0,0,0|3,0,0]=4 464 B11R0.3 [N-]=[N+]=NCCCCCCCCO Amb34913576 [0,1,0,0,0,0|3,0,0]=4 465 B11R0.4 C=CCCCCCC(=O)OCC Amb6298912 [0,1,0,0,0,0|2,0,1]=4 466 B11R0.4 C=COC(=O)CCCCCCC Amb17672562 [0,1,0,0,0,0|2,0,1]=4 467 B11R0.4 CCCCCCCC(O)CCC Amb18803156 [0,1,0,0,0,0|1,0,1]=3 468 B11R0.4 CCCCCCCC(O)CCN Amb32693374 [0,1,0,0,0,0|1,0,1]=3 469 B11R0.4 CCOC(=O)CCCCCC=O Amb8471024 [0,1,0,0,0,0|1,0,1]=3 470 B11R0.40 C=CS(=O)CCCCCCCC Amb1032994 [0,1,0,0,0,0|2,0,0]=3 471 B11R0.40 CCC(C)NCCCCCOC Amb33133265 [0,1,0,0,0,0|3,0,0]=4 472 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [0,1,0,0,0,0|1,0,2]=4 473 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [0,1,0,0,0,0|2,0,1]=4 474 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [0,1,0,0,0,0|2,0,1]=4 475 B11R0.40 CCCCCCCCC(Br)CBr Amb9787331 [0,1,0,0,0,0|1,0,1]=3 476 B11R0.40 CCCCCCCCC(C)CBr Amb32688274 [0,1,0,0,0,0|1,0,1]=3 477 B11R0.40 CCCCCCCCC(C)CCl Amb32688273 [0,1,0,0,0,0|1,0,1]=3 478 B11R0.40 CCCCCCCCC(N)CO Amb22536244 [0,1,0,0,0,0|0,0,2]=3 479 B11R0.40 CCCCCCCCC(O)CO Amb8517521 [0,1,0,0,0,0|0,0,2]=3 480 B11R0.40 CCCCCCCNC(C)CC Amb7794405 [0,1,0,0,0,0|2,0,1]=4 481 B11R0.40 CCCCCCOCC(O)CCl Amb9787121 [0,1,0,0,0,0|2,0,1]=4 482 B11R0.40 CCCCNCCCC(C)OC Amb33133286 [0,1,0,0,0,0|3,0,0]=4 483 B11R0.81 C=CCOC(=O)CCCCCC Amb8514890 [0,1,0,0,0,0|2,0,1]=4 484 B11R0.81 CCCCCCC(C)OCCCl Amb8828496 [0,1,0,0,0,0|2,0,1]=4 485 B11R0.81 CCCCN(C)CCCCCN Amb5357879 [0,1,0,0,0,0|2,0,1]=4 486 B11R0.140 C=CCCCN(C)CCCCN Amb33033519 [0,1,0,0,0,0|3,0,0]=4 487 B11R0.140 C=CCCCN(C)CCCNC Amb33033507 [0,1,0,0,0,0|3,0,0]=4 488 B11R0.140 C=CCCCN(C)CCNCC Amb33033514 [0,1,0,0,0,0|3,0,0]=4 489 B11R0.140 CCCCCC(=O)CCCCC Amb6608883 [0,1,0,0,0,0|1,0,2]=4 490 B11R0.140 CCCCCC(N)CCCCC Amb9620841 [0,1,0,0,0,0|1,0,1]=3 491 B11R0.140 CCCCCC(S)CCCCC Amb32788302 [0,1,0,0,0,0|1,0,1]=3 492 B11R0.140 NCCCCC(F)CCCCN Amb33620813 [0,1,0,0,0,0|2,0,1]=4 493 B11R0.148 C#CCCCCCCCC(=O)O Amb22388895 [0,1,0,0,0,0|0,0,2]=3 494 B11R0.148 C=C(Br)CCCCCCCCC Amb6298936 [0,1,0,0,0,0|1,0,0]=2 495 B11R0.148 C=C(C)CCCCCCCC#N Amb6298909 [0,1,0,0,0,0|1,0,2]=4 496 B11R0.148 C=C(C)CCCCCCCCC Amb6298942 [0,1,0,0,0,0|1,0,0]=2 497 B11R0.148 C=C(Cl)CCCCCCCCC Amb6298930 [0,1,0,0,0,0|1,0,0]=2 498 B11R0.148 C=CCCCCCCCC(=O)O Amb2686677 [0,1,0,0,0,0|0,0,2]=3 499 B11R0.148 C=CCCOCCCCC(=O)O Amb33531508 [0,1,0,0,0,0|1,0,2]=4 500 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [0,1,0,0,0,0|1,0,1]=3 501 B11R0.148 CC(C)CCNCCCCCO Amb17334954 [0,1,0,0,0,0|1,0,2]=4 502 B11R0.148 CC(O)CCCCCCCCO Amb33331053 [0,1,0,0,0,0|0,0,2]=3 503 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [0,1,0,0,0,0|0,0,0]=1 504 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,1,0,0,0,0|0,0,0]=1 505 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [0,1,0,0,0,0|0,0,0]=1 506 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [0,1,0,0,0,0|1,0,1]=3 507 B11R0.148 CCCCCCCCCC(C)N Amb6366423 [0,1,0,0,0,0|1,0,1]=3 508 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [0,1,0,0,0,0|0,0,0]=1 509 B11R0.148 CCCCCCCCCC(N)=S Amb7794719 [0,1,0,0,0,0|0,1,0]=2 510 B11R0.148 CCCCCCCCCS(=O)Cl Amb32720537 [0,1,0,0,0,0|1,0,0]=2 511 B11R0.148 CCCCCCCCCS(=O)[O-] Amb32755589 [0,1,0,0,0,0|1,0,0]=2 512 B11R0.148 CCCCCCCCCS(N)=O Amb32720538 [0,1,0,0,0,0|1,0,0]=2 513 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [0,1,0,0,0,0|1,0,0]=2 514 B11R0.148 CCCCCCCCNC(N)=S Amb1152183 [0,1,0,0,0,0|1,1,0]=3 515 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [0,1,0,0,0,0|1,0,0]=2 516 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [0,1,0,0,0,0|1,0,0]=2 517 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,1,0,0,0,0|1,0,0]=2 518 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,1,0,0,0,0|1,0,0]=2 519 B11R0.148 CCCCCCCNCC(C)C Amb7757190 [0,1,0,0,0,0|2,0,1]=4 520 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [0,1,0,0,0,0|0,0,2]=3 521 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,1,0,0,0,0|1,0,0]=2 522 B11R0.148 CCCCCCNCCC(C)C Amb6620655 [0,1,0,0,0,0|2,0,1]=4 523 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [0,1,0,0,0,0|0,0,2]=3 524 B11R0.148 CCCCC\C=C\COC(C)=O Amb30988128 [0,1,0,0,0,0|1,0,2]=4 525 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [0,1,0,0,0,0|2,0,0]=3 526 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,1,0,0,0,0|1,0,0]=2 527 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [0,1,0,0,0,0|0,0,2]=3 528 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [0,1,0,0,0,0|2,0,0]=3 529 B11R0.148 CCOCCCNCCC(N)=S Amb17315344 [0,1,0,0,0,0|2,1,0]=4 530 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [0,1,0,0,0,0|2,0,0]=3 531 B11R0.148 CCOCCOCCOC(C)=O Amb8514868 [0,1,0,0,0,0|3,0,0]=4 532 B11R0.148 CCOCCOCCOC(N)=O Amb29674648 [0,1,0,0,0,0|3,0,0]=4 533 B11R0.148 CN(C)CCCCCCCCN Amb24117500 [0,1,0,0,0,0|2,0,1]=4 534 B11R0.148 CNCCCNCCCC(=O)O Amb28963363 [0,1,0,0,0,0|2,0,0]=3 535 B11R0.148 CNCCCNCCCC(=O)O Amb33470189 [0,1,0,0,0,0|2,0,0]=3 536 B11R0.148 COCCCCCNCC(C)C Amb18803744 [0,1,0,0,0,0|3,0,0]=4 537 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [0,1,0,0,0,0|2,0,0]=3 538 B11R0.148 COCCOCCOCC(=O)Cl Amb2689123 [0,1,0,0,0,0|3,0,0]=4 539 B11R0.148 COCCOCCOCC(=O)O Amb3940728 [0,1,0,0,0,0|3,0,0]=4 540 B11R0.148 N#CCCCSCCCC(=O)O Amb17504253 [0,1,0,0,0,0|2,0,1]=4 541 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,1,0,0,0,0|2,0,0]=3 542 B11R0.148 NCCOCCOCCC(=O)O Amb18111401 [0,1,0,0,0,0|3,0,0]=4 543 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,1,0,0,0,0|1,0,0]=2 544 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,1,0,0,0,0|1,0,0]=2 545 B11R0.148 O=C(O)CCCCCCN=C=S Amb33471526 [0,1,0,0,0,0|2,0,1]=4 546 B11R0.148 O=C(O)CCOCCOCCBr Amb24057758 [0,1,0,0,0,0|3,0,0]=4 547 B11R0.148 O=C(O)CCOCCOCCO Amb24057823 [0,1,0,0,0,0|3,0,0]=4 548 B11R0.148 O=C=NCCCCCCC(=O)O Amb33471297 [0,1,0,0,0,0|2,0,1]=4 549 B11R0.148 [N-]=[N+]=NCCCCCCC(=O)O Amb22407009 [0,1,0,0,0,0|3,0,0]=4 550 B11R1.4 BrCCCCCC1CCCC1 Amb33005083 [0,0,0,1,0,0|1,0,1]=3 551 B11R1.4 BrCCCCCC1CCCO1 Amb32688248 [0,0,0,1,0,0|1,0,2]=4 552 B11R1.4 BrCCCCCC1CCOC1 Amb32690149 [0,0,0,1,0,0|2,0,1]=4 553 B11R1.4 BrCCCCCN1CCCC1 Amb33005047 [0,0,0,1,0,0|2,0,1]=4 554 B11R1.4 BrCCCCCN1CCCC1 Amb33624785 [0,0,0,1,0,0|2,0,1]=4 555 B11R1.4 BrCCCCOC1CCCC1 Amb8855441 [0,0,0,1,0,0|2,0,1]=4 556 B11R1.4 C#CCCCCC1CCCC1 Amb33380242 [0,0,0,1,0,0|1,0,1]=3 557 B11R1.4 C#CCCCCN1CCCC1 Amb33274873 [0,0,0,1,0,0|2,0,1]=4 558 B11R1.4 C#CCCCNC1CCCC1 Amb27986567 [0,0,0,1,0,0|2,0,1]=4 559 B11R1.4 C#CCCCSC1CCCC1 Amb27818451 [0,0,0,1,0,0|2,0,1]=4 560 B11R1.4 C#CCCNCC1CCCC1 Amb27271558 [0,0,0,1,0,0|2,0,1]=4 561 B11R1.4 C#CCCSCC1CCCC1 Amb27271560 [0,0,0,1,0,0|2,0,1]=4 562 B11R1.4 CCCCCCC1CCCN1 Amb2235790 [0,0,0,1,0,0|1,0,1]=3 563 B11R1.4 CCCCCCC1CCCO1 Amb10558596 [0,0,0,1,0,0|0,0,2]=3 564 B11R1.4 CCCCCNC1CCCC1 Amb6688081 [0,0,0,1,0,0|2,0,1]=4 565 B11R1.4 CCCCNCC1CCCO1 Amb4313709 [0,0,0,1,0,0|1,0,2]=4 566 B11R1.4 CCCCOCC1CCCN1 Amb32430276 [0,0,0,1,0,0|2,0,1]=4 567 B11R1.4 CNCCCCC1CCCC1 Amb33448409 [0,0,0,1,0,0|2,0,0]=3 568 B11R1.4 CNCCCCN1CCCC1 Amb18179689 [0,0,0,1,0,0|3,0,0]=4 569 B11R1.4 COCCCNC1CCCC1 Amb6730167 [0,0,0,1,0,0|3,0,0]=4 570 B11R1.4 CSCCCNC1CCCC1 Amb6719739 [0,0,0,1,0,0|3,0,0]=4 571 B11R1.4 C\C=C\CCNC1CCCC1 Amb27988121 [0,0,0,1,0,0|2,0,1]=4 572 B11R1.4 ClCCCCCC1CCCO1 Amb32688218 [0,0,0,1,0,0|1,0,2]=4 573 B11R1.4 ClCCCCCC1CCOC1 Amb32690148 [0,0,0,1,0,0|2,0,1]=4 574 B11R1.4 ClCCCCOC1CCCC1 Amb18184123 [0,0,0,1,0,0|2,0,1]=4 575 B11R1.4 Cl\C=C\CNCC1CCCC1 Amb27492458 [0,0,0,1,0,0|2,0,1]=4 576 B11R1.4 N#CCCCCC1CCCC1 Amb33374908 [0,0,0,1,0,0|1,0,1]=3 577 B11R1.4 N#CCCCCN1CCCC1 Amb4011625 [0,0,0,1,0,0|2,0,1]=4 578 B11R1.4 N#CCCNCC1CCCC1 Amb8952610 [0,0,0,1,0,0|2,0,1]=4 579 B11R1.4 N#CCCOCC1CCCC1 Amb28386902 [0,0,0,1,0,0|2,0,1]=4 580 B11R1.4 N#CCCSCC1CCCC1 Amb27269543 [0,0,0,1,0,0|2,0,1]=4 581 B11R1.4 NCCCCCC1CCCC1 Amb18200303 [0,0,0,1,0,0|1,0,1]=3 582 B11R1.4 NCCCCCN1CCCC1 Amb22728865 [0,0,0,1,0,0|2,0,1]=4 583 B11R1.4 NCCCCCN1CCCC1 Amb5357881 [0,0,0,1,0,0|2,0,1]=4 584 B11R1.4 NCCCOCC1CCCC1 Amb18797162 [0,0,0,1,0,0|2,0,1]=4 585 B11R1.4 NCCOCCC1CCCC1 Amb33481730 [0,0,0,1,0,0|2,0,1]=4 586 B11R1.4 NOCCCCC1CCCC1 Amb33374554 [0,0,0,1,0,0|2,0,0]=3 587 B11R1.4 NOCCCCN1CCCC1 Amb33225881 [0,0,0,1,0,0|3,0,0]=4 588 B11R1.4 O=C=NCCCC1CCCC1 Amb26083705 [0,0,0,1,0,0|1,0,1]=3 589 B11R1.4 O=C=NCCCN1CCCC1 Amb24750766 [0,0,0,1,0,0|2,0,1]=4 590 B11R1.4 O=C=NCCOC1CCCC1 Amb27269484 [0,0,0,1,0,0|2,0,1]=4 591 B11R1.4 O=CCCCCC1CCCC1 Amb33358714 [0,0,0,1,0,0|0,0,0]=1 592 B11R1.4 O=CCCCCN1CCCC1 Amb33225870 [0,0,0,1,0,0|1,0,0]=2 593 B11R1.4 O=CCOCCC1OCCO1 Amb27828914 [0,0,0,1,0,0|3,0,0]=4 594 B11R1.4 O=CNCCCC1CCCN1 Amb27989289 [0,0,0,1,0,0|2,0,0]=3 595 B11R1.4 O=CNCCCC1CCNC1 Amb27989293 [0,0,0,1,0,0|2,0,0]=3 596 B11R1.4 O=CNCCCN1CCCC1 Amb28386791 [0,0,0,1,0,0|2,0,0]=3 597 B11R1.4 O=CNCCOC1CCCC1 Amb27818501 [0,0,0,1,0,0|2,0,0]=3 598 B11R1.4 O=C\C=C\CCC1CCCC1 Amb33374529 [0,0,0,1,0,0|0,0,2]=3 599 B11R1.4 O=C\C=C\CCN1CCCC1 Amb33275172 [0,0,0,1,0,0|1,0,2]=4 600 B11R1.4 OCCCCCC1CCCC1 Amb33358865 [0,0,0,1,0,0|0,0,2]=3 601 B11R1.4 OCCCCCN1CCCC1 Amb17334420 [0,0,0,1,0,0|1,0,2]=4 602 B11R1.4 OCCCNCC1CCCC1 Amb18177551 [0,0,0,1,0,0|1,0,2]=4 603 B11R1.4 SCCCCCC1CCCC1 Amb33379887 [0,0,0,1,0,0|0,1,1]=3 604 B11R1.4 SCCCCCN1CCCC1 Amb32954137 [0,0,0,1,0,0|1,1,1]=4 605 B11R1.4 [C-]#[N+]CCCCC1CCCC1 Amb33374569 [0,0,0,1,0,0|2,0,0]=3 606 B11R1.4 [C-]#[N+]CCCCN1CCCC1 Amb33275242 [0,0,0,1,0,0|3,0,0]=4 607 B11R1.4 [N-]=[N+]=NCCCC1CCCC1 Amb27673385 [0,0,0,1,0,0|3,0,0]=4 608 B11R1.5 C#CCC1CCCCCC1O Amb18182808 [0,0,0,1,0,0|2,0,1]=4 609 B11R1.5 C#CCN1CCCCCC1=O Amb18177185 [0,0,0,1,0,0|1,0,2]=4 610 B11R1.5 C#CCN1CCCCCC1C Amb27646259 [0,0,0,1,0,0|2,0,1]=4 611 B11R1.5 C#CC[C@@H]1CCCCC[C@H]1O Amb33213413 [0,0,0,1,0,0|2,0,1]=4 612 B11R1.5 C=C1CCCCCC1CCO Amb27829924 [0,0,0,1,0,0|2,0,0]=3 613 B11R1.5 C=CCC1CCCCCC1=O Amb18181756 [0,0,0,1,0,0|0,0,2]=3 614 B11R1.5 C=CCC1CCCCCC1Cl Amb18185761 [0,0,0,1,0,0|2,0,0]=3 615 B11R1.5 C=CCC1CCCCCC1O Amb18182944 [0,0,0,1,0,0|2,0,0]=3 616 B11R1.5 C=CCC1CCCCNC1=O Amb27869951 [0,0,0,1,0,0|1,0,2]=4 617 B11R1.5 C=CCC1OCCCCC1O Amb28350359 [0,0,0,1,0,0|3,0,0]=4 618 B11R1.5 C=CCN1CCCNCC1C Amb18563461 [0,0,0,1,0,0|3,0,0]=4 619 B11R1.5 C=CCN1CCNCCC1C Amb18065436 [0,0,0,1,0,0|3,0,0]=4 620 B11R1.5 C=CCN1CCOCCC1C Amb28206976 [0,0,0,1,0,0|3,0,0]=4 621 B11R1.5 C=CC[C@@H]1CCCCC[C@H]1O Amb25968545 [0,0,0,1,0,0|2,0,0]=3 622 B11R1.5 C=CC[C@@H]1OCCCC[C@@H]1O Amb27213807 [0,0,0,1,0,0|3,0,0]=4 623 B11R1.5 CC1CCCCCC1CCN Amb27639026 [0,0,0,1,0,0|1,0,1]=3 624 B11R1.5 CC1CCCCCN1CCF Amb28187917 [0,0,0,1,0,0|2,0,1]=4 625 B11R1.5 CC1CCCCCN1CCI Amb27840345 [0,0,0,1,0,0|2,0,1]=4 626 B11R1.5 CC1CCSCCN1CC=O Amb27786524 [0,0,0,1,0,0|2,0,0]=3 627 B11R1.5 CC1COCCCN1CC=O Amb28195623 [0,0,0,1,0,0|2,0,0]=3 628 B11R1.5 CCCC1CCCCCC1Br Amb27809042 [0,0,0,1,0,0|1,0,1]=3 629 B11R1.5 CCCC1CCCCCC1Cl Amb28291245 [0,0,0,1,0,0|1,0,1]=3 630 B11R1.5 CCCC1CCCCCC1O Amb18799751 [0,0,0,1,0,0|0,0,2]=3 631 B11R1.5 CCCC1CNCCCN1C Amb27240307 [0,0,0,1,0,0|3,0,0]=4 632 B11R1.5 CCCC1CSCCNC1=O Amb28284783 [0,0,0,1,0,0|2,0,0]=3 633 B11R1.5 CCCC1NCCCNC1=O Amb32719912 [0,0,0,1,0,0|2,0,0]=3 634 B11R1.5 CCCN1CCCNCC1=O Amb22549346 [0,0,0,1,0,0|2,0,0]=3 635 B11R1.5 CCCN1CCNCCC1=O Amb22498695 [0,0,0,1,0,0|2,0,0]=3 636 B11R1.5 CCC[C@@H]1CCCCC[C@H]1O Amb24675468 [0,0,0,1,0,0|0,0,2]=3 637 B11R1.5 CCC[C@H]1NCCCNC1=O Amb32719924 [0,0,0,1,0,0|2,0,0]=3 638 B11R1.5 CCOC1CCCCCC1Br Amb24418269 [0,0,0,1,0,0|2,0,1]=4 639 B11R1.5 CCOC1CCCCCC1I Amb27590958 [0,0,0,1,0,0|2,0,1]=4 640 B11R1.5 CCO[C@@H]1CCCCC[C@H]1N Amb33339088 [0,0,0,1,0,0|2,0,1]=4 641 B11R1.5 CN1CCCCCC1CC#N Amb27441834 [0,0,0,1,0,0|2,0,1]=4 642 B11R1.5 CN1CCCCCC1CCN Amb27264633 [0,0,0,1,0,0|2,0,1]=4 643 B11R1.5 CN1CCCCCC1CCO Amb28126475 [0,0,0,1,0,0|1,0,2]=4 644 B11R1.5 CNCC1CCCCCN1C Amb27239773 [0,0,0,1,0,0|3,0,0]=4 645 B11R1.5 CNCC1OCCCNC1=O Amb28254825 [0,0,0,1,0,0|3,0,0]=4 646 B11R1.5 COCC1CCCCCC1O Amb26871984 [0,0,0,1,0,0|1,0,2]=4 647 B11R1.5 COCC1CCCCNC1=O Amb25093894 [0,0,0,1,0,0|2,0,0]=3 648 B11R1.5 COC[C@@H]1CCCCC[C@H]1O Amb33213541 [0,0,0,1,0,0|1,0,2]=4 649 B11R1.5 CONC1CCCCCC1C Amb35726892 [0,0,0,1,0,0|3,0,0]=4 650 B11R1.5 CONC1CCCCNC1=O Amb28285365 [0,0,0,1,0,0|3,0,0]=4 651 B11R1.5 CSCC1NCCCNC1=O Amb32719915 [0,0,0,1,0,0|3,0,0]=4 652 B11R1.5 C[C@@H]1CCOCC[C@H]1OC=O Amb25257191 [0,0,0,1,0,0|2,0,0]=3 653 B11R1.5 C\C=C\C1CCCCCC1O Amb33213699 [0,0,0,1,0,0|2,0,1]=4 654 B11R1.5 C\C=C\[C@@H]1CCCCC[C@H]1O Amb32950402 [0,0,0,1,0,0|2,0,1]=4 655 B11R1.5 N=C1CCCCCN1CCO Amb27757273 [0,0,0,1,0,0|3,0,0]=4 656 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [0,0,0,1,0,0|1,0,0]=2 657 B11R1.5 NCCC1CCCCCC1F Amb28199101 [0,0,0,1,0,0|2,0,1]=4 658 B11R1.5 NCCC1CCCCCC1O Amb18199945 [0,0,0,1,0,0|1,0,2]=4 659 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [0,0,0,1,0,0|2,0,0]=3 660 B11R1.5 NCCN1CCCCCC1=O Amb6252150 [0,0,0,1,0,0|2,0,0]=3 661 B11R1.5 NCCN1CCCCCC1=O Amb7969849 [0,0,0,1,0,0|2,0,0]=3 662 B11R1.5 O=C1CCCCCC1CCO Amb27395084 [0,0,0,1,0,0|1,0,0]=2 663 B11R1.5 O=C1CCCCCN1CCO Amb9370344 [0,0,0,1,0,0|2,0,0]=3 664 B11R1.5 O=C1CCOCCN1CCBr Amb28460673 [0,0,0,1,0,0|3,0,0]=4 665 B11R1.5 O=C1CCOCCN1CCCl Amb25152267 [0,0,0,1,0,0|3,0,0]=4 666 B11R1.5 O=C1CCOCCN1CCO Amb26605397 [0,0,0,1,0,0|3,0,0]=4 667 B11R1.5 O=C1NCCCCC1CCO Amb26456499 [0,0,0,1,0,0|2,0,0]=3 668 B11R1.5 O=C1NCCCNC1CCF Amb32719944 [0,0,0,1,0,0|3,0,0]=4 669 B11R1.5 O=CCC1OCCCCC1O Amb28350808 [0,0,0,1,0,0|2,0,0]=3 670 B11R1.5 O=COC1CCCCCC1Cl Amb27444181 [0,0,0,1,0,0|2,0,0]=3 671 B11R1.5 OC1CCCCCC1CCF Amb28363868 [0,0,0,1,0,0|1,0,2]=4 672 B11R1.17 C#CCCC1CCCCC1=C Amb27827906 [0,0,0,1,0,0|1,0,2]=4 673 B11R1.17 C#CCCC1CCCCC1Br Amb27805721 [0,0,0,1,0,0|2,0,1]=4 674 B11R1.17 C#CCCC1CCCCC1O Amb24574008 [0,0,0,1,0,0|2,0,1]=4 675 B11R1.17 C#CCCC1CCCCN1C Amb33322460 [0,0,0,1,0,0|2,0,1]=4 676 B11R1.17 C#CCCC1CCCNC1=O Amb27812760 [0,0,0,1,0,0|1,0,2]=4 677 B11R1.17 C#CCCC1CNCCC1=O Amb27973205 [0,0,0,1,0,0|1,0,2]=4 678 B11R1.17 C#CCC[C@@H]1CCCC[C@H]1O Amb27218929 [0,0,0,1,0,0|2,0,1]=4 679 B11R1.17 C=C1CCCCC1CCC=O Amb28239533 [0,0,0,1,0,0|0,0,2]=3 680 B11R1.17 C=C1CCCCC1CCCBr Amb27654983 [0,0,0,1,0,0|2,0,0]=3 681 B11R1.17 C=CCCC1CCCCC1Br Amb28079317 [0,0,0,1,0,0|2,0,0]=3 682 B11R1.17 C=CCCC1CCCCC1O Amb25227048 [0,0,0,1,0,0|2,0,0]=3 683 B11R1.17 C=CCCN1CCNC[C@@H]1C Amb27749883 [0,0,0,1,0,0|3,0,0]=4 684 B11R1.17 C=CCCN1CCNC[C@H]1C Amb27830332 [0,0,0,1,0,0|3,0,0]=4 685 B11R1.17 C=CCCN1CCOCC1C Amb27598401 [0,0,0,1,0,0|3,0,0]=4 686 B11R1.17 C=CCC[C@@H]1CCCC[C@H]1O Amb27793096 [0,0,0,1,0,0|2,0,0]=3 687 B11R1.17 C=CCNC1CCCCC1C Amb4304020 [0,0,0,1,0,0|2,0,0]=3 688 B11R1.17 C=CCNC1CCCCC1N Amb27476204 [0,0,0,1,0,0|3,0,0]=4 689 B11R1.17 C=CCNC1CCCNC1C Amb27436696 [0,0,0,1,0,0|3,0,0]=4 690 B11R1.17 C=CCNC1CCNCC1C Amb27840211 [0,0,0,1,0,0|3,0,0]=4 691 B11R1.17 C=CCN[C@@H]1CCCC[C@@H]1C Amb27633906 [0,0,0,1,0,0|2,0,0]=3 692 B11R1.17 C=CCN[C@@H]1CCCC[C@H]1O Amb25774282 [0,0,0,1,0,0|3,0,0]=4 693 B11R1.17 C=CCN[C@H]1CCCC[C@H]1C Amb27462045 [0,0,0,1,0,0|2,0,0]=3 694 B11R1.17 C=CCOC1CCCCC1Br Amb27176337 [0,0,0,1,0,0|3,0,0]=4 695 B11R1.17 C=CCOC1CCCCC1Cl Amb27617495 [0,0,0,1,0,0|3,0,0]=4 696 B11R1.17 C=CCOC1CCCCC1N Amb27241113 [0,0,0,1,0,0|3,0,0]=4 697 B11R1.17 C=CCO[C@@H]1CCCC[C@@H]1O Amb27211315 [0,0,0,1,0,0|3,0,0]=4 698 B11R1.17 C=CCO[C@@H]1CCCC[C@H]1Br Amb28053494 [0,0,0,1,0,0|3,0,0]=4 699 B11R1.17 C=CCS[C@@H]1CCCC[C@H]1O Amb28139989 [0,0,0,1,0,0|3,0,0]=4 700 B11R1.17 CC1=C(CCC=O)CCCC1 Amb27592943 [0,0,0,1,0,0|0,0,2]=3 701 B11R1.17 CC1=C(CCCN)CCCC1 Amb28140735 [0,0,0,1,0,0|2,0,1]=4 702 B11R1.17 CC1=C(CCCO)CCCC1 Amb28194242 [0,0,0,1,0,0|2,0,1]=4 703 B11R1.17 CC1CCCCC1CCCN Amb28135308 [0,0,0,1,0,0|1,0,1]=3 704 B11R1.17 CC1CCCCC1NCC#N Amb6712600 [0,0,0,1,0,0|2,0,1]=4 705 B11R1.17 CC1CCCCC1NCCBr Amb28319772 [0,0,0,1,0,0|2,0,1]=4 706 B11R1.17 CC1CCCCC1NCCF Amb27413393 [0,0,0,1,0,0|2,0,1]=4 707 B11R1.17 CC1CCCCC1NCCO Amb6712645 [0,0,0,1,0,0|1,0,2]=4 708 B11R1.17 CC1CCCCC1NCCS Amb28293920 [0,0,0,1,0,0|1,1,1]=4 709 B11R1.17 CC1CCCCC1OCC#N Amb6279402 [0,0,0,1,0,0|2,0,1]=4 710 B11R1.17 CC1CCCCC1OCC=O Amb18183071 [0,0,0,1,0,0|1,0,0]=2 711 B11R1.17 CC1CCCCC1OCCBr Amb6255500 [0,0,0,1,0,0|2,0,1]=4 712 B11R1.17 CC1CCCCC1OCCCl Amb8828472 [0,0,0,1,0,0|2,0,1]=4 713 B11R1.17 CC1CCCCC1OCCN Amb9711437 [0,0,0,1,0,0|2,0,1]=4 714 B11R1.17 CC1CCCCC1\C=C\C=O Amb24513220 [0,0,0,1,0,0|0,0,2]=3 715 B11R1.17 CC1CCCCN1CCC#N Amb9727667 [0,0,0,1,0,0|2,0,1]=4 716 B11R1.17 CC1CCCCN1CCCCl Amb17335100 [0,0,0,1,0,0|2,0,1]=4 717 B11R1.17 CC1CCCCN1CCCN Amb3939840 [0,0,0,1,0,0|2,0,1]=4 718 B11R1.17 CC1CCCCN1CCCO Amb3939429 [0,0,0,1,0,0|1,0,2]=4 719 B11R1.17 CC1CCCCN1CCON Amb17104864 [0,0,0,1,0,0|3,0,0]=4 720 B11R1.17 CC1CCCNC1CCCN Amb30007640 [0,0,0,1,0,0|2,0,1]=4 721 B11R1.17 CC1CNCCN1CCC=O Amb27419928 [0,0,0,1,0,0|2,0,0]=3 722 B11R1.17 CC1CSCCN1CCC=O Amb27872905 [0,0,0,1,0,0|2,0,0]=3 723 B11R1.17 CC1NCCCC1CCCN Amb27389996 [0,0,0,1,0,0|2,0,1]=4 724 B11R1.17 CCCCC1CCCCC1=O Amb3940594 [0,0,0,1,0,0|0,0,0]=1 725 B11R1.17 CCCCC1CCCCC1C Amb24484363 [0,0,0,1,0,0|1,0,1]=3 726 B11R1.17 CCCCC1CCCCC1O Amb3354798 [0,0,0,1,0,0|0,0,2]=3 727 B11R1.17 CCCCC1CCCNC1C Amb25989636 [0,0,0,1,0,0|2,0,1]=4 728 B11R1.17 CCCCC1CCNCC1C Amb25096286 [0,0,0,1,0,0|2,0,1]=4 729 B11R1.17 CCCCC1CCNCC1N Amb24566143 [0,0,0,1,0,0|2,0,1]=4 730 B11R1.17 CCCCC1CNCCC1C Amb26512801 [0,0,0,1,0,0|2,0,1]=4 731 B11R1.17 CCCCC1CNCCC1N Amb24565409 [0,0,0,1,0,0|2,0,1]=4 732 B11R1.17 CCCCC1CNCCN1C Amb33428429 [0,0,0,1,0,0|3,0,0]=4 733 B11R1.17 CCCCC1COCCC1Br Amb27235549 [0,0,0,1,0,0|2,0,1]=4 734 B11R1.17 CCCCC1NCCCC1C Amb25690783 [0,0,0,1,0,0|2,0,1]=4 735 B11R1.17 CCCCC1NCCCC1N Amb33500836 [0,0,0,1,0,0|2,0,1]=4 736 B11R1.17 CCCCC1NCCCC1O Amb27176604 [0,0,0,1,0,0|1,0,2]=4 737 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [0,0,0,1,0,0|2,0,0]=3 738 B11R1.17 CCCCC1OCCCC1O Amb27651657 [0,0,0,1,0,0|1,0,2]=4 739 B11R1.17 CCCCN1CCCCC1=S Amb24589190 [0,0,0,1,0,0|1,1,0]=3 740 B11R1.17 CCCCN1CCNCC1=O Amb10607569 [0,0,0,1,0,0|2,0,0]=3 741 B11R1.17 CCCC[C@@H]1CCCC[C@@H]1O Amb25933579 [0,0,0,1,0,0|0,0,2]=3 742 B11R1.17 CCCC[C@@H]1CCCC[C@H]1N Amb28457366 [0,0,0,1,0,0|1,0,1]=3 743 B11R1.17 CCCC[C@@H]1CCCC[C@H]1O Amb26614644 [0,0,0,1,0,0|0,0,2]=3 744 B11R1.17 CCCC[C@@H]1CCNC[C@H]1N Amb28385546 [0,0,0,1,0,0|2,0,1]=4 745 B11R1.17 CCCC[C@@H]1NCCC[C@@H]1C Amb28400060 [0,0,0,1,0,0|2,0,1]=4 746 B11R1.17 CCCC[C@@H]1NCCC[C@@H]1O Amb27965046 [0,0,0,1,0,0|1,0,2]=4 747 B11R1.17 CCCC[C@@H]1OCCC[C@H]1O Amb27852842 [0,0,0,1,0,0|1,0,2]=4 748 B11R1.17 CCCC[C@H]1NCCC[C@@H]1O Amb27213987 [0,0,0,1,0,0|1,0,2]=4 749 B11R1.17 CCCNC1CCCCC1C Amb6261656 [0,0,0,1,0,0|2,0,1]=4 750 B11R1.17 CCCNC1CCCCC1N Amb23559103 [0,0,0,1,0,0|2,0,1]=4 751 B11R1.17 CCCNC1CCCCC1O Amb844924 [0,0,0,1,0,0|1,0,2]=4 752 B11R1.17 CCCNC1CCCCC1S Amb18647769 [0,0,0,1,0,0|1,1,1]=4 753 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1O Amb23263413 [0,0,0,1,0,0|1,0,2]=4 754 B11R1.17 CCCN[C@@H]1CCCC[C@H]1C Amb28051950 [0,0,0,1,0,0|2,0,1]=4 755 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O Amb10608055 [0,0,0,1,0,0|1,0,2]=4 756 B11R1.17 CCCOC1CCCCC1Br Amb26629820 [0,0,0,1,0,0|2,0,1]=4 757 B11R1.17 CCCOC1CCCCC1Cl Amb27454968 [0,0,0,1,0,0|2,0,1]=4 758 B11R1.17 CCCOC1CCCCC1I Amb25893297 [0,0,0,1,0,0|2,0,1]=4 759 B11R1.17 CCCOC1CCCCC1O Amb18183283 [0,0,0,1,0,0|1,0,2]=4 760 B11R1.17 CCCO[C@@H]1CCCC[C@H]1N Amb33744134 [0,0,0,1,0,0|2,0,1]=4 761 B11R1.17 CCCO[C@@H]1CCCC[C@H]1O Amb28319930 [0,0,0,1,0,0|1,0,2]=4 762 B11R1.17 CCCS[C@@H]1CCCC[C@H]1O Amb25699949 [0,0,0,1,0,0|1,0,2]=4 763 B11R1.17 CCCS[C@H]1CCCC[C@@H]1O Amb27822957 [0,0,0,1,0,0|1,0,2]=4 764 B11R1.17 CCC\C=C1/CCCCC1=O Amb3372069 [0,0,0,1,0,0|0,0,2]=3 765 B11R1.17 CCNCC1CCCCC1O Amb18644960 [0,0,0,1,0,0|1,0,2]=4 766 B11R1.17 CCN\C=C1\CCCCC1=O Amb17778149 [0,0,0,1,0,0|1,0,2]=4 767 B11R1.17 CCOCC1CCCCC1=O Amb27399156 [0,0,0,1,0,0|1,0,0]=2 768 B11R1.17 CCOCC1CCCCC1Cl Amb28289871 [0,0,0,1,0,0|2,0,1]=4 769 B11R1.17 CCOCC1CCCCC1O Amb26996081 [0,0,0,1,0,0|1,0,2]=4 770 B11R1.17 CCOC[C@@H]1CCCC[C@H]1O Amb26970539 [0,0,0,1,0,0|1,0,2]=4 771 B11R1.17 CCOC[C@H]1NCCNC1=O Amb28245307 [0,0,0,1,0,0|3,0,0]=4 772 B11R1.17 CCO\C=C1/CCCCC1=O Amb33291262 [0,0,0,1,0,0|1,0,2]=4 773 B11R1.17 CN1CCCCC1CCC#N Amb18125502 [0,0,0,1,0,0|2,0,1]=4 774 B11R1.17 CN1CCCCC1CCC=O Amb33322456 [0,0,0,1,0,0|1,0,0]=2 775 B11R1.17 CN1CCCCC1CCCBr Amb33434051 [0,0,0,1,0,0|2,0,1]=4 776 B11R1.17 CN1CCCCC1CCCCl Amb27635346 [0,0,0,1,0,0|2,0,1]=4 777 B11R1.17 CN1CCCCC1CCCN Amb18830694 [0,0,0,1,0,0|2,0,1]=4 778 B11R1.17 CN1CCCCC1CCCO Amb25846934 [0,0,0,1,0,0|1,0,2]=4 779 B11R1.17 CN1CCCCC1CCCS Amb33322431 [0,0,0,1,0,0|1,1,1]=4 780 B11R1.17 CN1CCCCC1CCNN Amb27184022 [0,0,0,1,0,0|3,0,0]=4 781 B11R1.17 CN1CCCCC1CCON Amb27629492 [0,0,0,1,0,0|3,0,0]=4 782 B11R1.17 CN1CCCCC1CN=C=O Amb26365884 [0,0,0,1,0,0|2,0,1]=4 783 B11R1.17 CN1CCCCC1\C=C\C=O Amb33322714 [0,0,0,1,0,0|1,0,2]=4 784 B11R1.17 CN1CCOCC1CNC=O Amb35666808 [0,0,0,1,0,0|3,0,0]=4 785 B11R1.17 CNCCC1CCCCC1F Amb28135872 [0,0,0,1,0,0|2,0,1]=4 786 B11R1.17 CNCCC1CCCCC1N Amb27776146 [0,0,0,1,0,0|2,0,1]=4 787 B11R1.17 CNCCC1CCCCC1O Amb28077324 [0,0,0,1,0,0|1,0,2]=4 788 B11R1.17 CNCCC1CCCCN1C Amb18989162 [0,0,0,1,0,0|3,0,0]=4 789 B11R1.17 CNCCN1CCCCC1=O Amb10607655 [0,0,0,1,0,0|2,0,0]=3 790 B11R1.17 CNCCN1CCCCC1=O Amb8503381 [0,0,0,1,0,0|2,0,0]=3 791 B11R1.17 CNCCN1CCCCC1C Amb9750162 [0,0,0,1,0,0|3,0,0]=4 792 B11R1.17 CNCCN1CCCNC1=O Amb18994359 [0,0,0,1,0,0|3,0,0]=4 793 B11R1.17 CNCCN1CCCNC1=O Amb32676660 [0,0,0,1,0,0|3,0,0]=4 794 B11R1.17 CNCCN1CCCOC1=O Amb18994355 [0,0,0,1,0,0|3,0,0]=4 795 B11R1.17 CNCCN1CCOCC1=O Amb18255030 [0,0,0,1,0,0|3,0,0]=4 796 B11R1.17 COCCC1CCCCC1Cl Amb18808936 [0,0,0,1,0,0|2,0,1]=4 797 B11R1.17 COCCC1CCCCN1C Amb2694557 [0,0,0,1,0,0|3,0,0]=4 798 B11R1.17 COCCC1CCCNC1=O Amb28313285 [0,0,0,1,0,0|2,0,0]=3 799 B11R1.17 COCCC1COCCC1=O Amb27628599 [0,0,0,1,0,0|2,0,0]=3 800 B11R1.17 COCCC1NCCCC1C Amb35731390 [0,0,0,1,0,0|3,0,0]=4 801 B11R1.17 COCCN1CCNCC1=O Amb18988293 [0,0,0,1,0,0|3,0,0]=4 802 B11R1.17 COCCN1CCNCC1=O Amb22227572 [0,0,0,1,0,0|3,0,0]=4 803 B11R1.17 COCC[C@@H]1CCCC[C@@H]1O Amb27978371 [0,0,0,1,0,0|1,0,2]=4 804 B11R1.17 COCC[C@@H]1CCCC[C@H]1O Amb27197114 [0,0,0,1,0,0|1,0,2]=4 805 B11R1.17 COCC[C@H]1CCCCC1=O Amb27974073 [0,0,0,1,0,0|1,0,0]=2 806 B11R1.17 COCOC1CCCCC1=O Amb27750289 [0,0,0,1,0,0|2,0,0]=3 807 B11R1.17 COCOC1COCCC1=O Amb32674192 [0,0,0,1,0,0|3,0,0]=4 808 B11R1.17 CONCC1CCCCC1C Amb27406145 [0,0,0,1,0,0|3,0,0]=4 809 B11R1.17 CSCCC1CCCNC1=O Amb27949745 [0,0,0,1,0,0|2,0,0]=3 810 B11R1.17 CSCCC1NCCCC1C Amb35670703 [0,0,0,1,0,0|3,0,0]=4 811 B11R1.17 C[C@@H]1CCCCN1CCCN Amb25807782 [0,0,0,1,0,0|2,0,1]=4 812 B11R1.17 C[C@@H]1CCCN[C@@H]1CCCN Amb35682241 [0,0,0,1,0,0|2,0,1]=4 813 B11R1.17 C[C@H]1CCCC[C@H]1OCCO Amb27220257 [0,0,0,1,0,0|1,0,2]=4 814 B11R1.17 C\C=C\CC1CCCCC1Cl Amb28118945 [0,0,0,1,0,0|2,0,1]=4 815 B11R1.17 C\C=C\CC1CCCNC1=O Amb26658441 [0,0,0,1,0,0|1,0,2]=4 816 B11R1.17 N#CCCC1CCCCC1=O Amb2720475 [0,0,0,1,0,0|1,0,1]=3 817 B11R1.17 N#CCCC1CCCCC1O Amb18644585 [0,0,0,1,0,0|2,0,1]=4 818 B11R1.17 N#CCCN1CCCCC1=O Amb6751473 [0,0,0,1,0,0|2,0,1]=4 819 B11R1.17 N#CCC[C@H]1CCCC[C@H]1O Amb27267823 [0,0,0,1,0,0|2,0,1]=4 820 B11R1.17 N=C1CCCCN1CCCF Amb27261618 [0,0,0,1,0,0|3,0,0]=4 821 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [0,0,0,1,0,0|1,0,0]=2 822 B11R1.17 NCCCC1CCCCC1O Amb9783182 [0,0,0,1,0,0|1,0,2]=4 823 B11R1.17 NCCCC1CCCNC1=O Amb27863499 [0,0,0,1,0,0|2,0,0]=3 824 B11R1.17 NCCCN1CCCCC1=O Amb6751261 [0,0,0,1,0,0|2,0,0]=3 825 B11R1.17 NCCCN1CCCNC1=O Amb18987991 [0,0,0,1,0,0|3,0,0]=4 826 B11R1.17 NCCCN1CCNCC1=O Amb28368195 [0,0,0,1,0,0|3,0,0]=4 827 B11R1.17 NCCCN1CCOCC1=O Amb18917091 [0,0,0,1,0,0|3,0,0]=4 828 B11R1.17 NCCC[C@@H]1CCCC[C@H]1O Amb27845404 [0,0,0,1,0,0|1,0,2]=4 829 B11R1.17 NCCSC1COCCC1=O Amb27781923 [0,0,0,1,0,0|3,0,0]=4 830 B11R1.17 N[C@H]1CCCC[C@H]1CCCBr Amb27219876 [0,0,0,1,0,0|2,0,1]=4 831 B11R1.17 O=C1CCCCC1CCCO Amb27481191 [0,0,0,1,0,0|1,0,0]=2 832 B11R1.17 O=C1CCCCN1CCCCl Amb6751295 [0,0,0,1,0,0|2,0,0]=3 833 B11R1.17 O=C1CCCCN1CCCO Amb9370460 [0,0,0,1,0,0|2,0,0]=3 834 B11R1.17 O=C1CCOCC1CCCF Amb27640843 [0,0,0,1,0,0|2,0,0]=3 835 B11R1.17 O=C1CCOCC1CCCO Amb28284744 [0,0,0,1,0,0|2,0,0]=3 836 B11R1.17 O=C1CCSCN1CCCO Amb27652884 [0,0,0,1,0,0|3,0,0]=4 837 B11R1.17 O=C1COCCN1CCCBr Amb26050407 [0,0,0,1,0,0|3,0,0]=4 838 B11R1.17 O=C1COCCN1CCCO Amb26485003 [0,0,0,1,0,0|3,0,0]=4 839 B11R1.17 O=C1NCCCC1CCCO Amb25978142 [0,0,0,1,0,0|2,0,0]=3 840 B11R1.17 O=C1NCCCC1NCCF Amb28341468 [0,0,0,1,0,0|3,0,0]=4 841 B11R1.17 O=C1NCCCC1SCCO Amb27980138 [0,0,0,1,0,0|3,0,0]=4 842 B11R1.17 O=C1NCCCN1CCCF Amb27607289 [0,0,0,1,0,0|3,0,0]=4 843 B11R1.17 O=C1NCCCN1CCCO Amb27254452 [0,0,0,1,0,0|3,0,0]=4 844 B11R1.17 O=C1OCCCC1CCCI Amb27261546 [0,0,0,1,0,0|2,0,0]=3 845 B11R1.17 O=C1OCCCN1CCCO Amb25130885 [0,0,0,1,0,0|3,0,0]=4 846 B11R1.17 O=CC#CC1CCCCC1O Amb27948639 [0,0,0,1,0,0|1,0,2]=4 847 B11R1.17 O=CC#C[C@@H]1CCCC[C@H]1O Amb28052725 [0,0,0,1,0,0|1,0,2]=4 848 B11R1.17 O=CCCC1CCCCC1O Amb27166081 [0,0,0,1,0,0|1,0,0]=2 849 B11R1.17 O=CCCC1CCCOC1=O Amb28320351 [0,0,0,1,0,0|2,0,1]=4 850 B11R1.17 O=CCCN1CCCCC1=O Amb18177406 [0,0,0,1,0,0|2,0,1]=4 851 B11R1.17 O=CNCC1CCCCC1=O Amb28120357 [0,0,0,1,0,0|2,0,1]=4 852 B11R1.17 OCCCC1CCCCC1O Amb27170228 [0,0,0,1,0,0|1,0,2]=4 853 B11R1.17 OCCC[C@@H]1CCCC[C@H]1O Amb27448760 [0,0,0,1,0,0|1,0,2]=4 854 B11R1.17 [C-]#[N+]CCC1CCCCN1C Amb33223889 [0,0,0,1,0,0|3,0,0]=4 855 B11R1.18 C#CCCC1CCCC1C=O Amb27442997 [0,0,0,1,0,0|0,0,2]=3 856 B11R1.18 C#CCC[C@@H]1CCC[C@H]1C=O Amb28143047 [0,0,0,1,0,0|0,0,2]=3 857 B11R1.18 C#CCNC1CCCC1CC Amb27256904 [0,0,0,1,0,0|2,0,1]=4 858 B11R1.18 C=CC1CCCN1CCCC Amb25383205 [0,0,0,1,0,0|2,0,0]=3 859 B11R1.18 C=CCCC1CCCC1NC Amb27271588 [0,0,0,1,0,0|2,0,0]=3 860 B11R1.18 C=CCCN1CCCC1CN Amb27673299 [0,0,0,1,0,0|3,0,0]=4 861 B11R1.18 C=CCCN1CCCC1CO Amb27271574 [0,0,0,1,0,0|3,0,0]=4 862 B11R1.18 C=CCCN1CCC[C@@H]1CO Amb27670886 [0,0,0,1,0,0|3,0,0]=4 863 B11R1.18 C=CCCN1CCC[C@H]1C=O Amb25382181 [0,0,0,1,0,0|1,0,2]=4 864 B11R1.18 C=CCCN1CCC[C@H]1CO Amb27670881 [0,0,0,1,0,0|3,0,0]=4 865 B11R1.18 C=CCNC1CCCC1CCl Amb27492478 [0,0,0,1,0,0|3,0,0]=4 866 B11R1.18 C=CCNC1CCCC1CN Amb27271607 [0,0,0,1,0,0|3,0,0]=4 867 B11R1.18 C=CCNC1CCCC1CO Amb27492472 [0,0,0,1,0,0|3,0,0]=4 868 B11R1.18 C=CCN[C@@H]1CCC[C@H]1OC Amb27271928 [0,0,0,1,0,0|3,0,0]=4 869 B11R1.18 C=CCOC1CCCC1CN Amb27271605 [0,0,0,1,0,0|3,0,0]=4 870 B11R1.18 C=CCSC1CCCC1CN Amb27492187 [0,0,0,1,0,0|3,0,0]=4 871 B11R1.18 C=CCSC1CCCC1NC Amb27492196 [0,0,0,1,0,0|3,0,0]=4 872 B11R1.18 C=C[C@H]1CCC[C@H]1C#CCC Amb28194640 [0,0,0,1,0,0|1,0,2]=4 873 B11R1.18 CCC1CCCC1NCC#N Amb25120542 [0,0,0,1,0,0|2,0,1]=4 874 B11R1.18 CCC1CCCC1NCCF Amb27987646 [0,0,0,1,0,0|2,0,1]=4 875 B11R1.18 CCC1CCCN1CCC#N Amb18791517 [0,0,0,1,0,0|2,0,1]=4 876 B11R1.18 CCC1CCCN1CCCBr Amb27986411 [0,0,0,1,0,0|2,0,1]=4 877 B11R1.18 CCC1CCCN1CCCCl Amb18790722 [0,0,0,1,0,0|2,0,1]=4 878 B11R1.18 CCC1CCCN1CCCN Amb18304548 [0,0,0,1,0,0|2,0,1]=4 879 B11R1.18 CCC1CCCN1CCCO Amb18179765 [0,0,0,1,0,0|1,0,2]=4 880 B11R1.18 CCC1CCCN1CCNC Amb18312335 [0,0,0,1,0,0|3,0,0]=4 881 B11R1.18 CCCCC1CCCC1CC Amb27674064 [0,0,0,1,0,0|1,0,1]=3 882 B11R1.18 CCCCC1CCC\C1=N/N Amb27457271 [0,0,0,1,0,0|2,0,1]=4 883 B11R1.18 CCCCC1OCCC1CN Amb27987725 [0,0,0,1,0,0|2,0,1]=4 884 B11R1.18 CCCCC1OCCC1CO Amb27987731 [0,0,0,1,0,0|1,0,2]=4 885 B11R1.18 CCCCN1CCCC1CCl Amb27269158 [0,0,0,1,0,0|2,0,1]=4 886 B11R1.18 CCCCN1CCCC1CN Amb6673981 [0,0,0,1,0,0|2,0,1]=4 887 B11R1.18 CCCCN1CCCC1CO Amb18799841 [0,0,0,1,0,0|1,0,2]=4 888 B11R1.18 CCCCN1CCC[C@@H]1CN Amb27818752 [0,0,0,1,0,0|2,0,1]=4 889 B11R1.18 CCCCN1CCC[C@@H]1CO Amb27670885 [0,0,0,1,0,0|1,0,2]=4 890 B11R1.18 CCCCN1CCC[C@H]1CN Amb27818751 [0,0,0,1,0,0|2,0,1]=4 891 B11R1.18 CCCCN1CCC[C@H]1CO Amb27670884 [0,0,0,1,0,0|1,0,2]=4 892 B11R1.18 CCCC[C@H]1OCC[C@@H]1C=O Amb24765269 [0,0,0,1,0,0|1,0,0]=2 893 B11R1.18 CCCC[C@H]1OCC[C@H]1C=O Amb24765268 [0,0,0,1,0,0|1,0,0]=2 894 B11R1.18 CCCNC1CCCC1CCl Amb27492475 [0,0,0,1,0,0|2,0,1]=4 895 B11R1.18 CCCNC1CCCC1CN Amb27271606 [0,0,0,1,0,0|2,0,1]=4 896 B11R1.18 CCCNC1CCCC1CO Amb27269399 [0,0,0,1,0,0|1,0,2]=4 897 B11R1.18 CCCNC1CCCC1OC Amb18799825 [0,0,0,1,0,0|3,0,0]=4 898 B11R1.18 CCCSC1CCCC1CN Amb9391524 [0,0,0,1,0,0|2,0,1]=4 899 B11R1.18 CCCSC1CCCC1NC Amb27670962 [0,0,0,1,0,0|3,0,0]=4 900 B11R1.18 CCN1CCCC1CCCBr Amb27670648 [0,0,0,1,0,0|2,0,1]=4 901 B11R1.18 CCN1CCCC1CCCCl Amb27269167 [0,0,0,1,0,0|2,0,1]=4 902 B11R1.18 CCNCC1CCCC1CN Amb27672028 [0,0,0,1,0,0|2,0,1]=4 903 B11R1.18 CCNCC1CCCC1CO Amb27271612 [0,0,0,1,0,0|1,0,2]=4 904 B11R1.18 CCNCC1CCCC1OC Amb28079937 [0,0,0,1,0,0|3,0,0]=4 905 B11R1.18 CCOCC1CCCC1CN Amb27670426 [0,0,0,1,0,0|2,0,1]=4 906 B11R1.18 CCOCC1CCCC1NC Amb27987807 [0,0,0,1,0,0|3,0,0]=4 907 B11R1.18 CC\C=C/[C@@H]1CCO[C@@H]1C=O Amb27234655 [0,0,0,1,0,0|1,0,2]=4 908 B11R1.18 CC\C=C/[C@H]1CCC[C@H]1C=O Amb28122412 [0,0,0,1,0,0|0,0,2]=3 909 B11R1.18 CC\C=C\C1CCOC1C=O Amb28318221 [0,0,0,1,0,0|1,0,2]=4 910 B11R1.18 CNC1CCCC1CCCF Amb27988859 [0,0,0,1,0,0|2,0,1]=4 911 B11R1.18 CNC1CCCC1CCSC Amb27671382 [0,0,0,1,0,0|3,0,0]=4 912 B11R1.18 CNCCC1CCCC1OC Amb28079939 [0,0,0,1,0,0|3,0,0]=4 913 B11R1.18 COC1CCCC1CCC=O Amb28079946 [0,0,0,1,0,0|1,0,0]=2 914 B11R1.18 COC1CCCC1CCCBr Amb28079934 [0,0,0,1,0,0|2,0,1]=4 915 B11R1.18 COC1CCCC1CCCCl Amb28079933 [0,0,0,1,0,0|2,0,1]=4 916 B11R1.18 COC1CCCC1CCCN Amb28079940 [0,0,0,1,0,0|2,0,1]=4 917 B11R1.18 COC1CCCC1CCCO Amb28079932 [0,0,0,1,0,0|1,0,2]=4 918 B11R1.18 COCCN1CCCC1C=O Amb23586304 [0,0,0,1,0,0|2,0,0]=3 919 B11R1.18 CSCCC1CCCC1CN Amb27986374 [0,0,0,1,0,0|2,0,1]=4 920 B11R1.18 C\C=C\CN1CCCC1CC Amb27757138 [0,0,0,1,0,0|2,0,1]=4 921 B11R1.18 OCCC[C@H]1CCC[C@H]1CO Amb27989722 [0,0,0,1,0,0|1,0,2]=4 922 B11R1.18 [C-]#[N+]CCC1CCCC1CF Amb27958562 [0,0,0,1,0,0|3,0,0]=4 923 B11R1.26 C#CC1CCCCCCC1O Amb28065903 [0,0,0,1,0,0|2,0,1]=4 924 B11R1.26 C#C[C@@H]1CCCCCC[C@H]1O Amb27422664 [0,0,0,1,0,0|2,0,1]=4 925 B11R1.26 C=C1CCCCCCC1CO Amb27765896 [0,0,0,1,0,0|2,0,0]=3 926 B11R1.26 C=CC1OCCCCCC1O Amb27219659 [0,0,0,1,0,0|3,0,0]=4 927 B11R1.26 CC1=C(CO)CCCCCC1 Amb28127966 [0,0,0,1,0,0|2,0,1]=4 928 B11R1.26 CCC1CCCCCCC1=O Amb28284886 [0,0,0,1,0,0|0,0,0]=1 929 B11R1.26 CCC1CCCCCCC1O Amb28342347 [0,0,0,1,0,0|0,0,2]=3 930 B11R1.26 CC[C@@H]1CCCCCC[C@H]1O Amb25931014 [0,0,0,1,0,0|0,0,2]=3 931 B11R1.26 CN1CCCCCCC1C#N Amb27215590 [0,0,0,1,0,0|2,0,1]=4 932 B11R1.26 COC1CCCCCCC1Br Amb27480443 [0,0,0,1,0,0|2,0,1]=4 933 B11R1.26 COC1CCCCCCC1Cl Amb27232713 [0,0,0,1,0,0|2,0,1]=4 934 B11R1.26 COC1CCCCCCC1F Amb25309265 [0,0,0,1,0,0|2,0,1]=4 935 B11R1.26 COC1CCCCCCC1I Amb25693588 [0,0,0,1,0,0|2,0,1]=4 936 B11R1.26 C\C=C1\CCCCCCC1=O Amb25967372 [0,0,0,1,0,0|0,0,2]=3 937 B11R1.26 N#CC1CCCCCCC1=O Amb27954163 [0,0,0,1,0,0|1,0,1]=3 938 B11R1.26 N#C[C@@H]1CCCCCC[C@H]1O Amb27422329 [0,0,0,1,0,0|2,0,1]=4 939 B11R1.26 NC1CCCCCCC1CO Amb27798202 [0,0,0,1,0,0|1,0,2]=4 940 B11R1.26 NCC1CCCCCCC1O Amb26386383 [0,0,0,1,0,0|1,0,2]=4 941 B11R1.26 NCN1CCCCCCC1=O Amb28436920 [0,0,0,1,0,0|2,0,0]=3 942 B11R1.26 N\C=C1\CCCCCCC1=O Amb24723926 [0,0,0,1,0,0|1,0,2]=4 943 B11R1.26 O=C1CCCCCCN1CCl Amb8844104 [0,0,0,1,0,0|2,0,0]=3 944 B11R1.26 O=C1CCCCCCN1CO Amb8844103 [0,0,0,1,0,0|2,0,0]=3 945 B11R1.26 O=C1CCCCCC\C1=C/O Amb22520392 [0,0,0,1,0,0|1,0,2]=4 946 B11R1.26 O=C1CCCCCC\C1=C\Cl Amb24519274 [0,0,0,1,0,0|1,0,2]=4 947 B11R1.26 O=C1CCCCCC\C1=C\O Amb24662269 [0,0,0,1,0,0|1,0,2]=4 948 B11R1.26 O=CC1=C(Cl)CCCCCC1 Amb26404217 [0,0,0,1,0,0|1,0,2]=4 949 B11R1.26 O=CC1CCCCCCC1=O Amb27863967 [0,0,0,1,0,0|1,0,1]=3 950 B11R1.26 O=CN1CCCCCCC1=O Amb27200407 [0,0,0,1,0,0|2,0,1]=4 951 B11R1.26 OCC1CCCCCCC1O Amb26612870 [0,0,0,1,0,0|1,0,2]=4 952 B11R1.26 OC[C@H]1CCCCCC[C@@H]1O Amb28292208 [0,0,0,1,0,0|1,0,2]=4 953 B11R1.26 [C-]#[N+][C@@H]1CCCCCC[C@H]1O Amb28345315 [0,0,0,1,0,0|3,0,0]=4 954 B11R1.26 [C-]#[N+][C@H]1CCCCCC[C@@H]1O Amb28455682 [0,0,0,1,0,0|3,0,0]=4 955 B11R1.28 BrCCCCC1CCCCC1 Amb21937167 [0,0,0,1,0,0|1,0,1]=3 956 B11R1.28 BrCCCCC1CCCCO1 Amb32690655 [0,0,0,1,0,0|1,0,2]=4 957 B11R1.28 BrCCCCC1CCNCC1 Amb10602362 [0,0,0,1,0,0|2,0,1]=4 958 B11R1.28 BrCCCCC1CCOCC1 Amb26651654 [0,0,0,1,0,0|2,0,1]=4 959 B11R1.28 BrCCCCN1CCCCC1 Amb27986415 [0,0,0,1,0,0|2,0,1]=4 960 B11R1.28 BrCCCCN1CCCCC1 Amb33624630 [0,0,0,1,0,0|2,0,1]=4 961 B11R1.28 BrCCCOC1CCCCC1 Amb8828202 [0,0,0,1,0,0|2,0,1]=4 962 B11R1.28 C#CCCCC1CCCCC1 Amb24062905 [0,0,0,1,0,0|1,0,1]=3 963 B11R1.28 C#CCCCN1CCCCC1 Amb18113203 [0,0,0,1,0,0|2,0,1]=4 964 B11R1.28 C#CCCNC1CCCCC1 Amb25827979 [0,0,0,1,0,0|2,0,1]=4 965 B11R1.28 C=CCCCC1CCCCC1 Amb24117204 [0,0,0,1,0,0|1,0,0]=2 966 B11R1.28 C=CCCCC1CCCCN1 Amb27271589 [0,0,0,1,0,0|2,0,0]=3 967 B11R1.28 C=CCCCC1OCCCO1 Amb28388099 [0,0,0,1,0,0|3,0,0]=4 968 B11R1.28 C=CCCCN1CCCCC1 Amb27986500 [0,0,0,1,0,0|2,0,0]=3 969 B11R1.28 C=CCCCN1CCCCN1 Amb27671785 [0,0,0,1,0,0|3,0,0]=4 970 B11R1.28 C=CCCCN1CCOCC1 Amb26999414 [0,0,0,1,0,0|3,0,0]=4 971 B11R1.28 C=CCCCN1CCSCC1 Amb27270189 [0,0,0,1,0,0|3,0,0]=4 972 B11R1.28 C=CCCNC1CCCCC1 Amb10559348 [0,0,0,1,0,0|2,0,0]=3 973 B11R1.28 C=CCCNC1CCCNC1 Amb27988126 [0,0,0,1,0,0|3,0,0]=4 974 B11R1.28 C=CCCNC1CCCOC1 Amb27266962 [0,0,0,1,0,0|3,0,0]=4 975 B11R1.28 C=CCCNC1CCCSC1 Amb27988112 [0,0,0,1,0,0|3,0,0]=4 976 B11R1.28 C=CCCNC1CCOCC1 Amb27266955 [0,0,0,1,0,0|3,0,0]=4 977 B11R1.28 C=CCCOC1CCCCO1 Amb9134800 [0,0,0,1,0,0|3,0,0]=4 978 B11R1.28 C=CCCOC1CCCNC1 Amb27266957 [0,0,0,1,0,0|3,0,0]=4 979 B11R1.28 C=CCCOC1CCNCC1 Amb27266956 [0,0,0,1,0,0|3,0,0]=4 980 B11R1.28 C=CCCO[C@H]1CCCNC1 Amb27492038 [0,0,0,1,0,0|3,0,0]=4 981 B11R1.28 C=CCNCC1CCCCC1 Amb6683817 [0,0,0,1,0,0|2,0,0]=3 982 B11R1.28 C=CCNCC1CCCNC1 Amb17232142 [0,0,0,1,0,0|3,0,0]=4 983 B11R1.28 C=CCNCC1CCNCC1 Amb17232140 [0,0,0,1,0,0|3,0,0]=4 984 B11R1.28 C=CCOCC1CCCNC1 Amb19021852 [0,0,0,1,0,0|3,0,0]=4 985 B11R1.28 C=CCOCC1CCCNC1 Amb32412161 [0,0,0,1,0,0|3,0,0]=4 986 B11R1.28 C=CCOCC1CCNCC1 Amb13783512 [0,0,0,1,0,0|3,0,0]=4 987 B11R1.28 C=CCOCC1CCNCC1 Amb21954868 [0,0,0,1,0,0|3,0,0]=4 988 B11R1.28 C=CCSCC1CCCCN1 Amb27492206 [0,0,0,1,0,0|3,0,0]=4 989 B11R1.28 C=CCSCC1CCCNC1 Amb27492202 [0,0,0,1,0,0|3,0,0]=4 990 B11R1.28 C=CCSCC1CCNCC1 Amb27492197 [0,0,0,1,0,0|3,0,0]=4 991 B11R1.28 C=COCCN1CCCCC1 Amb17934202 [0,0,0,1,0,0|3,0,0]=4 992 B11R1.28 C=C\C=C\CC1CCCCC1 Amb28284960 [0,0,0,1,0,0|1,0,2]=4 993 B11R1.28 CCCCCC1CCCCC1 Amb4035883 [0,0,0,1,0,0|1,0,1]=3 994 B11R1.28 CCCCCC1CCCCN1 Amb35745661 [0,0,0,1,0,0|1,0,1]=3 995 B11R1.28 CCCCCC1CCCCN1 Amb3788144 [0,0,0,1,0,0|1,0,1]=3 996 B11R1.28 CCCCCC1CCCNC1 Amb22642855 [0,0,0,1,0,0|2,0,0]=3 997 B11R1.28 CCCCCC1CCCNC1 Amb35745623 [0,0,0,1,0,0|2,0,0]=3 998 B11R1.28 CCCCCC1CCNCC1 Amb3933573 [0,0,0,1,0,0|2,0,1]=4 999 B11R1.28 CCCCCC1CCOCO1 Amb27673274 [0,0,0,1,0,0|1,0,2]=4 1000 B11R1.28 CCCCCC1CNCCN1 Amb26659400 [0,0,0,1,0,0|2,0,1]=4 1001 B11R1.28 CCCCCC1COCCN1 Amb27673037 [0,0,0,1,0,0|2,0,1]=4 1002 B11R1.28 CCCCCC1NCCCS1 Amb27271116 [0,0,0,1,0,0|1,1,1]=4 1003 B11R1.28 CCCCCN1CC=CCC1 Amb28352146 [0,0,0,1,0,0|2,0,1]=4 1004 B11R1.28 CCCCCN1CCCCC1 Amb10573561 [0,0,0,1,0,0|2,0,1]=4 1005 B11R1.28 CCCCCN1CCCCN1 Amb27671793 [0,0,0,1,0,0|2,0,1]=4 1006 B11R1.28 CCCCNC1CCCCC1 Amb33548377 [0,0,0,1,0,0|2,0,1]=4 1007 B11R1.28 CCCCNC1CCCCC1 Amb4313711 [0,0,0,1,0,0|2,0,1]=4 1008 B11R1.28 CCCCNC1CCCSC1 Amb18315275 [0,0,0,1,0,0|3,0,0]=4 1009 B11R1.28 CCCCOC1CCCCO1 Amb33856103 [0,0,0,1,0,0|1,0,2]=4 1010 B11R1.28 CCCCOC1CCCNC1 Amb6701469 [0,0,0,1,0,0|3,0,0]=4 1011 B11R1.28 CCCCO[C@H]1CCCNC1 Amb27492036 [0,0,0,1,0,0|3,0,0]=4 1012 B11R1.28 CCCCSC1CCCCC1 Amb17672783 [0,0,0,1,0,0|2,0,1]=4 1013 B11R1.28 CCCCSC1CCCNC1 Amb18803882 [0,0,0,1,0,0|3,0,0]=4 1014 B11R1.28 CCCNCC1CC=CCC1 Amb6719089 [0,0,0,1,0,0|2,0,1]=4 1015 B11R1.28 CCCNCC1CCC=CO1 Amb18183022 [0,0,0,1,0,0|1,0,2]=4 1016 B11R1.28 CCCNCC1CCCCC1 Amb1042518 [0,0,0,1,0,0|2,0,1]=4 1017 B11R1.28 CCCNCC1CCCCC1 Amb2119490 [0,0,0,1,0,0|2,0,1]=4 1018 B11R1.28 CCCNCC1CCCCO1 Amb9258727 [0,0,0,1,0,0|1,0,2]=4 1019 B11R1.28 CCCNCC1CCCNC1 Amb17232186 [0,0,0,1,0,0|3,0,0]=4 1020 B11R1.28 CCCNCC1CCCOC1 Amb19008394 [0,0,0,1,0,0|3,0,0]=4 1021 B11R1.28 CCCOCC1CCCCN1 Amb18797153 [0,0,0,1,0,0|2,0,1]=4 1022 B11R1.28 CCCOCC1CCCNC1 Amb18797152 [0,0,0,1,0,0|3,0,0]=4 1023 B11R1.28 CCCSCC1CCCCN1 Amb18803880 [0,0,0,1,0,0|2,0,1]=4 1024 B11R1.28 CCCSCC1CCCNC1 Amb18183806 [0,0,0,1,0,0|3,0,0]=4 1025 B11R1.28 CCNCCC1CC=CCC1 Amb32753680 [0,0,0,1,0,0|2,0,1]=4 1026 B11R1.28 CCNCCC1CCCCC1 Amb8853691 [0,0,0,1,0,0|2,0,1]=4 1027 B11R1.28 CCNCCC1CCCCO1 Amb18312531 [0,0,0,1,0,0|1,0,2]=4 1028 B11R1.28 CCNCCC1CCCNC1 Amb18313379 [0,0,0,1,0,0|3,0,0]=4 1029 B11R1.28 CCNCCC1CCCOC1 Amb22411363 [0,0,0,1,0,0|3,0,0]=4 1030 B11R1.28 CCOCCC1CCCCN1 Amb17773408 [0,0,0,1,0,0|2,0,1]=4 1031 B11R1.28 CCOCCC1CCCNC1 Amb19020994 [0,0,0,1,0,0|3,0,0]=4 1032 B11R1.28 CCSCCC1CCCCN1 Amb17503513 [0,0,0,1,0,0|2,0,1]=4 1033 B11R1.28 CCSCCC1CCCCN1 Amb35745722 [0,0,0,1,0,0|2,0,1]=4 1034 B11R1.28 CCSCCC1CCCNC1 Amb18308556 [0,0,0,1,0,0|3,0,0]=4 1035 B11R1.28 CNCCCC1CCCCC1 Amb8853671 [0,0,0,1,0,0|2,0,0]=3 1036 B11R1.28 CNCCCC1CCCCN1 Amb18799769 [0,0,0,1,0,0|2,0,1]=4 1037 B11R1.28 CNCCCC1CCCCO1 Amb27266780 [0,0,0,1,0,0|1,0,2]=4 1038 B11R1.28 CNCCCC1CCCNC1 Amb18182155 [0,0,0,1,0,0|3,0,0]=4 1039 B11R1.28 CNCCCC1CCCOC1 Amb27989561 [0,0,0,1,0,0|3,0,0]=4 1040 B11R1.28 CNCCCC1CCNCC1 Amb18799768 [0,0,0,1,0,0|3,0,0]=4 1041 B11R1.28 CNCCCN1CCCCC1 Amb5380409 [0,0,0,1,0,0|3,0,0]=4 1042 B11R1.28 CNCCSC1C=CCCC1 Amb27674013 [0,0,0,1,0,0|3,0,0]=4 1043 B11R1.28 CNCCSC1CCCCC1 Amb19024678 [0,0,0,1,0,0|3,0,0]=4 1044 B11R1.28 COCCCC1CCCCN1 Amb4304397 [0,0,0,1,0,0|2,0,1]=4 1045 B11R1.28 COCCCC1CCCNC1 Amb4304398 [0,0,0,1,0,0|3,0,0]=4 1046 B11R1.28 COCCCC1CCNCC1 Amb10607554 [0,0,0,1,0,0|3,0,0]=4 1047 B11R1.28 COCCCN1CCCCC1 Amb17232232 [0,0,0,1,0,0|3,0,0]=4 1048 B11R1.28 COCCNC1CCCCC1 Amb6685736 [0,0,0,1,0,0|3,0,0]=4 1049 B11R1.28 CSCCCC1CCCCN1 Amb27271775 [0,0,0,1,0,0|2,0,1]=4 1050 B11R1.28 CSCCCC1CCCNC1 Amb26076166 [0,0,0,1,0,0|3,0,0]=4 1051 B11R1.28 CSCCCC1CCNCC1 Amb27818855 [0,0,0,1,0,0|3,0,0]=4 1052 B11R1.28 CSCCCC1CCOCC1 Amb27271832 [0,0,0,1,0,0|3,0,0]=4 1053 B11R1.28 CSCCCN1CCCCC1 Amb28078020 [0,0,0,1,0,0|3,0,0]=4 1054 B11R1.28 CSCCSC1CCCCC1 Amb27988067 [0,0,0,1,0,0|3,0,0]=4 1055 B11R1.28 C[NH2+]CCCC1CCCCC1 Amb20648432 [0,0,0,1,0,0|2,0,0]=3 1056 B11R1.28 ClCCCCC1CCCCC1 Amb26076997 [0,0,0,1,0,0|1,0,1]=3 1057 B11R1.28 ClCCCCC1CCCCO1 Amb32690653 [0,0,0,1,0,0|1,0,2]=4 1058 B11R1.28 ClCCCCC1CCOCC1 Amb26076983 [0,0,0,1,0,0|2,0,1]=4 1059 B11R1.28 ClCCCCN1CCCCC1 Amb17335097 [0,0,0,1,0,0|2,0,1]=4 1060 B11R1.28 ClCCCNC1CCCCC1 Amb27990124 [0,0,0,1,0,0|2,0,1]=4 1061 B11R1.28 ClCCCOC1CCCCC1 Amb6255056 [0,0,0,1,0,0|2,0,1]=4 1062 B11R1.28 ClCCSCC1CCCCC1 Amb27492366 [0,0,0,1,0,0|2,0,1]=4 1063 B11R1.28 ClCOCCC1CCCCC1 Amb27990056 [0,0,0,1,0,0|2,0,1]=4 1064 B11R1.28 Cl\C=C\CNC1CCCCC1 Amb27485006 [0,0,0,1,0,0|2,0,1]=4 1065 B11R1.28 FCCCCN1CCCCC1 Amb27672958 [0,0,0,1,0,0|2,0,1]=4 1066 B11R1.28 FCCCNC1C=CCCC1 Amb27987678 [0,0,0,1,0,0|3,0,0]=4 1067 B11R1.28 FCCCSC1CCCCC1 Amb27989077 [0,0,0,1,0,0|2,0,1]=4 1068 B11R1.28 FCCSCC1CCCCC1 Amb27271862 [0,0,0,1,0,0|2,0,1]=4 1069 B11R1.28 ICCCCC1CCCCC1 Amb32411024 [0,0,0,1,0,0|1,0,1]=3 1070 B11R1.28 N#CCCCC1CCCCC1 Amb4035890 [0,0,0,1,0,0|1,0,1]=3 1071 B11R1.28 N#CCCCC1CCCCO1 Amb35647727 [0,0,0,1,0,0|2,0,1]=4 1072 B11R1.28 N#CCCCN1CCCCC1 Amb6266057 [0,0,0,1,0,0|2,0,1]=4 1073 B11R1.28 N#CCCNC1CCCCC1 Amb2414042 [0,0,0,1,0,0|2,0,1]=4 1074 B11R1.28 N#CCCOC1CCCCC1 Amb6271869 [0,0,0,1,0,0|2,0,1]=4 1075 B11R1.28 NCCCCC1CC=CCC1 Amb33375582 [0,0,0,1,0,0|2,0,1]=4 1076 B11R1.28 NCCCCC1CCCCC1 Amb17570025 [0,0,0,1,0,0|1,0,1]=3 1077 B11R1.28 NCCCCC1CCCCN1 Amb27272282 [0,0,0,1,0,0|2,0,1]=4 1078 B11R1.28 NCCCCC1CCCCO1 Amb33377397 [0,0,0,1,0,0|1,0,2]=4 1079 B11R1.28 NCCCCC1CCCOC1 Amb26653352 [0,0,0,1,0,0|2,0,1]=4 1080 B11R1.28 NCCCCC1CCCSC1 Amb26076936 [0,0,0,1,0,0|2,0,1]=4 1081 B11R1.28 NCCCCC1CCNCC1 Amb10071400 [0,0,0,1,0,0|2,0,1]=4 1082 B11R1.28 NCCCCC1CCOCC1 Amb26653417 [0,0,0,1,0,0|2,0,1]=4 1083 B11R1.28 NCCCCN1CCCCC1 Amb1094595 [0,0,0,1,0,0|2,0,1]=4 1084 B11R1.28 NCCCNC1CCCCC1 Amb3940354 [0,0,0,1,0,0|2,0,1]=4 1085 B11R1.28 NCCCOC1CCCCC1 Amb1154583 [0,0,0,1,0,0|2,0,1]=4 1086 B11R1.28 NCCCSC1CCCCC1 Amb10608281 [0,0,0,1,0,0|2,0,1]=4 1087 B11R1.28 NCCCSC1CCCCC1 Amb21984186 [0,0,0,1,0,0|2,0,1]=4 1088 B11R1.28 NCCOCC1CCCCC1 Amb19033755 [0,0,0,1,0,0|2,0,1]=4 1089 B11R1.28 NNCCCC1CCCCC1 Amb6248425 [0,0,0,1,0,0|2,0,0]=3 1090 B11R1.28 NNCCCC1CCCCO1 Amb27266779 [0,0,0,1,0,0|3,0,0]=4 1091 B11R1.28 NNCCSC1CCCCC1 Amb27987903 [0,0,0,1,0,0|3,0,0]=4 1092 B11R1.28 NOCCCC1CCCCC1 Amb33422787 [0,0,0,1,0,0|2,0,0]=3 1093 B11R1.28 NOCCCN1CCCCC1 Amb17104871 [0,0,0,1,0,0|3,0,0]=4 1094 B11R1.28 O=C=NCCC1CCCCC1 Amb6272842 [0,0,0,1,0,0|1,0,1]=3 1095 B11R1.28 O=C=NCCC1CCCCO1 Amb25331594 [0,0,0,1,0,0|2,0,1]=4 1096 B11R1.28 O=C=NCCC1CCCOC1 Amb33322546 [0,0,0,1,0,0|2,0,1]=4 1097 B11R1.28 O=C=NCCC1CCCSC1 Amb32726300 [0,0,0,1,0,0|2,0,1]=4 1098 B11R1.28 O=C=NCCC1CCOCC1 Amb25187662 [0,0,0,1,0,0|2,0,1]=4 1099 B11R1.28 O=C=NCCN1CCCCC1 Amb27622522 [0,0,0,1,0,0|2,0,1]=4 1100 B11R1.28 O=CCCC=C1CCCCC1 Amb27441049 [0,0,0,1,0,0|0,0,2]=3 1101 B11R1.28 O=CCCCC1=COCCC1 Amb33424235 [0,0,0,1,0,0|1,0,2]=4 1102 B11R1.28 O=CCCCC1CC=CCC1 Amb33375581 [0,0,0,1,0,0|0,0,2]=3 1103 B11R1.28 O=CCCCC1CCCCC1 Amb26998071 [0,0,0,1,0,0|0,0,0]=1 1104 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [0,0,0,1,0,0|1,0,0]=2 1105 B11R1.28 O=CCCCC1CCCOC1 Amb33323158 [0,0,0,1,0,0|1,0,0]=2 1106 B11R1.28 O=CCCCC1CCCSC1 Amb32726172 [0,0,0,1,0,0|1,0,0]=2 1107 B11R1.28 O=CCCCC1CCOCC1 Amb26076142 [0,0,0,1,0,0|1,0,0]=2 1108 B11R1.28 O=CCCCN1CCOCC1 Amb25385962 [0,0,0,1,0,0|2,0,0]=3 1109 B11R1.28 O=CCCOC1CCCOC1 Amb27673699 [0,0,0,1,0,0|2,0,0]=3 1110 B11R1.28 O=CCOCC1CCOCC1 Amb18797338 [0,0,0,1,0,0|2,0,0]=3 1111 B11R1.28 O=CNCCC1=CCCCC1 Amb2780720 [0,0,0,1,0,0|1,0,2]=4 1112 B11R1.28 O=CNCCC1CCCCC1 Amb28293397 [0,0,0,1,0,0|1,0,0]=2 1113 B11R1.28 O=CNCCN1CCOCC1 Amb33547785 [0,0,0,1,0,0|3,0,0]=4 1114 B11R1.28 O=CN\N=C\C1CCCCC1 Amb28365670 [0,0,0,1,0,0|2,0,1]=4 1115 B11R1.28 O=C\C=C\CC1CCCCC1 Amb33172261 [0,0,0,1,0,0|0,0,2]=3 1116 B11R1.28 OCCCCC1C=CCCO1 Amb27989629 [0,0,0,1,0,0|3,0,0]=4 1117 B11R1.28 OCCCCC1CCCCC1 Amb3939108 [0,0,0,1,0,0|0,0,2]=3 1118 B11R1.28 OCCCCC1CCCCN1 Amb22749320 [0,0,0,1,0,0|1,0,2]=4 1119 B11R1.28 OCCCCC1CCCCO1 Amb26658869 [0,0,0,1,0,0|1,0,2]=4 1120 B11R1.28 OCCCCC1CCCNC1 Amb22749319 [0,0,0,1,0,0|1,0,2]=4 1121 B11R1.28 OCCCCC1CCNCC1 Amb21858465 [0,0,0,1,0,0|1,0,2]=4 1122 B11R1.28 OCCCCC1CCNCC1 Amb21858466 [0,0,0,1,0,0|1,0,2]=4 1123 B11R1.28 OCCCCC1CCOCC1 Amb24750759 [0,0,0,1,0,0|1,0,2]=4 1124 B11R1.28 OCCCCN1CCCCC1 Amb3204765 [0,0,0,1,0,0|1,0,2]=4 1125 B11R1.28 OCCCNC1C=CCCC1 Amb27271277 [0,0,0,1,0,0|3,0,0]=4 1126 B11R1.28 OCCCNC1CCCCC1 Amb35750445 [0,0,0,1,0,0|1,0,2]=4 1127 B11R1.28 OCCCNC1CCCCC1 Amb6733735 [0,0,0,1,0,0|1,0,2]=4 1128 B11R1.28 OCCCOC1CCCCC1 Amb6893051 [0,0,0,1,0,0|1,0,2]=4 1129 B11R1.28 OCCCPC1CCCCC1 Amb27989607 [0,0,0,1,0,0|1,0,2]=4 1130 B11R1.28 OCCNCC1CCCCC1 Amb9203178 [0,0,0,1,0,0|1,0,2]=4 1131 B11R1.28 O\N=C\CCC1CCCCC1 Amb27442803 [0,0,0,1,0,0|1,0,2]=4 1132 B11R1.28 SCCCCC1CCCCC1 Amb33422122 [0,0,0,1,0,0|0,1,1]=3 1133 B11R1.28 SCCCCC1CCOCC1 Amb27670740 [0,0,0,1,0,0|1,1,1]=4 1134 B11R1.28 [C-]#[N+]CCCC1CCCCC1 Amb26448941 [0,0,0,1,0,0|2,0,0]=3 1135 B11R1.28 [N-]=[N+]=NCCC1CCCCC1 Amb26518079 [0,0,0,1,0,0|3,0,0]=4 1136 B11R1.41 C=CC1CCCCN1CC=O Amb27446649 [0,0,0,1,0,0|1,0,2]=4 1137 B11R1.41 C=CC1CCCCN1CCC Amb28453966 [0,0,0,1,0,0|2,0,0]=3 1138 B11R1.41 C=CC1CCCCN1CCI Amb27467164 [0,0,0,1,0,0|3,0,0]=4 1139 B11R1.41 C=CC1CCCCN1CCO Amb27472730 [0,0,0,1,0,0|3,0,0]=4 1140 B11R1.41 C=CC1CNCCC1CCCl Amb27445053 [0,0,0,1,0,0|3,0,0]=4 1141 B11R1.41 C=CCC1CCCCC1NC Amb18993613 [0,0,0,1,0,0|2,0,0]=3 1142 B11R1.41 C=CCC1CCCCN1C=O Amb26366793 [0,0,0,1,0,0|1,0,2]=4 1143 B11R1.41 C=CCN1CCCCC1CO Amb18183002 [0,0,0,1,0,0|3,0,0]=4 1144 B11R1.41 C=COC1CCCCC1CC Amb27757966 [0,0,0,1,0,0|2,0,0]=3 1145 B11R1.41 C=C[C@@H]1CCCC[C@H]1CC=O Amb27447266 [0,0,0,1,0,0|0,0,2]=3 1146 B11R1.41 CCC1CCCCC1CCBr Amb28186141 [0,0,0,1,0,0|1,0,1]=3 1147 B11R1.41 CCC1CCCCC1CCO Amb28186835 [0,0,0,1,0,0|0,0,2]=3 1148 B11R1.41 CCC1CCCCC1N=C=O Amb28347996 [0,0,0,1,0,0|1,0,1]=3 1149 B11R1.41 CCC1CCCCC1NOC Amb27464264 [0,0,0,1,0,0|3,0,0]=4 1150 B11R1.41 CCC1CCCCC1OC=N Amb26009235 [0,0,0,1,0,0|2,0,0]=3 1151 B11R1.41 CCC1CCCCC1OCCl Amb27945645 [0,0,0,1,0,0|2,0,1]=4 1152 B11R1.41 CCC1CCCCN1CC#N Amb1971721 [0,0,0,1,0,0|2,0,1]=4 1153 B11R1.41 CCC1CCCCN1CC#N Amb5837272 [0,0,0,1,0,0|2,0,1]=4 1154 B11R1.41 CCC1CCCCN1CC=O Amb18799608 [0,0,0,1,0,0|1,0,0]=2 1155 B11R1.41 CCC1CCCCN1CCCl Amb17335102 [0,0,0,1,0,0|2,0,1]=4 1156 B11R1.41 CCC1CCCCN1CCN Amb9763887 [0,0,0,1,0,0|2,0,1]=4 1157 B11R1.41 CCC1CCCCN1CCO Amb9370238 [0,0,0,1,0,0|1,0,2]=4 1158 B11R1.41 CCC1COCCN1CC=O Amb18799791 [0,0,0,1,0,0|2,0,0]=3 1159 B11R1.41 CCCC1CCCCC1CN Amb26014918 [0,0,0,1,0,0|1,0,1]=3 1160 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [0,0,0,1,0,0|1,0,0]=2 1161 B11R1.41 CCCC1CCCC\C1=N/O Amb25992585 [0,0,0,1,0,0|1,0,2]=4 1162 B11R1.41 CCCC1COCCC1CN Amb28245486 [0,0,0,1,0,0|2,0,1]=4 1163 B11R1.41 CCCC1COCCC1NC Amb28050864 [0,0,0,1,0,0|3,0,0]=4 1164 B11R1.41 CCCC1NCCCC1CC Amb6666232 [0,0,0,1,0,0|2,0,1]=4 1165 B11R1.41 CCCC1OCCCC1C#N Amb27263516 [0,0,0,1,0,0|2,0,1]=4 1166 B11R1.41 CCCC1OCCCC1C=O Amb28132010 [0,0,0,1,0,0|1,0,0]=2 1167 B11R1.41 CCCN1CCCCC1C#N Amb27872069 [0,0,0,1,0,0|2,0,1]=4 1168 B11R1.41 CCCN1CCCCC1CN Amb6674019 [0,0,0,1,0,0|2,0,1]=4 1169 B11R1.41 CCCN1CCCC[C@@H]1CN Amb33218412 [0,0,0,1,0,0|2,0,1]=4 1170 B11R1.41 CCCN1CCCC[C@H]1CN Amb33218399 [0,0,0,1,0,0|2,0,1]=4 1171 B11R1.41 CCCN1CCCC[C@H]1CO Amb27604762 [0,0,0,1,0,0|1,0,2]=4 1172 B11R1.41 CCN1CCCCC1CC=O Amb27958566 [0,0,0,1,0,0|1,0,0]=2 1173 B11R1.41 CCN1CCCCC1CCBr Amb27765441 [0,0,0,1,0,0|2,0,1]=4 1174 B11R1.41 CCN1CCCCC1CCN Amb18251513 [0,0,0,1,0,0|2,0,1]=4 1175 B11R1.41 CCN1CCCCC1CCO Amb18183195 [0,0,0,1,0,0|1,0,2]=4 1176 B11R1.41 CCN1CCCCC1CNC Amb5493931 [0,0,0,1,0,0|3,0,0]=4 1177 B11R1.41 CCNC1CCCCC1CCl Amb28321031 [0,0,0,1,0,0|2,0,1]=4 1178 B11R1.41 CCNC1CCCCC1SC Amb27490493 [0,0,0,1,0,0|3,0,0]=4 1179 B11R1.41 CCN[C@H]1CCCC[C@@H]1OC Amb28063657 [0,0,0,1,0,0|3,0,0]=4 1180 B11R1.41 CCOC1C=CCCC1C=O Amb27829513 [0,0,0,1,0,0|1,0,2]=4 1181 B11R1.41 CCSC1C=CCCC1C=O Amb27257863 [0,0,0,1,0,0|1,0,2]=4 1182 B11R1.41 CCSC1CCCCC1C=O Amb27431708 [0,0,0,1,0,0|1,0,0]=2 1183 B11R1.41 CC[C@@H]1CCCC[C@H]1CCO Amb28321391 [0,0,0,1,0,0|0,0,2]=3 1184 B11R1.41 CC[C@H]1CNCC[C@@H]1CCO Amb27482650 [0,0,0,1,0,0|1,0,2]=4 1185 B11R1.41 CNCC1CCCCC1CCl Amb27868101 [0,0,0,1,0,0|2,0,1]=4 1186 B11R1.41 CNCC1CCCCC1CO Amb27640096 [0,0,0,1,0,0|1,0,2]=4 1187 B11R1.41 COC1CCCCC1CCBr Amb23538187 [0,0,0,1,0,0|2,0,1]=4 1188 B11R1.41 COC1CCCCC1CCCl Amb27849812 [0,0,0,1,0,0|2,0,1]=4 1189 B11R1.41 COC1CCCCC1N=C=O Amb28325801 [0,0,0,1,0,0|2,0,1]=4 1190 B11R1.41 COC1COCCC1NC=O Amb27847983 [0,0,0,1,0,0|3,0,0]=4 1191 B11R1.41 COCC1CCCCC1CCl Amb27794626 [0,0,0,1,0,0|2,0,1]=4 1192 B11R1.41 COC[C@@H]1CCCC[C@H]1CO Amb17939261 [0,0,0,1,0,0|1,0,2]=4 1193 B11R1.41 CO[C@@H]1CCCC[C@H]1CCO Amb27207783 [0,0,0,1,0,0|1,0,2]=4 1194 B11R1.41 CO[C@H]1CCCC[C@H]1CCCl Amb27632432 [0,0,0,1,0,0|2,0,1]=4 1195 B11R1.41 CSC1CCCCC1N=C=O Amb27591900 [0,0,0,1,0,0|2,0,1]=4 1196 B11R1.41 C\C=C/[C@@H]1CCCC[C@H]1C=O Amb25956926 [0,0,0,1,0,0|0,0,2]=3 1197 B11R1.41 NCCC1CCCCC1CF Amb27967428 [0,0,0,1,0,0|2,0,1]=4 1198 B11R1.41 O=CCN1CCCCC1CO Amb18799800 [0,0,0,1,0,0|2,0,0]=3 1199 B11R1.41 O=CCN1CCSCC1CO Amb28193026 [0,0,0,1,0,0|3,0,0]=4 1200 B11R1.41 O=CC[C@@H]1CCCC[C@@H]1C=O Amb28131369 [0,0,0,1,0,0|1,0,1]=3 1201 B11R1.41 O=CN1CCCCC1CCCl Amb26642972 [0,0,0,1,0,0|2,0,0]=3 1202 B11R1.41 O=CN1CCOCC1CCO Amb35645434 [0,0,0,1,0,0|3,0,0]=4 1203 B11R1.41 O=CNC1CCCCC1CO Amb27235336 [0,0,0,1,0,0|2,0,0]=3 1204 B11R1.41 OCC1CCCCC1CCF Amb27958912 [0,0,0,1,0,0|1,0,2]=4 1205 B11R1.41 OCC[C@@H]1CCCC[C@H]1CO Amb28249036 [0,0,0,1,0,0|1,0,2]=4 1206 B11R1.47 CCCCCCOC1CNC1 Amb18182290 [0,0,0,1,0,0|3,0,0]=4 1207 B11R1.47 OCCCCNCC1CCC1 Amb18182245 [0,0,0,1,0,0|1,0,2]=4 1208 B11R1.51 CCC1CCCCCC1C#N Amb35611345 [0,0,0,1,0,0|1,0,1]=3 1209 B11R1.51 CCC1CCCCCC1C=O Amb35725693 [0,0,0,1,0,0|0,0,0]=1 1210 B11R1.51 CCC1CCCCCC1CBr Amb35721286 [0,0,0,1,0,0|1,0,1]=3 1211 B11R1.51 CCC1CCCCCC1CCl Amb35721285 [0,0,0,1,0,0|1,0,1]=3 1212 B11R1.51 CCC1CCCCCC1CN Amb27977818 [0,0,0,1,0,0|1,0,1]=3 1213 B11R1.51 CCC1CCCCCC1CO Amb35672750 [0,0,0,1,0,0|0,0,2]=3 1214 B11R1.51 CCC1CCCCCC1NN Amb35734051 [0,0,0,1,0,0|2,0,0]=3 1215 B11R1.51 CCC1CCCCCC1NO Amb35725722 [0,0,0,1,0,0|1,0,1]=3 1216 B11R1.51 CCC1CCCCC\C1=N/N Amb35734046 [0,0,0,1,0,0|2,0,1]=4 1217 B11R1.51 CCC1CCCCC\C1=N/O Amb35681163 [0,0,0,1,0,0|1,0,2]=4 1218 B11R1.51 CCN1CCCCCC1C=O Amb28135545 [0,0,0,1,0,0|1,0,0]=2 1219 B11R1.51 CCN1CCCCCC1CO Amb10817345 [0,0,0,1,0,0|1,0,2]=4 1220 B11R1.51 CNC1CCCCCC1C#N Amb18280343 [0,0,0,1,0,0|2,0,1]=4 1221 B11R1.51 COC1CCCCCN1C=O Amb27488557 [0,0,0,1,0,0|2,0,0]=3 1222 B11R1.51 CSC1CCCCCC1CN Amb18281653 [0,0,0,1,0,0|2,0,1]=4 1223 B11R1.51 O=CN1CCCCCC1CO Amb26932888 [0,0,0,1,0,0|2,0,0]=3 1224 B11R1.51 OCC1CCCCCC1CCl Amb27875207 [0,0,0,1,0,0|1,0,2]=4 1225 B11R1.51 OC[C@H]1CCCCC[C@H]1CO Amb22356584 [0,0,0,1,0,0|1,0,2]=4 1226 B11R1.85 ClC1=CCCCCCCC1Cl Amb27858768 [0,0,0,1,0,0|2,0,1]=4 1227 B11R1.85 NC1CCCCCCNC1=O Amb27640572 [0,0,0,1,0,0|2,0,0]=3 1228 B11R1.85 OC1CCCCCCC=C1Br Amb17595969 [0,0,0,1,0,0|2,0,1]=4 1229 B11R1.92 C1CCCCCCCCCC1 Amb25060085 [0,0,0,1,0,0|1,0,1]=3 1230 B11R1.92 C1CCCCCNCCCC1 Amb27462141 [0,0,0,1,0,0|1,0,1]=3 1231 B11R1.92 C1CCNCCCCNCC1 Amb27199700 [0,0,0,1,0,0|2,0,1]=4 1232 B11R1.99 BrCCCCCCCC1CC1 Amb33167094 [0,0,0,1,0,0|1,0,1]=3 1233 B11R1.99 C=CCCCCCCC1CO1 Amb8515343 [0,0,0,1,0,0|2,0,0]=3 1234 B11R1.99 CCCCCCCNC1CC1 Amb7794378 [0,0,0,1,0,0|2,0,1]=4 1235 B11R1.99 CCCCCCOCC1CO1 Amb7761629 [0,0,0,1,0,0|1,0,2]=4 1236 B11R1.99 CCCNCCCCC1CC1 Amb32675851 [0,0,0,1,0,0|2,0,1]=4 1237 B11R1.99 COCCCCCNC1CC1 Amb18797208 [0,0,0,1,0,0|3,0,0]=4 1238 B11R1.99 NCCCCCCCC1CC1 Amb33167099 [0,0,0,1,0,0|1,0,1]=3 1239 B11R1.99 O=CCCCCCCC1CC1 Amb33167104 [0,0,0,1,0,0|0,0,0]=1 1240 B11R1.99 O=CCOCCOCC1CC1 Amb33167107 [0,0,0,1,0,0|2,0,0]=3 1241 B11R1.99 OCCNCCCCC1CC1 Amb32675860 [0,0,0,1,0,0|1,0,2]=4 1242 B11R1.101 BrC1C#CCCCCCCC1 Amb27848975 [0,0,0,1,0,0|2,0,1]=4 1243 B11R1.101 CN1CCCCCNCCC1 Amb32753620 [0,0,0,1,0,0|3,0,0]=4 1244 B11R1.101 CN1CCCCCNCCC1 Amb33038179 [0,0,0,1,0,0|3,0,0]=4 1245 B11R1.101 CN1CCCCNCCCC1 Amb18200074 [0,0,0,1,0,0|3,0,0]=4 1246 B11R1.101 ClC1C=CCCCCCCC1 Amb28285392 [0,0,0,1,0,0|2,0,0]=3 1247 B11R1.101 ClC1CCCCCCCCC1 Amb26603797 [0,0,0,1,0,0|1,0,1]=3 1248 B11R1.101 NC1CCCCCCCCC1 Amb17593887 [0,0,0,1,0,0|1,0,1]=3 1249 B11R1.101 NC1CCCCCCCCC1 Amb29837926 [0,0,0,1,0,0|1,0,1]=3 1250 B11R1.101 O=C1C=CCCCCCCC1 Amb28254479 [0,0,0,1,0,0|0,0,2]=3 1251 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [0,0,0,1,0,0|0,0,2]=3 1252 B11R1.101 O=C1CCC=CCCCCC1 Amb4034899 [0,0,0,1,0,0|0,0,2]=3 1253 B11R1.101 O=C1CCCC=C=CCCC1 Amb27854575 [0,0,0,1,0,0|0,0,3]=4 1254 B11R1.101 O=C1CCCCCCCCC1 Amb2778532 [0,0,0,1,0,0|0,0,0]=1 1255 B11R1.101 O=C1CCCCCCCCN1 Amb4034840 [0,0,0,1,0,0|1,0,0]=2 1256 B11R1.101 O=C1CCNCCCCCN1 Amb32679586 [0,0,0,1,0,0|2,0,0]=3 1257 B11R1.101 O=C1CCNCCOCCN1 Amb32667957 [0,0,0,1,0,0|3,0,0]=4 1258 B11R1.101 O=C1CNCCCCCCN1 Amb28044832 [0,0,0,1,0,0|2,0,0]=3 1259 B11R1.101 OB1CCCCNCCCC1 Amb28326087 [0,0,0,1,0,0|2,0,1]=4 1260 B11R1.101 OC1CCCCCCCCC1 Amb22008249 [0,0,0,1,0,0|0,0,2]=3 1261 B11R1.101 O[C@H]1C#CCCCCCCC1 Amb27833371 [0,0,0,1,0,0|2,0,1]=4 1262 B11R1.101 O[C@H]1C=CCCCCCCC1 Amb28206118 [0,0,0,1,0,0|2,0,0]=3 1263 B11R1.101 S=C1CCCCCCCCN1 Amb27636863 [0,0,0,1,0,0|1,1,0]=3 1264 B11R1.109 C#CCC1CCCC1NCC Amb18181704 [0,0,0,1,0,0|2,0,1]=4 1265 B11R1.109 C=CCC1CCCC1CC=O Amb27986653 [0,0,0,1,0,0|0,0,2]=3 1266 B11R1.109 C=CCN1CCCC1CCBr Amb27987121 [0,0,0,1,0,0|3,0,0]=4 1267 B11R1.109 C=CCN1CCCC1CCO Amb27987145 [0,0,0,1,0,0|3,0,0]=4 1268 B11R1.109 C=CCN1CCCC1CSC Amb27271836 [0,0,0,1,0,0|3,0,0]=4 1269 B11R1.109 CCCC1CCNC1CCO Amb32946581 [0,0,0,1,0,0|1,0,2]=4 1270 B11R1.109 CCCC1COCC1N=C=O Amb35617251 [0,0,0,1,0,0|2,0,1]=4 1271 B11R1.109 CCCC1COCC1NC=O Amb35617215 [0,0,0,1,0,0|2,0,0]=3 1272 B11R1.109 CCCN1CCCC1CCBr Amb27987119 [0,0,0,1,0,0|2,0,1]=4 1273 B11R1.109 CCCN1CCCC1CCCl Amb27987130 [0,0,0,1,0,0|2,0,1]=4 1274 B11R1.109 CCCN1CCCC1CCN Amb27987147 [0,0,0,1,0,0|2,0,1]=4 1275 B11R1.109 CCCN1CCCC1CCO Amb27989578 [0,0,0,1,0,0|1,0,2]=4 1276 B11R1.109 CCCN1CCCC1CNC Amb5493913 [0,0,0,1,0,0|3,0,0]=4 1277 B11R1.109 CCNC1CCCC1CCF Amb27272355 [0,0,0,1,0,0|2,0,1]=4 1278 B11R1.109 CCNC1CCCC1CCO Amb27272356 [0,0,0,1,0,0|1,0,2]=4 1279 B11R1.109 CCNC1CCCC1COC Amb27987808 [0,0,0,1,0,0|3,0,0]=4 1280 B11R1.109 CCSC1CCCC1N=C=O Amb27831071 [0,0,0,1,0,0|2,0,1]=4 1281 B11R1.109 CO\C=C1\CCCC1CC=O Amb26937975 [0,0,0,1,0,0|1,0,2]=4 1282 B11R1.109 NCCC1CCCC1CCN Amb27673469 [0,0,0,1,0,0|2,0,1]=4 1283 B11R1.109 O=CCN1CCCC1CCO Amb27987139 [0,0,0,1,0,0|2,0,0]=3 1284 B11R1.117 BrCCC1CCCCCCC1 Amb27231389 [0,0,0,1,0,0|1,0,1]=3 1285 B11R1.117 Br\C=C\C1CCCCCCC1 Amb33135178 [0,0,0,1,0,0|1,0,1]=3 1286 B11R1.117 C=CCC1=CCCCCCC1 Amb27465994 [0,0,0,1,0,0|1,0,2]=4 1287 B11R1.117 C=CCN1CCCCCCC1 Amb27632227 [0,0,0,1,0,0|2,0,0]=3 1288 B11R1.117 CCCC1CCCCCCN1 Amb27400100 [0,0,0,1,0,0|1,0,1]=3 1289 B11R1.117 CCCN1CCCCCCC1 Amb27176813 [0,0,0,1,0,0|2,0,1]=4 1290 B11R1.117 CCNC1CCCCCCC1 Amb6279427 [0,0,0,1,0,0|2,0,1]=4 1291 B11R1.117 CNCC1C=CCCCCC1 Amb28206523 [0,0,0,1,0,0|2,0,0]=3 1292 B11R1.117 CNCC1CCCCCCC1 Amb19149347 [0,0,0,1,0,0|2,0,0]=3 1293 B11R1.117 ClCCC1CCCCCCC1 Amb27760938 [0,0,0,1,0,0|1,0,1]=3 1294 B11R1.117 N#CCC1CCCCCCC1 Amb25947499 [0,0,0,1,0,0|1,0,1]=3 1295 B11R1.117 N#CCN1CCCCCCC1 Amb6750406 [0,0,0,1,0,0|2,0,1]=4 1296 B11R1.117 NCCC1CCCCCCC1 Amb10607690 [0,0,0,1,0,0|1,0,1]=3 1297 B11R1.117 N\N=C\C1CCCCCCC1 Amb28318593 [0,0,0,1,0,0|2,0,1]=4 1298 B11R1.117 O=C=NC1CCCCCCC1 Amb22362664 [0,0,0,1,0,0|1,0,1]=3 1299 B11R1.117 OCCC1CCCCCCN1 Amb28135445 [0,0,0,1,0,0|1,0,2]=4 1300 B11R1.117 ONCC1CCCCCCC1 Amb28189794 [0,0,0,1,0,0|1,0,1]=3 1301 B11R1.117 S=C=NC1CCCCCCC1 Amb2686647 [0,0,0,1,0,0|1,1,1]=4 1302 B11R1.117 SCCN1CCCCCCC1 Amb27979127 [0,0,0,1,0,0|1,1,1]=4 1303 B11R1.180 C#CCCCC1CCCC1O Amb26560187 [0,0,0,1,0,0|2,0,1]=4 1304 B11R1.180 C#CCCCC1CCCN1C Amb33320359 [0,0,0,1,0,0|2,0,1]=4 1305 B11R1.180 C#CCCCC1COCC1=O Amb35608520 [0,0,0,1,0,0|1,0,2]=4 1306 B11R1.180 C#CCCC[C@@H]1CCC[C@H]1O Amb32945288 [0,0,0,1,0,0|2,0,1]=4 1307 B11R1.180 C#CCNCC1CCCC1C Amb28422485 [0,0,0,1,0,0|2,0,1]=4 1308 B11R1.180 C=CCCCC1CCCC1=O Amb27271584 [0,0,0,1,0,0|0,0,2]=3 1309 B11R1.180 C=CCCCC1CCCC1Br Amb27271586 [0,0,0,1,0,0|2,0,0]=3 1310 B11R1.180 C=CCCCC1CCCC1Cl Amb27271585 [0,0,0,1,0,0|2,0,0]=3 1311 B11R1.180 C=CCCCC1CCCC1N Amb27271587 [0,0,0,1,0,0|2,0,0]=3 1312 B11R1.180 C=CCCCC1CCCC1O Amb24762973 [0,0,0,1,0,0|2,0,0]=3 1313 B11R1.180 C=CCCCC1CNCC1O Amb32950583 [0,0,0,1,0,0|3,0,0]=4 1314 B11R1.180 C=CCCCC1COCC1O Amb32950216 [0,0,0,1,0,0|3,0,0]=4 1315 B11R1.180 C=CCCCN1CCCC1C Amb28326413 [0,0,0,1,0,0|2,0,0]=3 1316 B11R1.180 C=CCCC[C@@H]1CCCC1=O Amb28080270 [0,0,0,1,0,0|0,0,2]=3 1317 B11R1.180 C=CCCC[C@@H]1CCC[C@@H]1O Amb27989516 [0,0,0,1,0,0|2,0,0]=3 1318 B11R1.180 C=CCCC[C@@H]1CCC[C@H]1O Amb26999456 [0,0,0,1,0,0|2,0,0]=3 1319 B11R1.180 C=CCCC[C@@H]1CNC[C@H]1O Amb33212961 [0,0,0,1,0,0|3,0,0]=4 1320 B11R1.180 C=CCCC[C@@H]1COC[C@H]1O Amb32950763 [0,0,0,1,0,0|3,0,0]=4 1321 B11R1.180 C=CCCNC1CCCC1C Amb27266961 [0,0,0,1,0,0|2,0,0]=3 1322 B11R1.180 C=CCCNC1CSCC1C Amb27670983 [0,0,0,1,0,0|3,0,0]=4 1323 B11R1.180 C=CCCN[C@@H]1CCC[C@H]1O Amb27266973 [0,0,0,1,0,0|3,0,0]=4 1324 B11R1.180 C=CCCN[C@@H]1CCO[C@@H]1C Amb28387239 [0,0,0,1,0,0|3,0,0]=4 1325 B11R1.180 C=CCCN[C@H]1CCC[C@@H]1O Amb28079994 [0,0,0,1,0,0|3,0,0]=4 1326 B11R1.180 C=CCNCC1CCCC1Cl Amb27271600 [0,0,0,1,0,0|3,0,0]=4 1327 B11R1.180 C=CCNCC1CCCC1O Amb27271602 [0,0,0,1,0,0|3,0,0]=4 1328 B11R1.180 C=CCNCC1CCOC1C Amb27271440 [0,0,0,1,0,0|3,0,0]=4 1329 B11R1.180 C=CCOC[C@@H]1CCCC1=O Amb25382187 [0,0,0,1,0,0|1,0,2]=4 1330 B11R1.180 C=CCOC[C@H]1CCCC1=O Amb27672521 [0,0,0,1,0,0|1,0,2]=4 1331 B11R1.180 CC#CCCC1COCC1=O Amb35639032 [0,0,0,1,0,0|1,0,2]=4 1332 B11R1.180 CC1CCCC1CCN=C=O Amb27964358 [0,0,0,1,0,0|1,0,1]=3 1333 B11R1.180 CC1CCCC1CNCCN Amb27988593 [0,0,0,1,0,0|2,0,1]=4 1334 B11R1.180 CC1CCCC1NCCC#N Amb27749964 [0,0,0,1,0,0|2,0,1]=4 1335 B11R1.180 CC1CCCC1NCCCF Amb27986344 [0,0,0,1,0,0|2,0,1]=4 1336 B11R1.180 CC1CCCC1NCCCI Amb28326426 [0,0,0,1,0,0|2,0,1]=4 1337 B11R1.180 CC1CCCC1NCCCO Amb24750431 [0,0,0,1,0,0|1,0,2]=4 1338 B11R1.180 CC1CCCC1NC\C=C\Cl Amb28062667 [0,0,0,1,0,0|2,0,1]=4 1339 B11R1.180 CC1CCCN1CCCCBr Amb27986412 [0,0,0,1,0,0|2,0,1]=4 1340 B11R1.180 CC1CCCN1CCCCCl Amb18184021 [0,0,0,1,0,0|2,0,1]=4 1341 B11R1.180 CC1CCCN1CCCCF Amb28326414 [0,0,0,1,0,0|2,0,1]=4 1342 B11R1.180 CC1CCCN1CCCCS Amb27671138 [0,0,0,1,0,0|1,1,1]=4 1343 B11R1.180 CC1OCCC1CCCC=O Amb33426812 [0,0,0,1,0,0|1,0,0]=2 1344 B11R1.180 CC1OCCC1CCCCN Amb33426821 [0,0,0,1,0,0|2,0,1]=4 1345 B11R1.180 CC1OCCC1CCN=C=O Amb33427679 [0,0,0,1,0,0|2,0,1]=4 1346 B11R1.180 CCC#CCC1CCCC1=O Amb27791342 [0,0,0,1,0,0|0,0,2]=3 1347 B11R1.180 CCCCCC1=CCCC1=O Amb533108 [0,0,0,1,0,0|0,0,2]=3 1348 B11R1.180 CCCCCC1=COCC1=O Amb27672330 [0,0,0,1,0,0|1,0,2]=4 1349 B11R1.180 CCCCCC1C=CCC1=O Amb27672594 [0,0,0,1,0,0|0,0,2]=3 1350 B11R1.180 CCCCCC1CC=CC1=O Amb17843926 [0,0,0,1,0,0|0,0,2]=3 1351 B11R1.180 CCCCCC1CCCC1=O Amb534714 [0,0,0,1,0,0|0,0,0]=1 1352 B11R1.180 CCCCCC1CCCC1Br Amb27266930 [0,0,0,1,0,0|1,0,1]=3 1353 B11R1.180 CCCCCC1CCCC1O Amb18183110 [0,0,0,1,0,0|0,0,2]=3 1354 B11R1.180 CCCCCC1CCCN1C Amb27272323 [0,0,0,1,0,0|2,0,0]=3 1355 B11R1.180 CCCCCC1CNCC1O Amb32944704 [0,0,0,1,0,0|1,0,2]=4 1356 B11R1.180 CCCCCC1COCC1=O Amb27672690 [0,0,0,1,0,0|1,0,0]=2 1357 B11R1.180 CCCCCC1COCC1O Amb32945486 [0,0,0,1,0,0|1,0,2]=4 1358 B11R1.180 CCCCCC1OCCC1N Amb27271299 [0,0,0,1,0,0|2,0,1]=4 1359 B11R1.180 CCCCCC1OCCC1O Amb27673890 [0,0,0,1,0,0|1,0,2]=4 1360 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [0,0,0,1,0,0|1,0,0]=2 1361 B11R1.180 CCCCCN1CCCC1C Amb27272044 [0,0,0,1,0,0|2,0,1]=4 1362 B11R1.180 CCCCCN1CCCC1C Amb28352147 [0,0,0,1,0,0|2,0,1]=4 1363 B11R1.180 CCCCCN1CCNC1=O Amb28386660 [0,0,0,1,0,0|2,0,0]=3 1364 B11R1.180 CCCCC[C@@H]1CCC[C@H]1O Amb26659964 [0,0,0,1,0,0|0,0,2]=3 1365 B11R1.180 CCCCC[C@@H]1CNC[C@H]1O Amb32945391 [0,0,0,1,0,0|1,0,2]=4 1366 B11R1.180 CCCCC[C@@H]1COC[C@H]1O Amb32945059 [0,0,0,1,0,0|1,0,2]=4 1367 B11R1.180 CCCCC[C@@H]1OCC[C@H]1O Amb27989725 [0,0,0,1,0,0|1,0,2]=4 1368 B11R1.180 CCCCNC1CCC=C1Br Amb27673636 [0,0,0,1,0,0|2,0,1]=4 1369 B11R1.180 CCCCNC1CCCC1Cl Amb27674051 [0,0,0,1,0,0|2,0,1]=4 1370 B11R1.180 CCCCNC1CCCC1O Amb18303638 [0,0,0,1,0,0|1,0,2]=4 1371 B11R1.180 CCCCN[C@@H]1CCC[C@H]1O Amb27266974 [0,0,0,1,0,0|1,0,2]=4 1372 B11R1.180 CCCCN[C@H]1CCC[C@@H]1O Amb27988011 [0,0,0,1,0,0|1,0,2]=4 1373 B11R1.180 CCCCOC1CCCC1Br Amb24761922 [0,0,0,1,0,0|2,0,1]=4 1374 B11R1.180 CCCCOC1CCCC1I Amb27000729 [0,0,0,1,0,0|2,0,1]=4 1375 B11R1.180 CCCCOC1CCCC1N Amb8895216 [0,0,0,1,0,0|2,0,1]=4 1376 B11R1.180 CCCCOC1CCCC1O Amb18799957 [0,0,0,1,0,0|1,0,2]=4 1377 B11R1.180 CCCCOC1OCCC1=O Amb27673554 [0,0,0,1,0,0|2,0,0]=3 1378 B11R1.180 CCCCSC1CCCC1Cl Amb27990087 [0,0,0,1,0,0|2,0,1]=4 1379 B11R1.180 CCCC\C=C1\CCCC1=O Amb533060 [0,0,0,1,0,0|0,0,2]=3 1380 B11R1.180 CCCC\C=C1\CCOC1=O Amb25947841 [0,0,0,1,0,0|1,0,2]=4 1381 B11R1.180 CCCNCC1CCCC1C Amb27987158 [0,0,0,1,0,0|2,0,1]=4 1382 B11R1.180 CCCNCC1CCCC1Cl Amb27271601 [0,0,0,1,0,0|2,0,1]=4 1383 B11R1.180 CCCNCC1CCCC1O Amb27271525 [0,0,0,1,0,0|1,0,2]=4 1384 B11R1.180 CCCOCC1CCCC1=O Amb27987801 [0,0,0,1,0,0|1,0,0]=2 1385 B11R1.180 CCCOCC1CCCC1Br Amb27987803 [0,0,0,1,0,0|2,0,1]=4 1386 B11R1.180 CCCOCC1CCCC1Cl Amb27987802 [0,0,0,1,0,0|2,0,1]=4 1387 B11R1.180 CCCOCC1CCCC1N Amb27987806 [0,0,0,1,0,0|2,0,1]=4 1388 B11R1.180 CCCOCC1CCCC1O Amb27987798 [0,0,0,1,0,0|1,0,2]=4 1389 B11R1.180 CCCOC[C@@H]1CCC[C@H]1O Amb32944526 [0,0,0,1,0,0|1,0,2]=4 1390 B11R1.180 CCNCCC1CCNC1=O Amb27674171 [0,0,0,1,0,0|2,0,0]=3 1391 B11R1.180 CCNCCN1CCNC1=O Amb6667162 [0,0,0,1,0,0|3,0,0]=4 1392 B11R1.180 CCNCCN1CCOC1=O Amb19026699 [0,0,0,1,0,0|3,0,0]=4 1393 B11R1.180 CCOCCC1CC=CC1=O Amb27672318 [0,0,0,1,0,0|1,0,2]=4 1394 B11R1.180 CCOCCC1CCCC1Br Amb27269149 [0,0,0,1,0,0|2,0,1]=4 1395 B11R1.180 CCOCCC1CCCC1O Amb18183285 [0,0,0,1,0,0|1,0,2]=4 1396 B11R1.180 CCOCCN1CCNC1=O Amb28386659 [0,0,0,1,0,0|3,0,0]=4 1397 B11R1.180 CCSCCC1CCCC1=O Amb27269774 [0,0,0,1,0,0|1,0,0]=2 1398 B11R1.180 CCSCCC1CCCC1Br Amb27271790 [0,0,0,1,0,0|2,0,1]=4 1399 B11R1.180 CCSCCC1CCCC1Cl Amb27986363 [0,0,0,1,0,0|2,0,1]=4 1400 B11R1.180 CCSCCC1CCCC1N Amb27987804 [0,0,0,1,0,0|2,0,1]=4 1401 B11R1.180 CCSCCC1CCCC1O Amb27986369 [0,0,0,1,0,0|1,0,2]=4 1402 B11R1.180 CCSCCC1CSCC1=O Amb27271770 [0,0,0,1,0,0|2,0,0]=3 1403 B11R1.180 CC\C=C/CC1CCCC1=O Amb27272751 [0,0,0,1,0,0|0,0,2]=3 1404 B11R1.180 CC\C=C\CC1CCCC1=O Amb26923884 [0,0,0,1,0,0|0,0,2]=3 1405 B11R1.180 CN1CCCC1CCCC#N Amb33322231 [0,0,0,1,0,0|2,0,1]=4 1406 B11R1.180 CN1CCCC1CCCC=O Amb33320340 [0,0,0,1,0,0|1,0,0]=2 1407 B11R1.180 CN1CCCC1CCCCBr Amb33434965 [0,0,0,1,0,0|2,0,1]=4 1408 B11R1.180 CN1CCCC1CCCCN Amb33321392 [0,0,0,1,0,0|2,0,1]=4 1409 B11R1.180 CN1CCCC1CCCCO Amb24750381 [0,0,0,1,0,0|1,0,2]=4 1410 B11R1.180 CN1CCCC1CCCCS Amb33325945 [0,0,0,1,0,0|1,1,1]=4 1411 B11R1.180 CN1CCCC1CCCON Amb33320741 [0,0,0,1,0,0|3,0,0]=4 1412 B11R1.180 CN1CCCC1CCN=C=O Amb24070149 [0,0,0,1,0,0|2,0,1]=4 1413 B11R1.180 CN1CCCC1CCNC=O Amb35682237 [0,0,0,1,0,0|2,0,0]=3 1414 B11R1.180 CN1CCCC1C\C=C\C=O Amb33320706 [0,0,0,1,0,0|1,0,2]=4 1415 B11R1.180 CNCCCC1CCCN1C Amb23541770 [0,0,0,1,0,0|3,0,0]=4 1416 B11R1.180 CNCCCN1CCCC1=O Amb19015452 [0,0,0,1,0,0|2,0,0]=3 1417 B11R1.180 CNCCSC1CCOC1=O Amb27674014 [0,0,0,1,0,0|3,0,0]=4 1418 B11R1.180 COCCCC1CCCC1Br Amb27269148 [0,0,0,1,0,0|2,0,1]=4 1419 B11R1.180 COCCCC1CCCC1Cl Amb18808937 [0,0,0,1,0,0|2,0,1]=4 1420 B11R1.180 COCCCC1CCCC1O Amb18183284 [0,0,0,1,0,0|1,0,2]=4 1421 B11R1.180 COCCCN1CCCC1=O Amb24064201 [0,0,0,1,0,0|2,0,0]=3 1422 B11R1.180 COCCCN1CCNC1=O Amb28386661 [0,0,0,1,0,0|3,0,0]=4 1423 B11R1.180 COCCC[C@@H]1CCC[C@H]1O Amb32945571 [0,0,0,1,0,0|1,0,2]=4 1424 B11R1.180 COCCNC1CCCC1C Amb24271165 [0,0,0,1,0,0|3,0,0]=4 1425 B11R1.180 CONCCC1CCNC1=O Amb27674172 [0,0,0,1,0,0|3,0,0]=4 1426 B11R1.180 CONCCN1CCCC1=O Amb27988831 [0,0,0,1,0,0|3,0,0]=4 1427 B11R1.180 CSCCCC1CCCC1Br Amb27271791 [0,0,0,1,0,0|2,0,1]=4 1428 B11R1.180 CSCCCC1CCCC1Cl Amb27986364 [0,0,0,1,0,0|2,0,1]=4 1429 B11R1.180 CSCCCC1CCCC1O Amb27986370 [0,0,0,1,0,0|1,0,2]=4 1430 B11R1.180 CSCCCC1CSCC1=O Amb27271771 [0,0,0,1,0,0|2,0,0]=3 1431 B11R1.180 CSCCCN1CCNC1=O Amb28386658 [0,0,0,1,0,0|3,0,0]=4 1432 B11R1.180 CSCCNC1CCCC1C Amb27670539 [0,0,0,1,0,0|3,0,0]=4 1433 B11R1.180 CSCCNC1CCNC1=O Amb27271802 [0,0,0,1,0,0|3,0,0]=4 1434 B11R1.180 CSCCNC1CCOC1=O Amb27271810 [0,0,0,1,0,0|3,0,0]=4 1435 B11R1.180 CSCCNC1CCSC1=O Amb27271811 [0,0,0,1,0,0|3,0,0]=4 1436 B11R1.180 CSCCN[C@H]1CCOC1=O Amb27987317 [0,0,0,1,0,0|3,0,0]=4 1437 B11R1.180 CSCCSC1CCCC1=O Amb28079899 [0,0,0,1,0,0|2,0,0]=3 1438 B11R1.180 C\C=C\COC1CCCC1=O Amb28194475 [0,0,0,1,0,0|1,0,2]=4 1439 B11R1.180 N#CCCCC1CCCC1=O Amb25717939 [0,0,0,1,0,0|1,0,1]=3 1440 B11R1.180 NCCCCC1NCNC1=O Amb27673315 [0,0,0,1,0,0|3,0,0]=4 1441 B11R1.180 NCCCCN1CCCC1=O Amb6244615 [0,0,0,1,0,0|2,0,0]=3 1442 B11R1.180 NCCCSC1CCOC1=O Amb27271115 [0,0,0,1,0,0|3,0,0]=4 1443 B11R1.180 O=C1CCC=C1CCCCBr Amb27673332 [0,0,0,1,0,0|1,0,2]=4 1444 B11R1.180 O=C1CCC=C1CCCCCl Amb27989998 [0,0,0,1,0,0|1,0,2]=4 1445 B11R1.180 O=C1CCCC1CCCCBr Amb27672177 [0,0,0,1,0,0|1,0,0]=2 1446 B11R1.180 O=C1CCCC1CCCCF Amb27267015 [0,0,0,1,0,0|1,0,0]=2 1447 B11R1.180 O=C1CCCC1CCCCO Amb27986534 [0,0,0,1,0,0|1,0,0]=2 1448 B11R1.180 O=C1CCCC1SCCCO Amb27271109 [0,0,0,1,0,0|2,0,0]=3 1449 B11R1.180 O=C1CCCN1CCCCBr Amb33545934 [0,0,0,1,0,0|2,0,0]=3 1450 B11R1.180 O=C1CCCN1CCCCCl Amb18184015 [0,0,0,1,0,0|2,0,0]=3 1451 B11R1.180 O=C1CSCC1CCCCF Amb27267016 [0,0,0,1,0,0|2,0,0]=3 1452 B11R1.180 O=C1NCCC1NCCCF Amb27271857 [0,0,0,1,0,0|3,0,0]=4 1453 B11R1.180 O=C1NCCC1SCCCF Amb27989079 [0,0,0,1,0,0|3,0,0]=4 1454 B11R1.180 O=C1NCCN1CCCCO Amb27671503 [0,0,0,1,0,0|3,0,0]=4 1455 B11R1.180 O=C1OCCC1CCCCO Amb27989920 [0,0,0,1,0,0|2,0,0]=3 1456 B11R1.180 O=C1OCCC1NCCCF Amb27271858 [0,0,0,1,0,0|3,0,0]=4 1457 B11R1.180 O=C1OCCN1CCCCBr Amb8855382 [0,0,0,1,0,0|3,0,0]=4 1458 B11R1.180 O=C1OCCN1CCCCCl Amb18804714 [0,0,0,1,0,0|3,0,0]=4 1459 B11R1.180 O=C1OCC[C@@H]1SCCCO Amb27989703 [0,0,0,1,0,0|3,0,0]=4 1460 B11R1.180 O=C1SCCC1NCCCO Amb27818439 [0,0,0,1,0,0|3,0,0]=4 1461 B11R1.180 O=CCCCC1CCOC1=O Amb27673678 [0,0,0,1,0,0|2,0,1]=4 1462 B11R1.180 OCCCCC1CCCC1O Amb28080690 [0,0,0,1,0,0|1,0,2]=4 1463 B11R1.180 [C-]#[N+]CCCC1CCCN1C Amb33320755 [0,0,0,1,0,0|3,0,0]=4 1464 B11R1.180 [C-]#[N+]CCCN1CCCC1=O Amb19928634 [0,0,0,1,0,0|2,0,1]=4 1465 B11R1.181 C#CCCCC1CCC1CN Amb27988343 [0,0,0,1,0,0|2,0,1]=4 1466 B11R1.181 C#CCCCN1CCC1CC Amb27986916 [0,0,0,1,0,0|2,0,1]=4 1467 B11R1.181 C=CCCCN1CCC1CN Amb33252359 [0,0,0,1,0,0|3,0,0]=4 1468 B11R1.181 CCC1CCC1CNCCN Amb32420103 [0,0,0,1,0,0|2,0,1]=4 1469 B11R1.181 CCC1CCC1CNCCO Amb32419822 [0,0,0,1,0,0|1,0,2]=4 1470 B11R1.181 CCC1CCN1CCCC#N Amb27986918 [0,0,0,1,0,0|2,0,1]=4 1471 B11R1.181 CCCCCN1CCC1CN Amb33251964 [0,0,0,1,0,0|2,0,1]=4 1472 B11R1.190 C#CCCCNC1CCC1C Amb27266941 [0,0,0,1,0,0|2,0,1]=4 1473 B11R1.190 CC1CCC1CNCCCN Amb32421501 [0,0,0,1,0,0|2,0,1]=4 1474 B11R1.190 CC1CCC1CNCCCO Amb32420109 [0,0,0,1,0,0|1,0,2]=4 1475 B11R1.190 CC1CCC1NCCCC#N Amb27266942 [0,0,0,1,0,0|2,0,1]=4 1476 B11R1.190 CCCCC\C=C1/CCC1=O Amb28080152 [0,0,0,1,0,0|0,0,2]=3 1477 B11R1.203 BrCCCC1CCCCCC1 Amb25836156 [0,0,0,1,0,0|1,0,1]=3 1478 B11R1.203 BrCCOC1CCCCCC1 Amb27485201 [0,0,0,1,0,0|2,0,1]=4 1479 B11R1.203 C#CCCC1CCCCCC1 Amb32882184 [0,0,0,1,0,0|1,0,1]=3 1480 B11R1.203 C#CCCC1CCCCNC1 Amb27817445 [0,0,0,1,0,0|2,0,1]=4 1481 B11R1.203 C#CCCN1CCCCCC1 Amb27836109 [0,0,0,1,0,0|2,0,1]=4 1482 B11R1.203 C=CCCC1=CCCCCC1 Amb35711416 [0,0,0,1,0,0|1,0,2]=4 1483 B11R1.203 C=CCCC1CCCCCC1 Amb29865043 [0,0,0,1,0,0|1,0,0]=2 1484 B11R1.203 C=CCNC1CCCCCC1 Amb6683795 [0,0,0,1,0,0|2,0,0]=3 1485 B11R1.203 C=CCNC1CCCNCC1 Amb27868911 [0,0,0,1,0,0|3,0,0]=4 1486 B11R1.203 C=CCNC1CCCOCC1 Amb28350672 [0,0,0,1,0,0|3,0,0]=4 1487 B11R1.203 C=CCNC1CCCSCC1 Amb35692802 [0,0,0,1,0,0|3,0,0]=4 1488 B11R1.203 C=CCSC1CCCNCC1 Amb27865787 [0,0,0,1,0,0|3,0,0]=4 1489 B11R1.203 CCCCC1CCCNCC1 Amb27982191 [0,0,0,1,0,0|2,0,1]=4 1490 B11R1.203 CCCCC1CCNCCO1 Amb32679926 [0,0,0,1,0,0|1,0,2]=4 1491 B11R1.203 CCCCN1CCCCCC1 Amb22347751 [0,0,0,1,0,0|2,0,1]=4 1492 B11R1.203 CCCNC1CCCCCC1 Amb22587063 [0,0,0,1,0,0|2,0,1]=4 1493 B11R1.203 CCCNC1CCCCCC1 Amb6266225 [0,0,0,1,0,0|2,0,1]=4 1494 B11R1.203 CCSCC1CCCCNC1 Amb29854440 [0,0,0,1,0,0|3,0,0]=4 1495 B11R1.203 CNCCC1CCCCCC1 Amb26457524 [0,0,0,1,0,0|2,0,0]=3 1496 B11R1.203 CNCCC1CCCCCN1 Amb27797506 [0,0,0,1,0,0|2,0,1]=4 1497 B11R1.203 CNCCN1CCCCCC1 Amb22586828 [0,0,0,1,0,0|3,0,0]=4 1498 B11R1.203 CNCCN1CCCCCC1 Amb6715126 [0,0,0,1,0,0|3,0,0]=4 1499 B11R1.203 COCCC1CCCCCN1 Amb27634772 [0,0,0,1,0,0|2,0,1]=4 1500 B11R1.203 COCCC1CCCCNC1 Amb27823463 [0,0,0,1,0,0|3,0,0]=4 1501 B11R1.203 ClCCCN1CCCCCC1 Amb17335099 [0,0,0,1,0,0|2,0,1]=4 1502 B11R1.203 ClCCNC1CCCCCC1 Amb17335094 [0,0,0,1,0,0|2,0,1]=4 1503 B11R1.203 ClCCOC1CCCCCC1 Amb18795877 [0,0,0,1,0,0|2,0,1]=4 1504 B11R1.203 ClCOCC1CCCCCC1 Amb28118315 [0,0,0,1,0,0|2,0,1]=4 1505 B11R1.203 Cl\C=C\CN1CCCCCC1 Amb28145650 [0,0,0,1,0,0|2,0,1]=4 1506 B11R1.203 FCCNC1CCCCCC1 Amb27760204 [0,0,0,1,0,0|2,0,1]=4 1507 B11R1.203 N#CCCC1CCCCCC1 Amb26050765 [0,0,0,1,0,0|1,0,1]=3 1508 B11R1.203 N#CCCC1CCCCNC1 Amb28188829 [0,0,0,1,0,0|2,0,1]=4 1509 B11R1.203 N#CCCN1CCCCCC1 Amb4004940 [0,0,0,1,0,0|2,0,1]=4 1510 B11R1.203 N#CCNC1CCCCCC1 Amb8998932 [0,0,0,1,0,0|2,0,1]=4 1511 B11R1.203 N#CCOC1CCCCCC1 Amb18791549 [0,0,0,1,0,0|2,0,1]=4 1512 B11R1.203 NCCCC1CCCCCC1 Amb25113900 [0,0,0,1,0,0|1,0,1]=3 1513 B11R1.203 NCCCN1CCCCCC1 Amb1154115 [0,0,0,1,0,0|2,0,1]=4 1514 B11R1.203 NCCCN1CCCCCC1 Amb5837271 [0,0,0,1,0,0|2,0,1]=4 1515 B11R1.203 NCCNC1CCCCCC1 Amb17091047 [0,0,0,1,0,0|2,0,1]=4 1516 B11R1.203 NCCOC1CCCCCC1 Amb18290053 [0,0,0,1,0,0|2,0,1]=4 1517 B11R1.203 NNCCC1CCCOCC1 Amb27624746 [0,0,0,1,0,0|3,0,0]=4 1518 B11R1.203 NOCCC1CCCCCC1 Amb33267300 [0,0,0,1,0,0|2,0,0]=3 1519 B11R1.203 NOCCN1CCCCCC1 Amb17104863 [0,0,0,1,0,0|3,0,0]=4 1520 B11R1.203 O=C=NCC1CCCCCC1 Amb27847742 [0,0,0,1,0,0|1,0,1]=3 1521 B11R1.203 O=C=NCC1CCCSCC1 Amb30030868 [0,0,0,1,0,0|2,0,1]=4 1522 B11R1.203 O=CCCC1C=CCCCC1 Amb27176435 [0,0,0,1,0,0|0,0,2]=3 1523 B11R1.203 O=CCCC1CCCCCC1 Amb26946978 [0,0,0,1,0,0|0,0,0]=1 1524 B11R1.203 O=CCCN1CCCOCC1 Amb18177532 [0,0,0,1,0,0|2,0,0]=3 1525 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [0,0,0,1,0,0|1,0,0]=2 1526 B11R1.203 O=CNCC1CCCCCC1 Amb28193191 [0,0,0,1,0,0|1,0,0]=2 1527 B11R1.203 O=CNCC1CCCSCC1 Amb35637603 [0,0,0,1,0,0|2,0,0]=3 1528 B11R1.203 O=CNN=C1CCCCCC1 Amb361364 [0,0,0,1,0,0|2,0,1]=4 1529 B11R1.203 O=C\C=C\C1CCCCCC1 Amb33079648 [0,0,0,1,0,0|0,0,2]=3 1530 B11R1.203 OCCCC1CCCCCC1 Amb26928808 [0,0,0,1,0,0|0,0,2]=3 1531 B11R1.203 OCCCC1CCCCCN1 Amb18199937 [0,0,0,1,0,0|1,0,2]=4 1532 B11R1.203 OCCCC1CCCCCO1 Amb27218605 [0,0,0,1,0,0|1,0,2]=4 1533 B11R1.203 OCCCC1CCCCNC1 Amb27241624 [0,0,0,1,0,0|1,0,2]=4 1534 B11R1.203 OCCCC1CCCNCC1 Amb23453247 [0,0,0,1,0,0|1,0,2]=4 1535 B11R1.203 OCCCN1CCCCCC1 Amb31188130 [0,0,0,1,0,0|1,0,2]=4 1536 B11R1.203 OCCCN1CCCCCC1 Amb8503314 [0,0,0,1,0,0|1,0,2]=4 1537 B11R1.203 OCCC[C@H]1C=CCCCC1 Amb27662385 [0,0,0,1,0,0|2,0,0]=3 1538 B11R1.203 OCCNC1CCCCCC1 Amb28960309 [0,0,0,1,0,0|1,0,2]=4 1539 B11R1.203 OCCNC1CCCCCC1 Amb9203172 [0,0,0,1,0,0|1,0,2]=4 1540 B11R1.203 OCCOC1CCCCCC1 Amb18799958 [0,0,0,1,0,0|1,0,2]=4 1541 B11R1.203 OCCSC1CCCCCC1 Amb28401295 [0,0,0,1,0,0|1,0,2]=4 1542 B11R1.203 SCCCC1CCCCCC1 Amb32881853 [0,0,0,1,0,0|0,1,1]=3 1543 B11R1.203 SCCNC1CCCCCC1 Amb26372799 [0,0,0,1,0,0|1,1,1]=4 1544 B11R1.203 SCCOC1CCCCCC1 Amb27807299 [0,0,0,1,0,0|1,1,1]=4 1545 B11R1.203 [C-]#[N+]CCC1CCCCCC1 Amb28071396 [0,0,0,1,0,0|2,0,0]=3 1546 B11R1.203 [N-]=[N+]=NCC1CCCCCC1 Amb33267275 [0,0,0,1,0,0|3,0,0]=4 1547 B11R1.229 CCCCC#CC1CC1C=O Amb25725911 [0,0,0,1,0,0|0,0,2]=3 1548 B11R1.229 CCCCC#C[C@@H]1C[C@@H]1C=O Amb27629609 [0,0,0,1,0,0|0,0,2]=3 1549 B11R1.248 C=CC1CCCCNCCC1 Amb27635206 [0,0,0,1,0,0|2,0,0]=3 1550 B11R1.248 CCC1CCCCNCCC1 Amb28398141 [0,0,0,1,0,0|2,0,1]=4 1551 B11R1.248 NCC1CCCCCCCC1 Amb27645281 [0,0,0,1,0,0|1,0,1]=3 1552 B11R1.248 O=CC1=CCCCCCCC1 Amb25172766 [0,0,0,1,0,0|0,0,2]=3 1553 B11R1.248 O=CC1CCCCCCCC1 Amb27215402 [0,0,0,1,0,0|0,0,0]=1 1554 B11R1.248 O=CN1CCNCCNCC1 Amb27666730 [0,0,0,1,0,0|3,0,0]=4 1555 B11R1.248 O=NN1CCCCCCCC1 Amb27605593 [0,0,0,1,0,0|2,0,0]=3 1556 B11R1.248 OCC1CCCCCCCN1 Amb27463499 [0,0,0,1,0,0|1,0,2]=4 1557 B8R0.4 BrCCCCCCCBr Amb10069015 [2,0,0,0,0,0|2,0,0]=4 1558 B8R0.4 C#CCCCCCC=O Amb25779363 [2,0,0,0,0,0|0,0,2]=4 1559 B8R0.4 C#CCCCCCCC Amb3940501 [2,0,0,0,0,0|0,0,2]=4 1560 B8R0.4 C=CCCCCCC=O Amb26017982 [2,0,0,0,0,0|0,0,2]=4 1561 B8R0.4 C=CCCCCCCBr Amb3940223 [2,0,0,0,0,0|1,0,1]=4 1562 B8R0.4 C=CCCCCCCC Amb3940502 [2,0,0,0,0,0|0,0,1]=3 1563 B8R0.4 C=CCCCCCCCl Amb6298879 [2,0,0,0,0,0|1,0,1]=4 1564 B8R0.4 C=CCCCCCCI Amb26577493 [2,0,0,0,0,0|1,0,1]=4 1565 B8R0.4 C=CCCCCCCN Amb33543931 [2,0,0,0,0,0|1,0,1]=4 1566 B8R0.4 C=CCCCCCCO Amb22230162 [2,0,0,0,0,0|1,0,1]=4 1567 B8R0.4 C=CCCCCCNC Amb19335339 [2,0,0,0,0,0|1,0,1]=4 1568 B8R0.4 C=CCCCCCSC Amb27780646 [2,0,0,0,0,0|1,0,1]=4 1569 B8R0.4 C=CCCCCNCC Amb27461423 [2,0,0,0,0,0|1,0,1]=4 1570 B8R0.4 C=CCCSCCCC Amb28078650 [2,0,0,0,0,0|1,0,1]=4 1571 B8R0.4 C=CCNCCCCC Amb6706493 [2,0,0,0,0,0|1,0,1]=4 1572 B8R0.4 C=CCSCCCCC Amb27837635 [2,0,0,0,0,0|1,0,1]=4 1573 B8R0.4 C=CNCCCCCC Amb27398596 [2,0,0,0,0,0|1,0,1]=4 1574 B8R0.4 C=COCCCCCC Amb24440550 [2,0,0,0,0,0|1,0,1]=4 1575 B8R0.4 CC#CCCCCC=O Amb27827379 [2,0,0,0,0,0|0,0,2]=4 1576 B8R0.4 CC#CCCCCCC Amb9134715 [2,0,0,0,0,0|0,0,2]=4 1577 B8R0.4 CCC#CCCCCC Amb9134716 [2,0,0,0,0,0|0,0,2]=4 1578 B8R0.4 CCCC#CCCCC Amb9134717 [2,0,0,0,0,0|0,0,2]=4 1579 B8R0.4 CCCCBCCCC Amb27624537 [2,0,0,0,0,0|1,0,0]=3 1580 B8R0.4 CCCCCC#CC=O Amb9825881 [2,0,0,0,0,0|0,0,2]=4 1581 B8R0.4 CCCCCCCC#N Amb7764637 [2,0,0,0,0,0|1,0,1]=4 1582 B8R0.4 CCCCCCCC=O Amb6891949 [2,0,0,0,0,0|0,0,0]=2 1583 B8R0.4 CCCCCCCCBr Amb2689971 [2,0,0,0,0,0|1,0,0]=3 1584 B8R0.4 CCCCCCCCC Amb8513269 [2,0,0,0,0,0|0,0,0]=2 1585 B8R0.4 CCCCCCCCCl Amb7757832 [2,0,0,0,0,0|1,0,0]=3 1586 B8R0.4 CCCCCCCCF Amb10840379 [2,0,0,0,0,0|1,0,0]=3 1587 B8R0.4 CCCCCCCCI Amb637144 [2,0,0,0,0,0|1,0,0]=3 1588 B8R0.4 CCCCCCCCN Amb2720240 [2,0,0,0,0,0|1,0,0]=3 1589 B8R0.4 CCCCCCCCN Amb3940466 [2,0,0,0,0,0|1,0,0]=3 1590 B8R0.4 CCCCCCCCO Amb6608788 [2,0,0,0,0,0|0,0,1]=3 1591 B8R0.4 CCCCCCCCS Amb8513530 [2,0,0,0,0,0|0,1,0]=3 1592 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [2,0,0,0,0,0|0,1,0]=3 1593 B8R0.4 CCCCCCCNC Amb7761453 [2,0,0,0,0,0|1,0,0]=3 1594 B8R0.4 CCCCCCCNN Amb7794376 [2,0,0,0,0,0|2,0,0]=4 1595 B8R0.4 CCCCCCCOC Amb24584912 [2,0,0,0,0,0|1,0,0]=3 1596 B8R0.4 CCCCCCCSC Amb22359861 [2,0,0,0,0,0|1,0,0]=3 1597 B8R0.4 CCCCCCN=C=O Amb8516659 [2,0,0,0,0,0|1,0,1]=4 1598 B8R0.4 CCCCCCNC=S Amb27880264 [2,0,0,0,0,0|1,1,0]=4 1599 B8R0.4 CCCCCCNCC Amb6730567 [2,0,0,0,0,0|1,0,0]=3 1600 B8R0.4 CCCCCCOCC Amb17672946 [2,0,0,0,0,0|1,0,0]=3 1601 B8R0.4 CCCCCCOCCl Amb27473208 [2,0,0,0,0,0|2,0,0]=4 1602 B8R0.4 CCCCCCON=O Amb17672945 [2,0,0,0,0,0|2,0,0]=4 1603 B8R0.4 CCCCCC\C=C\Br Amb24677708 [2,0,0,0,0,0|1,0,1]=4 1604 B8R0.4 CCCCCC\C=C\I Amb24446897 [2,0,0,0,0,0|1,0,1]=4 1605 B8R0.4 CCCCCNCCC Amb6688182 [2,0,0,0,0,0|1,0,0]=3 1606 B8R0.4 CCCCCNCCCl Amb17334288 [2,0,0,0,0,0|2,0,0]=4 1607 B8R0.4 CCCCCNCCI Amb27411190 [2,0,0,0,0,0|2,0,0]=4 1608 B8R0.4 CCCCCNCCN Amb17091049 [2,0,0,0,0,0|2,0,0]=4 1609 B8R0.4 CCCCCNCCO Amb3940022 [2,0,0,0,0,0|1,0,1]=4 1610 B8R0.4 CCCCCOCC=O Amb27230502 [2,0,0,0,0,0|1,0,0]=3 1611 B8R0.4 CCCCCOCCCl Amb8902963 [2,0,0,0,0,0|2,0,0]=4 1612 B8R0.4 CCCCCOCCO Amb22264988 [2,0,0,0,0,0|1,0,1]=4 1613 B8R0.4 CCCCCOCCS Amb27752940 [2,0,0,0,0,0|1,1,0]=4 1614 B8R0.4 CCCCCSCCCl Amb25887277 [2,0,0,0,0,0|2,0,0]=4 1615 B8R0.4 CCCCCSCCN Amb6275043 [2,0,0,0,0,0|2,0,0]=4 1616 B8R0.4 CCCCCSCCO Amb1032987 [2,0,0,0,0,0|1,0,1]=4 1617 B8R0.4 CCCCCSCOC Amb27771414 [2,0,0,0,0,0|2,0,0]=4 1618 B8R0.4 CCCCNCCCBr Amb28399869 [2,0,0,0,0,0|2,0,0]=4 1619 B8R0.4 CCCCNCCCC Amb22348285 [2,0,0,0,0,0|1,0,0]=3 1620 B8R0.4 CCCCNCCCC Amb3939027 [2,0,0,0,0,0|1,0,0]=3 1621 B8R0.4 CCCCNCCCC Amb4017913 [2,0,0,0,0,0|1,0,0]=3 1622 B8R0.4 CCCCNCCCCl Amb24529030 [2,0,0,0,0,0|2,0,0]=4 1623 B8R0.4 CCCCNCCCCl Amb33164142 [2,0,0,0,0,0|2,0,0]=4 1624 B8R0.4 CCCCNCCCN Amb17315267 [2,0,0,0,0,0|2,0,0]=4 1625 B8R0.4 CCCCNCCCO Amb4304116 [2,0,0,0,0,0|1,0,1]=4 1626 B8R0.4 CCCCNCCOC Amb6685727 [2,0,0,0,0,0|2,0,0]=4 1627 B8R0.4 CCCCOCCC=O Amb27880111 [2,0,0,0,0,0|1,0,0]=3 1628 B8R0.4 CCCCOCCCBr Amb8895241 [2,0,0,0,0,0|2,0,0]=4 1629 B8R0.4 CCCCOCCCC Amb8513426 [2,0,0,0,0,0|1,0,0]=3 1630 B8R0.4 CCCCOCCCN Amb3939348 [2,0,0,0,0,0|2,0,0]=4 1631 B8R0.4 CCCCOCCOC Amb33847381 [2,0,0,0,0,0|2,0,0]=4 1632 B8R0.4 CCCCOCNC=O Amb27392745 [2,0,0,0,0,0|2,0,0]=4 1633 B8R0.4 CCCCPCCCC Amb22730293 [2,0,0,0,0,0|1,0,0]=3 1634 B8R0.4 CCCCPCCCN Amb27217298 [2,0,0,0,0,0|2,0,0]=4 1635 B8R0.4 CCCCSCCCF Amb27449027 [2,0,0,0,0,0|2,0,0]=4 1636 B8R0.4 CCCCSCCCN Amb9261123 [2,0,0,0,0,0|2,0,0]=4 1637 B8R0.4 CCCCSCCCS Amb28453845 [2,0,0,0,0,0|1,1,0]=4 1638 B8R0.4 CCCCSCCOC Amb27827301 [2,0,0,0,0,0|2,0,0]=4 1639 B8R0.4 CCCCSCNC=O Amb27656061 [2,0,0,0,0,0|2,0,0]=4 1640 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [2,0,0,0,0,0|1,0,0]=3 1641 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [2,0,0,0,0,0|1,0,0]=3 1642 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [2,0,0,0,0,0|1,0,0]=3 1643 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [2,0,0,0,0,0|1,0,0]=3 1644 B8R0.4 CCCNCCCCI Amb28072729 [2,0,0,0,0,0|2,0,0]=4 1645 B8R0.4 CCCNCCCCN Amb17334115 [2,0,0,0,0,0|2,0,0]=4 1646 B8R0.4 CCCNCCCCS Amb28349265 [2,0,0,0,0,0|1,1,0]=4 1647 B8R0.4 CCCNCCCOC Amb6730309 [2,0,0,0,0,0|2,0,0]=4 1648 B8R0.4 CCCNCCOCC Amb8841458 [2,0,0,0,0,0|2,0,0]=4 1649 B8R0.4 CCCNCCSCC Amb27837542 [2,0,0,0,0,0|2,0,0]=4 1650 B8R0.4 CCCNCNCCC Amb28250874 [2,0,0,0,0,0|2,0,0]=4 1651 B8R0.4 CCCNCSCCC Amb27784117 [2,0,0,0,0,0|2,0,0]=4 1652 B8R0.4 CCCOCCCC=O Amb27795367 [2,0,0,0,0,0|1,0,0]=3 1653 B8R0.4 CCCOCCCCBr Amb8874783 [2,0,0,0,0,0|2,0,0]=4 1654 B8R0.4 CCCOCCCCCl Amb18181651 [2,0,0,0,0,0|2,0,0]=4 1655 B8R0.4 CCCOCCCCO Amb27395455 [2,0,0,0,0,0|1,0,1]=4 1656 B8R0.4 CCCOCCNCC Amb28146663 [2,0,0,0,0,0|2,0,0]=4 1657 B8R0.4 CCCOCOCCC Amb22230733 [2,0,0,0,0,0|2,0,0]=4 1658 B8R0.4 CCCSCCCCCl Amb18798739 [2,0,0,0,0,0|2,0,0]=4 1659 B8R0.4 CCCSCCCCN Amb9391521 [2,0,0,0,0,0|2,0,0]=4 1660 B8R0.4 CCCSCCCCO Amb9370795 [2,0,0,0,0,0|1,0,1]=4 1661 B8R0.4 CCCSCCCCS Amb27766901 [2,0,0,0,0,0|1,1,0]=4 1662 B8R0.4 CCCSCCCOC Amb27837637 [2,0,0,0,0,0|2,0,0]=4 1663 B8R0.4 CCCSCCNC=O Amb27630895 [2,0,0,0,0,0|2,0,0]=4 1664 B8R0.4 CCCSCCOCC Amb27970679 [2,0,0,0,0,0|2,0,0]=4 1665 B8R0.4 CCC\C=C/CCCC Amb26023943 [2,0,0,0,0,0|0,0,2]=4 1666 B8R0.4 CCC\C=C\CCC=O Amb33172232 [2,0,0,0,0,0|0,0,2]=4 1667 B8R0.4 CCC\C=C\CCCC Amb2778543 [2,0,0,0,0,0|0,0,2]=4 1668 B8R0.4 CCC\C=N\CCCC Amb19375587 [2,0,0,0,0,0|1,0,1]=4 1669 B8R0.4 CCNCCCCCF Amb27956469 [2,0,0,0,0,0|2,0,0]=4 1670 B8R0.4 CCNCCCCCI Amb27761837 [2,0,0,0,0,0|2,0,0]=4 1671 B8R0.4 CCNCCCCCN Amb27447573 [2,0,0,0,0,0|2,0,0]=4 1672 B8R0.4 CCNCCCCCO Amb17334130 [2,0,0,0,0,0|1,0,1]=4 1673 B8R0.4 CCNCCCCOC Amb27837458 [2,0,0,0,0,0|2,0,0]=4 1674 B8R0.4 CCNCCCCSC Amb27837487 [2,0,0,0,0,0|2,0,0]=4 1675 B8R0.4 CCNCCCNC=O Amb27220690 [2,0,0,0,0,0|2,0,0]=4 1676 B8R0.4 CCNCCCNCC Amb20171936 [2,0,0,0,0,0|2,0,0]=4 1677 B8R0.4 CCNCCCSCC Amb27647486 [2,0,0,0,0,0|2,0,0]=4 1678 B8R0.4 CCOCCCCCBr Amb24502334 [2,0,0,0,0,0|2,0,0]=4 1679 B8R0.4 CCOCCCCCCl Amb9001650 [2,0,0,0,0,0|2,0,0]=4 1680 B8R0.4 CCOCCCCCS Amb27835597 [2,0,0,0,0,0|1,1,0]=4 1681 B8R0.4 CCOCCCCNC Amb28049603 [2,0,0,0,0,0|2,0,0]=4 1682 B8R0.4 CCOCCOCC=O Amb33539619 [2,0,0,0,0,0|2,0,0]=4 1683 B8R0.4 CCSCCCCC=O Amb24690525 [2,0,0,0,0,0|1,0,0]=3 1684 B8R0.4 CCSCCCCCBr Amb25887441 [2,0,0,0,0,0|2,0,0]=4 1685 B8R0.4 CCSCCCCCCl Amb9304998 [2,0,0,0,0,0|2,0,0]=4 1686 B8R0.4 CCSCCCCCF Amb28207049 [2,0,0,0,0,0|2,0,0]=4 1687 B8R0.4 CCSCCCCCN Amb28049047 [2,0,0,0,0,0|2,0,0]=4 1688 B8R0.4 CCSCCCCNC Amb27837488 [2,0,0,0,0,0|2,0,0]=4 1689 B8R0.4 CCSCCCCOC Amb27651458 [2,0,0,0,0,0|2,0,0]=4 1690 B8R0.4 CCSCCCNC=O Amb27457130 [2,0,0,0,0,0|2,0,0]=4 1691 B8R0.4 CC\C=C/CCCCC Amb25258581 [2,0,0,0,0,0|0,0,2]=4 1692 B8R0.4 CC\C=C\CCCC=O Amb33171685 [2,0,0,0,0,0|0,0,2]=4 1693 B8R0.4 CC\C=C\CCCCC Amb22347893 [2,0,0,0,0,0|0,0,2]=4 1694 B8R0.4 CNCCCCCCF Amb28137350 [2,0,0,0,0,0|2,0,0]=4 1695 B8R0.4 CNCCCCCCN Amb22641938 [2,0,0,0,0,0|2,0,0]=4 1696 B8R0.4 CNCCCCCCN Amb32667312 [2,0,0,0,0,0|2,0,0]=4 1697 B8R0.4 CNCCCCCCO Amb2721293 [2,0,0,0,0,0|1,0,1]=4 1698 B8R0.4 CNCCCCCOC Amb17569940 [2,0,0,0,0,0|2,0,0]=4 1699 B8R0.4 COCCCCCC=O Amb27467958 [2,0,0,0,0,0|1,0,0]=3 1700 B8R0.4 COCCCCCCBr Amb26928164 [2,0,0,0,0,0|2,0,0]=4 1701 B8R0.4 COCCCCCCCl Amb18180174 [2,0,0,0,0,0|2,0,0]=4 1702 B8R0.4 COCCCCCCN Amb27799019 [2,0,0,0,0,0|2,0,0]=4 1703 B8R0.4 COCCCCCCO Amb28189816 [2,0,0,0,0,0|1,0,1]=4 1704 B8R0.4 COCCCCCOC Amb22348093 [2,0,0,0,0,0|2,0,0]=4 1705 B8R0.4 COCCOCCC=O Amb26078964 [2,0,0,0,0,0|2,0,0]=4 1706 B8R0.4 COCCSCCC=O Amb27837422 [2,0,0,0,0,0|2,0,0]=4 1707 B8R0.4 COCOCCCC=O Amb27234488 [2,0,0,0,0,0|2,0,0]=4 1708 B8R0.4 CSCCCCCC=O Amb27981887 [2,0,0,0,0,0|1,0,0]=3 1709 B8R0.4 CSCCCCCCN Amb24532830 [2,0,0,0,0,0|2,0,0]=4 1710 B8R0.4 CSCCCCCCO Amb22367888 [2,0,0,0,0,0|1,0,1]=4 1711 B8R0.4 CSCCCCCCS Amb27801758 [2,0,0,0,0,0|1,1,0]=4 1712 B8R0.4 CSCCCCCSC Amb4020033 [2,0,0,0,0,0|2,0,0]=4 1713 B8R0.4 CSCCCCNC=O Amb28366040 [2,0,0,0,0,0|2,0,0]=4 1714 B8R0.4 CSCCCOCC=O Amb28286017 [2,0,0,0,0,0|2,0,0]=4 1715 B8R0.4 CSCCOCCC=O Amb27823932 [2,0,0,0,0,0|2,0,0]=4 1716 B8R0.4 CSCCSCCC=O Amb27956184 [2,0,0,0,0,0|2,0,0]=4 1717 B8R0.4 C\C=C/CCCCC=O Amb26854801 [2,0,0,0,0,0|0,0,2]=4 1718 B8R0.4 C\C=C/CCCCCC Amb27478896 [2,0,0,0,0,0|0,0,2]=4 1719 B8R0.4 C\C=C\CCCCCC Amb19930200 [2,0,0,0,0,0|0,0,2]=4 1720 B8R0.4 ClCCCCCCCBr Amb24323576 [2,0,0,0,0,0|2,0,0]=4 1721 B8R0.4 ClCCCCCCCCl Amb22232563 [2,0,0,0,0,0|2,0,0]=4 1722 B8R0.4 N#CCCCCCC=O Amb18642301 [2,0,0,0,0,0|1,0,1]=4 1723 B8R0.4 NCCCCCCCBr Amb27817795 [2,0,0,0,0,0|2,0,0]=4 1724 B8R0.4 NCCCCCCCBr Amb33321489 [2,0,0,0,0,0|2,0,0]=4 1725 B8R0.4 NCCCCCCCF Amb25918508 [2,0,0,0,0,0|2,0,0]=4 1726 B8R0.4 NCCCCCCCN Amb3370862 [2,0,0,0,0,0|2,0,0]=4 1727 B8R0.4 NCCCCCCCO Amb24120448 [2,0,0,0,0,0|1,0,1]=4 1728 B8R0.4 NCCCCCCCO Amb33544521 [2,0,0,0,0,0|1,0,1]=4 1729 B8R0.4 NCCCCCCCS Amb25147209 [2,0,0,0,0,0|1,1,0]=4 1730 B8R0.4 O=CCCCCCCBr Amb22755463 [2,0,0,0,0,0|1,0,0]=3 1731 B8R0.4 O=CCCCCCCCl Amb27262031 [2,0,0,0,0,0|1,0,0]=3 1732 B8R0.4 O=CCCOCCCO Amb28428559 [2,0,0,0,0,0|2,0,0]=4 1733 B8R0.4 OCCCCCCCBr Amb9787726 [2,0,0,0,0,0|1,0,1]=4 1734 B8R0.4 OCCCCCCCF Amb25381297 [2,0,0,0,0,0|1,0,1]=4 1735 B8R0.4 OCCCCCCCI Amb32411247 [2,0,0,0,0,0|1,0,1]=4 1736 B8R0.4 OCCCCCCCO Amb8513178 [2,0,0,0,0,0|1,0,1]=4 1737 B8R0.4 [C-]#[N+]CCCCCC=O Amb27424636 [2,0,0,0,0,0|1,0,1]=4 1738 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [2,0,0,0,0,0|1,0,1]=4 1739 B10R0.1 CCCCCCC(=O)CCC Amb8513848 [1,1,0,0,0,0|0,0,2]=4 1740 B10R0.1 CCCCCCC(C)CCBr Amb28994667 [1,1,0,0,0,0|1,0,0]=3 1741 B10R0.1 CCCCCCC(O)CCN Amb32693327 [1,1,0,0,0,0|1,0,0]=3 1742 B10R0.1 CCCCCC[C@@H](O)CCO Amb8516913 [1,1,0,0,0,0|0,0,1]=3 1743 B10R0.1 CCCCCNC(C)CCC Amb9744734 [1,1,0,0,0,0|1,0,1]=4 1744 B10R0.1 NCCCCCC(F)CCN Amb33456282 [1,1,0,0,0,0|2,0,0]=4 1745 B10R0.1 NCCCCCC(F)CCN Amb33456283 [1,1,0,0,0,0|2,0,0]=4 1746 B10R0.4 C=C(Br)CCCCCCCC Amb6298935 [1,1,0,0,0,0|0,0,1]=3 1747 B10R0.4 C=C(Br)CCCCCCCCl Amb6298886 [1,1,0,0,0,0|1,0,1]=4 1748 B10R0.4 C=C(C)CCCCCCCC Amb6298941 [1,1,0,0,0,0|0,0,1]=3 1749 B10R0.4 C=C(C)CNCCCCCC Amb17308745 [1,1,0,0,0,0|1,0,1]=4 1750 B10R0.4 C=C(Cl)CCCCCCCC Amb6298929 [1,1,0,0,0,0|0,0,1]=3 1751 B10R0.4 C=CCCCCCC[C@@H](C)O Amb30594444 [1,1,0,0,0,0|0,0,1]=3 1752 B10R0.4 C=CCCCCNCC(C)C Amb32651007 [1,1,0,0,0,0|1,0,1]=4 1753 B10R0.4 CC(=O)NCCCCCC=O Amb24113371 [1,1,0,0,0,0|1,0,1]=4 1754 B10R0.4 CC(=O)NCCCCCCN Amb5786933 [1,1,0,0,0,0|2,0,0]=4 1755 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [1,1,0,0,0,0|2,0,0]=4 1756 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [1,1,0,0,0,0|2,0,0]=4 1757 B10R0.4 CC(=O)SCCCCCCN Amb31031026 [1,1,0,0,0,0|2,0,0]=4 1758 B10R0.4 CC(=O)SCCCCCCN Amb33276211 [1,1,0,0,0,0|2,0,0]=4 1759 B10R0.4 CC(C)CCCCCCCBr Amb32689357 [1,1,0,0,0,0|1,0,0]=3 1760 B10R0.4 CC(C)CCCCCCCCl Amb32689356 [1,1,0,0,0,0|1,0,0]=3 1761 B10R0.4 CC(C)CCOCCCCBr Amb8855446 [1,1,0,0,0,0|2,0,0]=4 1762 B10R0.4 CC(C)CCOCCCCCl Amb18804840 [1,1,0,0,0,0|2,0,0]=4 1763 B10R0.4 CC(C)CCSCCCCN Amb17500950 [1,1,0,0,0,0|2,0,0]=4 1764 B10R0.4 CC(C)CNCCCCCO Amb17334478 [1,1,0,0,0,0|1,0,1]=4 1765 B10R0.4 CC(N)CCNCCCCN Amb32679450 [1,1,0,0,0,0|2,0,0]=4 1766 B10R0.4 CC(N)CCNCCCCN Amb32685287 [1,1,0,0,0,0|2,0,0]=4 1767 B10R0.4 CCC#CCCCCC(=O)O Amb27269519 [1,1,0,0,0,0|0,0,2]=4 1768 B10R0.4 CCC#CCCCCC(N)=O Amb28079386 [1,1,0,0,0,0|0,0,2]=4 1769 B10R0.4 CCCC#CCCCC(=O)O Amb27269520 [1,1,0,0,0,0|0,0,2]=4 1770 B10R0.4 CCCC#CCCCC(N)=O Amb28079638 [1,1,0,0,0,0|0,0,2]=4 1771 B10R0.4 CCCCC#CCCC(C)=O Amb27269937 [1,1,0,0,0,0|0,0,2]=4 1772 B10R0.4 CCCCC#CCCC(N)=O Amb28079736 [1,1,0,0,0,0|0,0,2]=4 1773 B10R0.4 CCCCCC#CCC(=O)Cl Amb27672073 [1,1,0,0,0,0|0,0,2]=4 1774 B10R0.4 CCCCCCC#CC(=O)O Amb2780028 [1,1,0,0,0,0|0,0,2]=4 1775 B10R0.4 CCCCCCC#CC(C)=O Amb27672631 [1,1,0,0,0,0|0,0,2]=4 1776 B10R0.4 CCCCCCCCB(O)O Amb2456044 [1,1,0,0,0,0|1,0,1]=4 1777 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [1,1,0,0,0,0|0,0,0]=2 1778 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [1,1,0,0,0,0|0,0,0]=2 1779 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [1,1,0,0,0,0|0,0,0]=2 1780 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [1,1,0,0,0,0|0,0,0]=2 1781 B10R0.4 CCCCCCCCC(C)Br Amb22731670 [1,1,0,0,0,0|0,0,1]=3 1782 B10R0.4 CCCCCCCCC(C)C Amb20241015 [1,1,0,0,0,0|0,0,1]=3 1783 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [1,1,0,0,0,0|0,0,0]=2 1784 B10R0.4 CCCCCCCCN(C)C Amb2778778 [1,1,0,0,0,0|1,0,1]=4 1785 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [1,1,0,0,0,0|0,0,1]=3 1786 B10R0.4 CCCCCCCC[S@@+](C)[O-] Amb17779184 [1,1,0,0,0,0|1,0,1]=4 1787 B10R0.4 CCCCCCCNC(N)=S Amb2688655 [1,1,0,0,0,0|1,1,0]=4 1788 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [1,1,0,0,0,0|1,0,0]=3 1789 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [1,1,0,0,0,0|1,0,0]=3 1790 B10R0.4 CCCCCCCOC(C)Cl Amb32715989 [1,1,0,0,0,0|1,0,1]=4 1791 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [1,1,0,0,0,0|1,0,0]=3 1792 B10R0.4 CCCCCCCSC(=N)N Amb22487432 [1,1,0,0,0,0|2,0,0]=4 1793 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [1,1,0,0,0,0|1,0,0]=3 1794 B10R0.4 CCCCCCNCC(C)C Amb6730526 [1,1,0,0,0,0|1,0,1]=4 1795 B10R0.4 CCCCCCNCC(C)O Amb9247474 [1,1,0,0,0,0|1,0,1]=4 1796 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [1,1,0,0,0,0|1,0,0]=3 1797 B10R0.4 CCCCCC\C=C\C(=O)O Amb3940553 [1,1,0,0,0,0|0,0,2]=4 1798 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [1,1,0,0,0,0|0,0,2]=4 1799 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [1,1,0,0,0,0|1,0,0]=3 1800 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [1,1,0,0,0,0|1,0,0]=3 1801 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [1,1,0,0,0,0|2,0,0]=4 1802 B10R0.4 CCC\C=C\CCCC(=O)O Amb33079428 [1,1,0,0,0,0|0,0,2]=4 1803 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [1,1,0,0,0,0|2,0,0]=4 1804 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [1,1,0,0,0,0|1,0,0]=3 1805 B10R0.4 CCOCCOCCC(=O)O Amb6273854 [1,1,0,0,0,0|2,0,0]=4 1806 B10R0.4 CCOCCOCCC(N)=O Amb18797953 [1,1,0,0,0,0|2,0,0]=4 1807 B10R0.4 CN(C)CCCCCCCN Amb6715652 [1,1,0,0,0,0|2,0,0]=4 1808 B10R0.4 CNCCOCCCC(=O)O Amb18106300 [1,1,0,0,0,0|2,0,0]=4 1809 B10R0.4 COCCCNCCC(=O)O Amb8841109 [1,1,0,0,0,0|2,0,0]=4 1810 B10R0.4 COCCCNCCC(C)=O Amb32675820 [1,1,0,0,0,0|2,0,0]=4 1811 B10R0.4 COCCCOCCC(=O)O Amb18180046 [1,1,0,0,0,0|2,0,0]=4 1812 B10R0.4 COCCOCCCC(=O)O Amb6271198 [1,1,0,0,0,0|2,0,0]=4 1813 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [1,1,0,0,0,0|1,0,0]=3 1814 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [1,1,0,0,0,0|1,0,0]=3 1815 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [1,1,0,0,0,0|1,0,0]=3 1816 B10R0.4 NCCCCCCNC(=O)O Amb22494605 [1,1,0,0,0,0|2,0,0]=4 1817 B10R0.4 NCCCNCCCC(=O)O Amb18183427 [1,1,0,0,0,0|2,0,0]=4 1818 B10R0.4 NCCCNCCCC(=O)O Amb33172775 [1,1,0,0,0,0|2,0,0]=4 1819 B10R0.4 NCCCOCCCC(=O)O Amb18111568 [1,1,0,0,0,0|2,0,0]=4 1820 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [1,1,0,0,0,0|2,0,0]=4 1821 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [1,1,0,0,0,0|1,0,0]=3 1822 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [1,1,0,0,0,0|1,0,0]=3 1823 B10R0.4 O=C(O)CCCCOCCO Amb7782972 [1,1,0,0,0,0|2,0,0]=4 1824 B10R0.4 O=C(O)CCCSCCCO Amb17502860 [1,1,0,0,0,0|2,0,0]=4 1825 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [1,1,0,0,0,0|1,0,0]=3 1826 B10R0.74 C=CCCCCCC(C)CC Amb33457233 [1,1,0,0,0,0|0,0,1]=3 1827 B10R0.74 CCCCCCCC(=O)CC Amb6366429 [1,1,0,0,0,0|0,0,2]=4 1828 B10R0.74 CCCCCCCC(C)CBr Amb32689187 [1,1,0,0,0,0|1,0,0]=3 1829 B10R0.74 CCCCCCCC(C)CCl Amb32689186 [1,1,0,0,0,0|1,0,0]=3 1830 B10R0.74 CCCCCCCC(C)CN Amb8950186 [1,1,0,0,0,0|1,0,0]=3 1831 B10R0.74 CCCCCCNC(C)CC Amb6730569 [1,1,0,0,0,0|1,0,1]=4 1832 B10R0.74 CCCCCCOC(=O)C=O Amb17614962 [1,1,0,0,0,0|1,0,1]=4 1833 B10R0.74 CCCCOCCC(C)CBr Amb32689033 [1,1,0,0,0,0|2,0,0]=4 1834 B10R0.74 CCCCOCCC(C)CCl Amb32689032 [1,1,0,0,0,0|2,0,0]=4 1835 B10R0.91 CCCCN(C)CCCCN Amb5357861 [1,1,0,0,0,0|2,0,0]=4 1836 B10R0.91 CCCCNC(C)CCCC Amb33534585 [1,1,0,0,0,0|1,0,1]=4 1837 B12R0.1 C=CCCCCCCC(=O)OCC Amb6298913 [0,2,0,0,0,0|1,0,1]=4 1838 B12R0.1 CCCCCCCCC(O)CCC Amb9787107 [0,2,0,0,0,0|1,0,1]=4 1839 B12R0.5 BrCCCCCCCCCCCBr Amb8514480 [0,2,0,0,0,0|1,0,1]=4 1840 B12R0.5 C#CCCCCCCCCCCO Amb10602413 [0,2,0,0,0,0|0,0,2]=4 1841 B12R0.5 C=CCCCCCCCCCCC Amb2721661 [0,2,0,0,0,0|1,0,0]=3 1842 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [0,2,0,0,0,0|1,0,0]=3 1843 B12R0.5 C=CCNCCCCCCCCC Amb7761762 [0,2,0,0,0,0|1,0,0]=3 1844 B12R0.5 CCCCC#CCCCCCCCl Amb16232464 [0,2,0,0,0,0|1,0,1]=4 1845 B12R0.5 CCCCCCCCCC#CCO Amb2609119 [0,2,0,0,0,0|0,0,2]=4 1846 B12R0.5 CCCCCCCCCCCC#N Amb8384531 [0,2,0,0,0,0|1,0,1]=4 1847 B12R0.5 CCCCCCCCCCCC=O Amb3940434 [0,2,0,0,0,0|0,0,0]=2 1848 B12R0.5 CCCCCCCCCCCCBr Amb6891945 [0,2,0,0,0,0|1,0,1]=4 1849 B12R0.5 CCCCCCCCCCCCC Amb29471649 [0,2,0,0,0,0|1,0,1]=4 1850 B12R0.5 CCCCCCCCCCCCC Amb8513362 [0,2,0,0,0,0|1,0,1]=4 1851 B12R0.5 CCCCCCCCCCCCCl Amb4008392 [0,2,0,0,0,0|1,0,1]=4 1852 B12R0.5 CCCCCCCCCCCCI Amb3940281 [0,2,0,0,0,0|1,0,1]=4 1853 B12R0.5 CCCCCCCCCCCCN Amb3940463 [0,2,0,0,0,0|1,0,1]=4 1854 B12R0.5 CCCCCCCCCCCCO Amb2721434 [0,2,0,0,0,0|0,0,2]=4 1855 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [0,2,0,0,0,0|1,0,1]=4 1856 B12R0.5 CCCCCCCCCCCNC Amb32676722 [0,2,0,0,0,0|1,0,1]=4 1857 B12R0.5 CCCCCCCCCCCNC Amb9787074 [0,2,0,0,0,0|1,0,1]=4 1858 B12R0.5 CCCCCCCCCCN=C=S Amb2686679 [0,2,0,0,0,0|0,1,1]=4 1859 B12R0.5 CCCCCCCCCCN=[N+]=[N-] Amb17939439 [0,2,0,0,0,0|1,0,1]=4 1860 B12R0.5 CCCCCCCCCNCCC Amb7794670 [0,2,0,0,0,0|1,0,1]=4 1861 B12R0.5 CCCCCCCCCSCCN Amb7794936 [0,2,0,0,0,0|1,0,1]=4 1862 B12R0.5 CCCCCCCCCSCCO Amb7968787 [0,2,0,0,0,0|0,0,2]=4 1863 B12R0.5 CCCCCCCCNCCC#N Amb2689969 [0,2,0,0,0,0|1,0,1]=4 1864 B12R0.5 CCCCCCCCNCCCN Amb19058864 [0,2,0,0,0,0|1,0,1]=4 1865 B12R0.5 CCCCCCCCNCCNC Amb2691994 [0,2,0,0,0,0|1,0,1]=4 1866 B12R0.5 CCCCCCCCOCCCN Amb13951369 [0,2,0,0,0,0|1,0,1]=4 1867 B12R0.5 CCCCCCCCOCCCN Amb7764731 [0,2,0,0,0,0|1,0,1]=4 1868 B12R0.5 CCCCCCCNCCCCC Amb7761456 [0,2,0,0,0,0|1,0,1]=4 1869 B12R0.5 CCCCCCC\C=C\C=C\C=O Amb22045171 [0,2,0,0,0,0|0,0,2]=4 1870 B12R0.5 CCCCCCNCCCCCC Amb3938960 [0,2,0,0,0,0|1,0,1]=4 1871 B12R0.5 CCCCCCOCCCCCC Amb9787554 [0,2,0,0,0,0|1,0,1]=4 1872 B12R0.5 CCCCCCOCCOCCO Amb9787187 [0,2,0,0,0,0|0,0,2]=4 1873 B12R0.5 CCCCCCSCCCCCC Amb8513185 [0,2,0,0,0,0|1,0,1]=4 1874 B12R0.5 CCCCC\C=C/CC\C=C\C=O Amb22348277 [0,2,0,0,0,0|0,0,2]=4 1875 B12R0.5 CCCCOCCOCCCCN Amb9208521 [0,2,0,0,0,0|1,0,1]=4 1876 B12R0.5 CCCC\C=C\CCCCCCO Amb33513191 [0,2,0,0,0,0|0,0,2]=4 1877 B12R0.5 CCOCCCCCCCCCBr Amb33719481 [0,2,0,0,0,0|1,0,1]=4 1878 B12R0.5 CCOCCCCCCCCCO Amb22233218 [0,2,0,0,0,0|0,0,2]=4 1879 B12R0.5 COCCCCCNCCCOC Amb33133269 [0,2,0,0,0,0|2,0,0]=4 1880 B12R0.5 NCCCCCCCCCCCN Amb16233911 [0,2,0,0,0,0|1,0,1]=4 1881 B12R0.5 NCCCCCCCCCCCO Amb26304136 [0,2,0,0,0,0|0,0,2]=4 1882 B12R0.5 NCCCCCCCCCCCO Amb30988059 [0,2,0,0,0,0|0,0,2]=4 1883 B12R0.5 NCCCCCCCCCCCS Amb22336989 [0,2,0,0,0,0|0,1,1]=4 1884 B12R0.5 NOCCCCCCCCCON Amb33483168 [0,2,0,0,0,0|2,0,0]=4 1885 B12R0.5 OCCCCCCCCCCCBr Amb3372065 [0,2,0,0,0,0|0,0,2]=4 1886 B12R0.5 OCCCCCCCCCCCO Amb15692712 [0,2,0,0,0,0|0,0,2]=4 1887 B12R0.5 OCCCCCCCCCCCS Amb8396653 [0,2,0,0,0,0|0,0,2]=4 1888 B12R0.5 [N-]=[N+]=NCCCCCCCCCN Amb34913617 [0,2,0,0,0,0|2,0,0]=4 1889 B12R0.5 [N-]=[N+]=NCCCCCCCCCN Amb34913619 [0,2,0,0,0,0|2,0,0]=4 1890 B12R0.5 [N-]=[N+]=NCCCCCCCCCO Amb34913618 [0,2,0,0,0,0|2,0,0]=4 1891 B12R0.47 CCCCCCC(C)NCCCO Amb7761294 [0,2,0,0,0,0|0,0,2]=4 1892 B12R0.47 CCCCCCC(O)CCCCC Amb9787109 [0,2,0,0,0,0|1,0,1]=4 1893 B12R0.206 CCCCCCCC(=O)CCCC Amb6366430 [0,2,0,0,0,0|1,0,1]=4 1894 B12R0.206 CCCCCCCC(C)NCCO Amb7809070 [0,2,0,0,0,0|0,0,2]=4 1895 B12R0.206 CCCCCCNC(C)CCCO Amb33363358 [0,2,0,0,0,0|0,0,2]=4 1896 B12R0.206 CCCCN(C)CCCCCCN Amb5357899 [0,2,0,0,0,0|1,0,1]=4 1897 B12R0.234 C#CCCCCCCCCC(=O)O Amb536933 [0,2,0,0,0,0|0,0,1]=3 1898 B12R0.234 C=C(Br)CCCCCCCCCC Amb6298937 [0,2,0,0,0,0|1,0,0]=3 1899 B12R0.234 C=C(Cl)CCCCCCCCCC Amb6298931 [0,2,0,0,0,0|1,0,0]=3 1900 B12R0.234 C=CCCCCCCCCC(=O)Cl Amb2721637 [0,2,0,0,0,0|0,0,1]=3 1901 B12R0.234 C=CCCCCCCCCC(=O)O Amb533736 [0,2,0,0,0,0|0,0,1]=3 1902 B12R0.234 CC#CCCCCCCCC(=O)O Amb6565389 [0,2,0,0,0,0|0,0,1]=3 1903 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,2,0,0,0,0|2,0,0]=4 1904 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,2,0,0,0,0|1,0,0]=3 1905 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [0,2,0,0,0,0|0,0,2]=4 1906 B12R0.234 CCCCCCCCCCC(=O)Cl Amb9787304 [0,2,0,0,0,0|0,0,0]=2 1907 B12R0.234 CCCCCCCCCCC(=O)O Amb3941499 [0,2,0,0,0,0|0,0,0]=2 1908 B12R0.234 CCCCCCCCCCC(C)=O Amb6366439 [0,2,0,0,0,0|0,0,0]=2 1909 B12R0.234 CCCCCCCCCCC(C)N Amb8869702 [0,2,0,0,0,0|1,0,1]=4 1910 B12R0.234 CCCCCCCCCCN(C)C Amb9787202 [0,2,0,0,0,0|1,0,1]=4 1911 B12R0.234 CCCCCCCCCOC(=S)[S-] Amb534232 [0,2,0,0,0,0|0,1,0]=3 1912 B12R0.234 CCCCCCCCCOC(C)=O Amb6366259 [0,2,0,0,0,0|0,0,0]=2 1913 B12R0.234 CCCCCCCCOCC(=O)O Amb7790043 [0,2,0,0,0,0|0,0,0]=2 1914 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [0,2,0,0,0,0|0,0,1]=3 1915 B12R0.234 CCOCCOCCCCC(=O)O Amb9207787 [0,2,0,0,0,0|1,0,0]=3 1916 B12R0.234 COCCOCCOCCC(=O)O Amb16184341 [0,2,0,0,0,0|2,0,0]=4 1917 B12R0.234 N#CCCCCCCCCC(=O)O Amb4008315 [0,2,0,0,0,0|0,0,1]=3 1918 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,2,0,0,0,0|0,0,0]=2 1919 B12R0.234 NCCCCCCCCCC(=O)O Amb31030991 [0,2,0,0,0,0|0,0,0]=2 1920 B12R0.234 NCCOCCSCCCC(=O)O Amb17502011 [0,2,0,0,0,0|2,0,0]=4 1921 B12R0.234 O=C(O)CCCCCCCC#CBr Amb32422815 [0,2,0,0,0,0|0,0,2]=4 1922 B12R0.234 O=C(O)CCCCCCCCCBr Amb4014619 [0,2,0,0,0,0|0,0,0]=2 1923 B12R0.234 O=C(O)CCCCCCCCCO Amb3940517 [0,2,0,0,0,0|0,0,0]=2 1924 B12R0.234 O=C(O)CCCCCCCN=C=S Amb33471542 [0,2,0,0,0,0|1,0,1]=4 1925 B12R0.234 O=C(O)\C=C\CCCCCCCO Amb33757093 [0,2,0,0,0,0|0,0,2]=4 1926 B12R0.234 O=C=NCCCCCCCC(=O)O Amb32665820 [0,2,0,0,0,0|1,0,1]=4 1927 B12R0.234 [N-]=[N+]=NCCCCCCCC(=O)O Amb34932690 [0,2,0,0,0,0|2,0,0]=4 1928 B12R0.248 C=CC(=O)NCCCCCCCC Amb28556071 [0,2,0,0,0,0|1,0,0]=3 1929 B12R0.248 C=CC(=O)OCCCCCCCC Amb2778626 [0,2,0,0,0,0|1,0,0]=3 1930 B12R0.248 C=CCCCCCCCC(=O)OC Amb533244 [0,2,0,0,0,0|0,0,2]=4 1931 B12R0.248 CCCCCCCCCC(=O)NN Amb6530432 [0,2,0,0,0,0|0,0,0]=2 1932 B12R0.248 CCCCCCCCCC(=O)NO Amb33548521 [0,2,0,0,0,0|0,0,0]=2 1933 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [0,2,0,0,0,0|0,0,0]=2 1934 B12R0.248 CCCCCCCCCC(C)C=O Amb3940427 [0,2,0,0,0,0|0,0,0]=2 1935 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,2,0,0,0,0|1,0,0]=3 1936 B12R0.248 CCCCCCCCNC(=O)CCl Amb9786173 [0,2,0,0,0,0|1,0,0]=3 1937 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,2,0,0,0,0|1,0,0]=3 1938 B12R0.248 CCCCCCCCNC(=S)NN Amb2689974 [0,2,0,0,0,0|1,1,0]=4 1939 B12R0.248 CCCCCCCCOC(=O)CN Amb2688623 [0,2,0,0,0,0|1,0,0]=3 1940 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,2,0,0,0,0|1,0,0]=3 1941 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [0,2,0,0,0,0|0,0,2]=4 1942 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [0,2,0,0,0,0|2,0,0]=4 1943 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [0,2,0,0,0,0|2,0,0]=4 1944 B12R0.248 CCNCCOCCCC(=O)OC Amb18107249 [0,2,0,0,0,0|2,0,0]=4 1945 B12R0.248 COC(=O)CCCCCCCC=O Amb8391799 [0,2,0,0,0,0|0,0,1]=3 1946 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [0,2,0,0,0,0|1,0,0]=3 1947 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [0,2,0,0,0,0|1,0,0]=3 1948 B12R0.248 COC(=O)CCCSCCCCN Amb17500973 [0,2,0,0,0,0|2,0,0]=4 1949 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [0,2,0,0,0,0|2,0,0]=4 1950 B12R0.4 CCCCCCCC(=O)CC(C)=O Amb19068864 [0,2,0,0,0,0|0,0,1]=3 1951 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [0,2,0,0,0,0|1,0,0]=3 1952 B12R0.4 CCCCCCCC(N)CC(=O)O Amb32666363 [0,2,0,0,0,0|0,0,0]=2 1953 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33141063 [0,2,0,0,0,0|0,0,0]=2 1954 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33533164 [0,2,0,0,0,0|0,0,0]=2 1955 B12R0.4 CCCCCCCC(N)CC(N)=O Amb33253906 [0,2,0,0,0,0|0,0,0]=2 1956 B12R0.4 CCCCCCCC(O)CC(=O)O Amb19071697 [0,2,0,0,0,0|0,0,0]=2 1957 B12R0.4 CCCCCCCC(O)CC(C)C Amb19070434 [0,2,0,0,0,0|1,0,1]=4 1958 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172824 [0,2,0,0,0,0|0,0,0]=2 1959 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172825 [0,2,0,0,0,0|0,0,0]=2 1960 B12R0.4 CCCCCCC[C@H](O)CC(=O)O Amb33620732 [0,2,0,0,0,0|0,0,0]=2 1961 B12R0.4 CCCCCCOC(C)NC(C)=O Amb24096324 [0,2,0,0,0,0|2,0,0]=4 1962 B12R0.49 CCCCCCCC(O)C(C)CN Amb32693175 [0,2,0,0,0,0|1,0,1]=4 1963 B12R0.277 CCCC(=O)CCCCCC(=O)O Amb6305242 [0,2,0,0,0,0|0,0,1]=3 1964 B12R0.277 CCOC(=O)CCCCCC(=O)O Amb2692048 [0,2,0,0,0,0|1,0,1]=4 1965 B12R0.57 CCCCCCCCC(CC)CO Amb28984598 [0,2,0,0,0,0|0,0,2]=4 1966 B12R0.184 CCC(=O)NCCCCCC(=O)O Amb1137874 [0,2,0,0,0,0|1,0,1]=4 1967 B12R0.184 COC(=O)CCCCCCC(=O)O Amb3940370 [0,2,0,0,0,0|1,0,1]=4 1968 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O Amb33802212 [0,2,0,0,0,0|0,0,2]=4 1969 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O Amb33802213 [0,2,0,0,0,0|0,0,2]=4 1970 B12R0.251 CCCCCCCCC(Br)C(=O)O Amb22347926 [0,2,0,0,0,0|0,0,0]=2 1971 B12R0.251 CCCCCCCCC(C)C(=O)O Amb19058533 [0,2,0,0,0,0|0,0,0]=2 1972 B12R0.251 CCCCCCCCC(F)=C(F)F Amb10840896 [0,2,0,0,0,0|1,0,1]=4 1973 B12R0.251 CCCCCCCCC(N)C(=O)O Amb4134809 [0,2,0,0,0,0|0,0,0]=2 1974 B12R0.251 CCCCCCCCC(N)C(N)=O Amb32937043 [0,2,0,0,0,0|0,0,0]=2 1975 B12R0.251 CCCCCCCCC(O)C(=O)O Amb6295799 [0,2,0,0,0,0|0,0,0]=2 1976 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [0,2,0,0,0,0|1,0,0]=3 1977 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O Amb22745440 [0,2,0,0,0,0|0,0,0]=2 1978 B12R0.251 CCCCCCCC[C@H](N)C(=O)O Amb28974737 [0,2,0,0,0,0|0,0,0]=2 1979 B12R0.251 CCCCCCCSC(C)C(=O)O Amb7794235 [0,2,0,0,0,0|1,0,0]=3 1980 B12R0.251 CCOCCOCCC(N)C(=O)O Amb19041139 [0,2,0,0,0,0|2,0,0]=4 1981 B12R0.251 CCOCCOCCC(N)C(N)=O Amb19040935 [0,2,0,0,0,0|2,0,0]=4 1982 B12R0.251 CCOCCOCC[C@@H](N)C(=O)O Amb33308864 [0,2,0,0,0,0|2,0,0]=4 1983 B12R0.251 CCOCCOCC[C@H](N)C(=O)O Amb33066024 [0,2,0,0,0,0|2,0,0]=4 1984 B12R0.251 COCCCOCCC(N)C(=O)O Amb19041138 [0,2,0,0,0,0|2,0,0]=4 1985 B12R0.251 COCCCOCCC(N)C(N)=O Amb19040934 [0,2,0,0,0,0|2,0,0]=4 1986 B12R0.251 COCCCOCC[C@@H](N)C(=O)O Amb33036667 [0,2,0,0,0,0|2,0,0]=4 1987 B12R0.251 COCCCOCC[C@H](N)C(=O)O Amb33308728 [0,2,0,0,0,0|2,0,0]=4 1988 B12R0.251 COCCOCCCC(N)C(=O)O Amb33036966 [0,2,0,0,0,0|2,0,0]=4 1989 B12R0.251 COCCOCCCC(N)C(N)=O Amb33065407 [0,2,0,0,0,0|2,0,0]=4 1990 B12R0.251 COCCOCCC[C@@H](N)C(=O)O Amb33308666 [0,2,0,0,0,0|2,0,0]=4 1991 B12R0.251 COCCOCCC[C@H](N)C(=O)O Amb33034716 [0,2,0,0,0,0|2,0,0]=4 1992 B12R0.251 NCCCCNCC[C@@H](N)C(=O)O Amb31031097 [0,2,0,0,0,0|2,0,0]=4 1993 B12R0.251 NCCCNCCC[C@@H](N)C(=O)O Amb31031096 [0,2,0,0,0,0|2,0,0]=4 1994 B12R0.312 C=CS(=O)(=O)CCCCCCCC Amb7968840 [0,2,0,0,0,0|2,0,0]=4 1995 B12R0.95 CCCCC(=O)CCCCC(=O)O Amb6305232 [0,2,0,0,0,0|0,0,1]=3 1996 B12R0.95 CCCCC(=O)NCCCC(=O)O Amb5741970 [0,2,0,0,0,0|1,0,1]=4 1997 B12R0.111 CCCCCCC(CBr)CCCC Amb22001704 [0,2,0,0,0,0|1,0,1]=4 1998 B12R0.255 CCCCCCC(=O)NCC(=O)O Amb9013683 [0,2,0,0,0,0|1,0,1]=4 1999 B12R0.255 CCCCCCC(O)CCC(=O)O Amb19071689 [0,2,0,0,0,0|0,0,0]=2 2000 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb19149307 [0,2,0,0,0,0|0,0,0]=2 2001 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb31145472 [0,2,0,0,0,0|0,0,0]=2 2002 B12R0.255 CCCCCNC(=O)CCC(=O)Cl Amb17143340 [0,2,0,0,0,0|1,0,1]=4 2003 B12R0.255 CCCCCNC(=O)CCC(N)=O Amb17143033 [0,2,0,0,0,0|1,0,1]=4 2004 B12R0.255 COCCCCN(C)CCC(=O)O Amb33339167 [0,2,0,0,0,0|2,0,0]=4 2005 B12R0.585 CCCCCCC(C)(N)CCCC Amb23560207 [0,2,0,0,0,0|1,0,1]=4 2006 B12R0.233 C=CCCCC(O)CCCC(=O)[O-] Amb32751163 [0,2,0,0,0,0|0,0,2]=4 2007 B12R0.233 CCCCCC(=O)CCCC(=O)O Amb6305235 [0,2,0,0,0,0|0,0,1]=3 2008 B12R0.119 CCCCCCCCCS(=O)(=O)Cl Amb22387375 [0,2,0,0,0,0|1,0,0]=3 2009 B12R0.119 CCCCCCCCCS(=O)(=O)F Amb32755112 [0,2,0,0,0,0|1,0,0]=3 2010 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] Amb8515940 [0,2,0,0,0,0|1,0,0]=3 2011 B12R0.119 CCCCCCCCCS(N)(=O)=O Amb32715391 [0,2,0,0,0,0|1,0,0]=3 2012 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] Amb8516739 [0,2,0,0,0,0|2,0,0]=4 2013 B12R0.119 CCCCCCOCCS(=O)(=O)Cl Amb32940011 [0,2,0,0,0,0|2,0,0]=4 2014 B12R0.119 CCCCCOCCCS(=O)(=O)Cl Amb32939811 [0,2,0,0,0,0|2,0,0]=4 2015 B12R0.119 CCCCOCCCCS(=O)(=O)Cl Amb32940392 [0,2,0,0,0,0|2,0,0]=4 2016 B12R0.119 CCCOCCCCCS(=O)(=O)Cl Amb32939825 [0,2,0,0,0,0|2,0,0]=4 2017 B12R0.119 CCOCCCCCCS(=O)(=O)Cl Amb32939864 [0,2,0,0,0,0|2,0,0]=4 2018 B12R0.268 C=C(F)CCCCCCCC(=O)O Amb22641501 [0,2,0,0,0,0|0,0,2]=4 2019 B12R0.268 CC(=O)CCCCCCCC(=O)O Amb17938671 [0,2,0,0,0,0|0,0,1]=3 2020 B12R0.268 CC(C)CCCCCCCC(=O)O Amb24117911 [0,2,0,0,0,0|0,0,0]=2 2021 B12R0.268 CC(C)CCOCCCCC(=O)O Amb9207788 [0,2,0,0,0,0|1,0,0]=3 2022 B12R0.268 CC(C)SCCCCCCC(=O)O Amb32410629 [0,2,0,0,0,0|1,0,0]=3 2023 B12R0.268 O=C(Cl)CCCCCCCC(=O)Cl Amb3940246 [0,2,0,0,0,0|1,0,1]=4 2024 B12R0.268 O=C(O)CCCCCCCC(=O)O Amb33550139 [0,2,0,0,0,0|1,0,1]=4 2025 B10R1.4 C=C1CCCCC1CCBr Amb28437183 [1,0,0,1,0,0|1,0,1]=4 2026 B10R1.4 C=C1CCCCC1CCO Amb27839461 [1,0,0,1,0,0|1,0,1]=4 2027 B10R1.4 C=CCC1CCCCC1=O Amb2720504 [1,0,0,1,0,0|0,0,2]=4 2028 B10R1.4 C=CCC1CCCCC1Cl Amb18800074 [1,0,0,1,0,0|1,0,1]=4 2029 B10R1.4 C=CCC1CCCCC1N Amb18285972 [1,0,0,1,0,0|1,0,1]=4 2030 B10R1.4 C=CCC1CCCCC1O Amb17939272 [1,0,0,1,0,0|1,0,1]=4 2031 B10R1.4 C=CCC1NCCCC1C Amb27763454 [1,0,0,1,0,0|1,0,1]=4 2032 B10R1.4 C=CC[C@@H]1CCCC[C@@H]1O Amb27208223 [1,0,0,1,0,0|1,0,1]=4 2033 B10R1.4 C=CC[C@@H]1CCCC[C@H]1O Amb22801953 [1,0,0,1,0,0|1,0,1]=4 2034 B10R1.4 C=CC[C@H]1CCCC[C@@H]1N Amb27969775 [1,0,0,1,0,0|1,0,1]=4 2035 B10R1.4 C=CC[C@H]1CCCC[C@H]1O Amb28133377 [1,0,0,1,0,0|1,0,1]=4 2036 B10R1.4 CC#CC1CCCCC1=O Amb24736857 [1,0,0,1,0,0|0,0,2]=4 2037 B10R1.4 CC1CC=CCC1CC=O Amb27256521 [1,0,0,1,0,0|0,0,2]=4 2038 B10R1.4 CC1CCCCC1CCBr Amb25268141 [1,0,0,1,0,0|1,0,0]=3 2039 B10R1.4 CC1CCCCC1CCCl Amb24480580 [1,0,0,1,0,0|1,0,0]=3 2040 B10R1.4 CC1CCCCC1CCN Amb17226686 [1,0,0,1,0,0|1,0,0]=3 2041 B10R1.4 CC1CCCCC1CCO Amb28050625 [1,0,0,1,0,0|0,0,1]=3 2042 B10R1.4 CC1CCCCC1N=C=O Amb17506222 [1,0,0,1,0,0|1,0,1]=4 2043 B10R1.4 CC1CCCCC1NC=O Amb27589339 [1,0,0,1,0,0|1,0,0]=3 2044 B10R1.4 CC1CCCCC1\C=C\Br Amb33135579 [1,0,0,1,0,0|1,0,1]=4 2045 B10R1.4 CC1CCCCN1CCCl Amb17334549 [1,0,0,1,0,0|2,0,0]=4 2046 B10R1.4 CC1CCCCN1CCF Amb27652471 [1,0,0,1,0,0|2,0,0]=4 2047 B10R1.4 CC1CCCCN1CCN Amb9710084 [1,0,0,1,0,0|2,0,0]=4 2048 B10R1.4 CC1CCCCN1CCO Amb9370152 [1,0,0,1,0,0|1,0,1]=4 2049 B10R1.4 CC1CCCC\C1=C/C=O Amb25951883 [1,0,0,1,0,0|0,0,2]=4 2050 B10R1.4 CC1CCCNC1CCCl Amb35677648 [1,0,0,1,0,0|2,0,0]=4 2051 B10R1.4 CC1CCCNC1CCF Amb29855047 [1,0,0,1,0,0|2,0,0]=4 2052 B10R1.4 CC1CCCNC1CCN Amb35689085 [1,0,0,1,0,0|2,0,0]=4 2053 B10R1.4 CC1CCCNC1CCO Amb27391619 [1,0,0,1,0,0|1,0,1]=4 2054 B10R1.4 CC1CNCCN1CC=O Amb27442045 [1,0,0,1,0,0|2,0,0]=4 2055 B10R1.4 CC1COCCC1CCN Amb27869189 [1,0,0,1,0,0|2,0,0]=4 2056 B10R1.4 CC1CSCCN1CC=O Amb27837574 [1,0,0,1,0,0|2,0,0]=4 2057 B10R1.4 CC1NCCCC1CCN Amb33040283 [1,0,0,1,0,0|2,0,0]=4 2058 B10R1.4 CCCC1=CCCCC1=O Amb24722898 [1,0,0,1,0,0|0,0,2]=4 2059 B10R1.4 CCCC1CCC=CC1=O Amb27750345 [1,0,0,1,0,0|0,0,2]=4 2060 B10R1.4 CCCC1CCCCC1=O Amb22228916 [1,0,0,1,0,0|0,0,0]=2 2061 B10R1.4 CCCC1CCCCC1C Amb22227983 [1,0,0,1,0,0|0,0,1]=3 2062 B10R1.4 CCCC1CCCCC1N Amb18282859 [1,0,0,1,0,0|1,0,0]=3 2063 B10R1.4 CCCC1CCCCC1O Amb4016404 [1,0,0,1,0,0|0,0,1]=3 2064 B10R1.4 CCCC1CCCCN1N Amb24478422 [1,0,0,1,0,0|2,0,0]=4 2065 B10R1.4 CCCC1CCCNC1=O Amb27475482 [1,0,0,1,0,0|1,0,0]=3 2066 B10R1.4 CCCC1CCCOC1=O Amb25068420 [1,0,0,1,0,0|1,0,0]=3 2067 B10R1.4 CCCC1CCNCC1=O Amb27629020 [1,0,0,1,0,0|1,0,0]=3 2068 B10R1.4 CCCC1CCNCC1F Amb27795220 [1,0,0,1,0,0|2,0,0]=4 2069 B10R1.4 CCCC1CCNCC1N Amb27200410 [1,0,0,1,0,0|2,0,0]=4 2070 B10R1.4 CCCC1CNCCC1C Amb27196368 [1,0,0,1,0,0|1,0,1]=4 2071 B10R1.4 CCCC1CNCCC1N Amb28385096 [1,0,0,1,0,0|2,0,0]=4 2072 B10R1.4 CCCC1COCCC1Br Amb28049978 [1,0,0,1,0,0|2,0,0]=4 2073 B10R1.4 CCCC1CSCCC1=O Amb24736412 [1,0,0,1,0,0|1,0,0]=3 2074 B10R1.4 CCCC1NCCCC1C Amb19149012 [1,0,0,1,0,0|1,0,1]=4 2075 B10R1.4 CCCC1NCCCC1C Amb21967908 [1,0,0,1,0,0|1,0,1]=4 2076 B10R1.4 CCCC1NCCNC1=O Amb18960335 [1,0,0,1,0,0|2,0,0]=4 2077 B10R1.4 CCCC1OCCCC1Cl Amb27165826 [1,0,0,1,0,0|2,0,0]=4 2078 B10R1.4 CCCC1OCCCC1N Amb28245061 [1,0,0,1,0,0|2,0,0]=4 2079 B10R1.4 CCCN1CCCCC1=S Amb25348522 [1,0,0,1,0,0|1,1,0]=4 2080 B10R1.4 CCCN1CCCNC1=O Amb28049410 [1,0,0,1,0,0|2,0,0]=4 2081 B10R1.4 CCCN1CCNCC1=O Amb18285094 [1,0,0,1,0,0|2,0,0]=4 2082 B10R1.4 CCCN1CCNCC1=O Amb22586868 [1,0,0,1,0,0|2,0,0]=4 2083 B10R1.4 CCCN1CCNCC1=O Amb32412620 [1,0,0,1,0,0|2,0,0]=4 2084 B10R1.4 CCC[C@@H]1CCCCC1=O Amb25146733 [1,0,0,1,0,0|0,0,0]=2 2085 B10R1.4 CCC[C@@H]1CCCC[C@@H]1O Amb28053539 [1,0,0,1,0,0|0,0,1]=3 2086 B10R1.4 CCC[C@@H]1CCCC[C@H]1O Amb28455302 [1,0,0,1,0,0|0,0,1]=3 2087 B10R1.4 CCC[C@@H]1CSCC[C@@H]1O Amb27206130 [1,0,0,1,0,0|1,0,1]=4 2088 B10R1.4 CCC[C@@H]1OCCC[C@H]1Cl Amb27778181 [1,0,0,1,0,0|2,0,0]=4 2089 B10R1.4 CCC[C@H]1CCCCN1C Amb27975671 [1,0,0,1,0,0|1,0,1]=4 2090 B10R1.4 CCC[C@H]1CCCC[C@@H]1C Amb24594797 [1,0,0,1,0,0|0,0,1]=3 2091 B10R1.4 CCC[C@H]1CCCC[C@H]1C Amb22230418 [1,0,0,1,0,0|0,0,1]=3 2092 B10R1.4 CCC[C@H]1CCCC[C@H]1O Amb27221631 [1,0,0,1,0,0|0,0,1]=3 2093 B10R1.4 CCC[C@H]1CCNC[C@H]1O Amb27203949 [1,0,0,1,0,0|1,0,1]=4 2094 B10R1.4 CCC[C@H]1CNCC[C@H]1O Amb27263789 [1,0,0,1,0,0|1,0,1]=4 2095 B10R1.4 CCC[C@H]1CSCC[C@@H]1O Amb28350245 [1,0,0,1,0,0|1,0,1]=4 2096 B10R1.4 CCC[C@H]1CSCC[C@H]1O Amb27880290 [1,0,0,1,0,0|1,0,1]=4 2097 B10R1.4 CCC[C@H]1NCCC[C@@H]1O Amb28400045 [1,0,0,1,0,0|1,0,1]=4 2098 B10R1.4 CCC[C@H]1SCCNC1=O Amb28042822 [1,0,0,1,0,0|2,0,0]=4 2099 B10R1.4 CCNC1CCCCC1C Amb19373031 [1,0,0,1,0,0|1,0,1]=4 2100 B10R1.4 CCNC1CCCCC1C Amb6268262 [1,0,0,1,0,0|1,0,1]=4 2101 B10R1.4 CCNC1CCCNC1=O Amb18284476 [1,0,0,1,0,0|2,0,0]=4 2102 B10R1.4 CCN[C@@H]1CCCC[C@@H]1O Amb23263425 [1,0,0,1,0,0|1,0,1]=4 2103 B10R1.4 CCN[C@@H]1CCCC[C@H]1O Amb10608084 [1,0,0,1,0,0|1,0,1]=4 2104 B10R1.4 CCN[C@H]1CCCC[C@H]1N Amb27454964 [1,0,0,1,0,0|2,0,0]=4 2105 B10R1.4 CCN[C@H]1CCCNC1=O Amb28367203 [1,0,0,1,0,0|2,0,0]=4 2106 B10R1.4 CCOC1CCCCC1=O Amb4605921 [1,0,0,1,0,0|1,0,0]=3 2107 B10R1.4 CCOC1CCCCC1Br Amb25049464 [1,0,0,1,0,0|2,0,0]=4 2108 B10R1.4 CCOC1CCCCC1Cl Amb27444058 [1,0,0,1,0,0|2,0,0]=4 2109 B10R1.4 CCOC1CCCCC1I Amb27457774 [1,0,0,1,0,0|2,0,0]=4 2110 B10R1.4 CCOC1CCCCC1N Amb6660607 [1,0,0,1,0,0|2,0,0]=4 2111 B10R1.4 CCOC1CCCCC1O Amb26398852 [1,0,0,1,0,0|1,0,1]=4 2112 B10R1.4 CCOC1CNCCC1=O Amb32674193 [1,0,0,1,0,0|2,0,0]=4 2113 B10R1.4 CCOC1COCCC1=O Amb25838738 [1,0,0,1,0,0|2,0,0]=4 2114 B10R1.4 CCO[C@@H]1CCCC[C@@H]1O Amb28410837 [1,0,0,1,0,0|1,0,1]=4 2115 B10R1.4 CCO[C@@H]1CCCC[C@H]1Br Amb28053584 [1,0,0,1,0,0|2,0,0]=4 2116 B10R1.4 CCO[C@@H]1CCCC[C@H]1N Amb24548037 [1,0,0,1,0,0|2,0,0]=4 2117 B10R1.4 CCO[C@@H]1CCCC[C@H]1O Amb25310010 [1,0,0,1,0,0|1,0,1]=4 2118 B10R1.4 CCO[C@H]1CCCC[C@@H]1O Amb27844174 [1,0,0,1,0,0|1,0,1]=4 2119 B10R1.4 CCSC1CCCCC1Cl Amb27407789 [1,0,0,1,0,0|2,0,0]=4 2120 B10R1.4 CCSC1CCCCC1N Amb20622604 [1,0,0,1,0,0|2,0,0]=4 2121 B10R1.4 CCSC1CCCCC1O Amb18792295 [1,0,0,1,0,0|1,0,1]=4 2122 B10R1.4 CCS[C@@H]1CCCC[C@@H]1O Amb27660252 [1,0,0,1,0,0|1,0,1]=4 2123 B10R1.4 CC\C=C1/CCCCC1=O Amb24690557 [1,0,0,1,0,0|0,0,2]=4 2124 B10R1.4 CN1CCCCC1CC=O Amb27643631 [1,0,0,1,0,0|1,0,0]=3 2125 B10R1.4 CN1CCCCC1CCBr Amb10608060 [1,0,0,1,0,0|2,0,0]=4 2126 B10R1.4 CN1CCCCC1CCBr Amb22587122 [1,0,0,1,0,0|2,0,0]=4 2127 B10R1.4 CN1CCCCC1CCCl Amb6608942 [1,0,0,1,0,0|2,0,0]=4 2128 B10R1.4 CN1CCCCC1CCCl Amb9173822 [1,0,0,1,0,0|2,0,0]=4 2129 B10R1.4 CN1CCCCC1CCN Amb4304395 [1,0,0,1,0,0|2,0,0]=4 2130 B10R1.4 CN1CCCCC1CCO Amb839453 [1,0,0,1,0,0|1,0,1]=4 2131 B10R1.4 CN1CCCCC1CCS Amb27426839 [1,0,0,1,0,0|1,1,0]=4 2132 B10R1.4 CN1CCOCC1CC=O Amb27667179 [1,0,0,1,0,0|2,0,0]=4 2133 B10R1.4 CNCC1CCCCC1Cl Amb28457954 [1,0,0,1,0,0|2,0,0]=4 2134 B10R1.4 CNCC1CCCCC1O Amb18644012 [1,0,0,1,0,0|1,0,1]=4 2135 B10R1.4 CNC[C@@H]1CCCC[C@@H]1N Amb27803047 [1,0,0,1,0,0|2,0,0]=4 2136 B10R1.4 CNC[C@@H]1CCCC[C@H]1O Amb28401548 [1,0,0,1,0,0|1,0,1]=4 2137 B10R1.4 COCC1CCCCC1=O Amb25265248 [1,0,0,1,0,0|1,0,0]=3 2138 B10R1.4 COCC1CCCCC1Cl Amb27152394 [1,0,0,1,0,0|2,0,0]=4 2139 B10R1.4 COCC1CCCCC1N Amb18124657 [1,0,0,1,0,0|2,0,0]=4 2140 B10R1.4 COCC1CCCCC1O Amb24727818 [1,0,0,1,0,0|1,0,1]=4 2141 B10R1.4 COCC1COCCC1=O Amb26447203 [1,0,0,1,0,0|2,0,0]=4 2142 B10R1.4 COC[C@@H]1CCCC[C@@H]1N Amb27968896 [1,0,0,1,0,0|2,0,0]=4 2143 B10R1.4 COC[C@@H]1CCCC[C@@H]1O Amb27667023 [1,0,0,1,0,0|1,0,1]=4 2144 B10R1.4 COC[C@@H]1CCCC[C@H]1Br Amb27782433 [1,0,0,1,0,0|2,0,0]=4 2145 B10R1.4 COC[C@@H]1CCCC[C@H]1O Amb33213668 [1,0,0,1,0,0|1,0,1]=4 2146 B10R1.4 COC[C@H]1CCCC[C@@H]1Br Amb28428563 [1,0,0,1,0,0|2,0,0]=4 2147 B10R1.4 COC[C@H]1CCCC[C@@H]1Cl Amb27484112 [1,0,0,1,0,0|2,0,0]=4 2148 B10R1.4 COC[C@H]1CCCC[C@@H]1N Amb28132665 [1,0,0,1,0,0|2,0,0]=4 2149 B10R1.4 C[C@@H]1CCC=C[C@H]1CC=O Amb28247973 [1,0,0,1,0,0|0,0,2]=4 2150 B10R1.4 C[C@@H]1CCCC[C@@H]1N=C=O Amb28053713 [1,0,0,1,0,0|1,0,1]=4 2151 B10R1.4 C[C@H]1CCCCN1CCO Amb28122935 [1,0,0,1,0,0|1,0,1]=4 2152 B10R1.4 C[C@H]1CCCN[C@H]1CCO Amb27881692 [1,0,0,1,0,0|1,0,1]=4 2153 B10R1.4 C[C@H]1CCCN[C@H]1CCS Amb27252279 [1,0,0,1,0,0|1,1,0]=4 2154 B10R1.4 N#CCC1CCCCC1=O Amb17593484 [1,0,0,1,0,0|1,0,1]=4 2155 B10R1.4 NCCC1CCCCC1=O Amb18202696 [1,0,0,1,0,0|1,0,0]=3 2156 B10R1.4 NCCC1CCCCC1O Amb18202445 [1,0,0,1,0,0|1,0,1]=4 2157 B10R1.4 NCCC1CCCNC1=O Amb18831625 [1,0,0,1,0,0|2,0,0]=4 2158 B10R1.4 NCCC1CCOCC1=O Amb18831579 [1,0,0,1,0,0|2,0,0]=4 2159 B10R1.4 NCCC1CCSCC1=O Amb18830316 [1,0,0,1,0,0|2,0,0]=4 2160 B10R1.4 NCCC1COCCC1=O Amb18831578 [1,0,0,1,0,0|2,0,0]=4 2161 B10R1.4 NCCC1CSCCC1=O Amb18830315 [1,0,0,1,0,0|2,0,0]=4 2162 B10R1.4 NCCC1OCCCC1=O Amb18831580 [1,0,0,1,0,0|2,0,0]=4 2163 B10R1.4 NCCN1CCCCC1=O Amb13951132 [1,0,0,1,0,0|2,0,0]=4 2164 B10R1.4 NCCN1CCCCC1=O Amb21954327 [1,0,0,1,0,0|2,0,0]=4 2165 B10R1.4 NCCN1CCCCC1=O Amb2785016 [1,0,0,1,0,0|2,0,0]=4 2166 B10R1.4 NCC[C@@H]1CCCC[C@@H]1Br Amb33229056 [1,0,0,1,0,0|2,0,0]=4 2167 B10R1.4 NCC[C@@H]1CCCC[C@@H]1Cl Amb33229055 [1,0,0,1,0,0|2,0,0]=4 2168 B10R1.4 NCC[C@@H]1CCCC[C@@H]1O Amb32719260 [1,0,0,1,0,0|1,0,1]=4 2169 B10R1.4 NCC[C@H]1CCCC[C@H]1N Amb33229058 [1,0,0,1,0,0|2,0,0]=4 2170 B10R1.4 N[C@@H]1CCCC[C@@H]1CCO Amb33189208 [1,0,0,1,0,0|1,0,1]=4 2171 B10R1.4 O=C1CCCCC1CCO Amb26606412 [1,0,0,1,0,0|1,0,0]=3 2172 B10R1.4 O=C1CCCCN1CCO Amb9370459 [1,0,0,1,0,0|2,0,0]=4 2173 B10R1.4 O=C1CCCCN1CCS Amb27837905 [1,0,0,1,0,0|2,0,0]=4 2174 B10R1.4 O=C1NCCCC1CCF Amb25927286 [1,0,0,1,0,0|2,0,0]=4 2175 B10R1.4 O=C1NCCCC1CCO Amb28189105 [1,0,0,1,0,0|2,0,0]=4 2176 B10R1.4 O=CCC1CCCCC1=O Amb17593548 [1,0,0,1,0,0|1,0,1]=4 2177 B10R1.4 O=CCC1CCCCC1F Amb28132903 [1,0,0,1,0,0|1,0,0]=3 2178 B10R1.4 O=CC[C@@H]1CCCC[C@H]1O Amb27841135 [1,0,0,1,0,0|1,0,0]=3 2179 B10R1.4 O=CC[C@@H]1OCCC[C@H]1O Amb28057497 [1,0,0,1,0,0|2,0,0]=4 2180 B10R1.4 O=CNC1CCCCC1Br Amb28120542 [1,0,0,1,0,0|2,0,0]=4 2181 B10R1.4 O=CNC1CCCCC1Cl Amb28118963 [1,0,0,1,0,0|2,0,0]=4 2182 B10R1.4 O=CN[C@@H]1CCCC[C@H]1O Amb28256004 [1,0,0,1,0,0|2,0,0]=4 2183 B10R1.4 O=COC1CCCCC1O Amb27780535 [1,0,0,1,0,0|2,0,0]=4 2184 B10R1.4 O=CO[C@@H]1CCCC[C@H]1Br Amb27224811 [1,0,0,1,0,0|2,0,0]=4 2185 B10R1.4 O=CO[C@@H]1CCCC[C@H]1Cl Amb27865522 [1,0,0,1,0,0|2,0,0]=4 2186 B10R1.4 O=CO[C@H]1CCCC[C@@H]1O Amb27452411 [1,0,0,1,0,0|2,0,0]=4 2187 B10R1.4 OCCC1CCCCC1F Amb28046356 [1,0,0,1,0,0|1,0,1]=4 2188 B10R1.4 OCCC1CCCCC1O Amb28126038 [1,0,0,1,0,0|1,0,1]=4 2189 B10R1.4 OCC[C@@H]1CCCC[C@@H]1F Amb25163783 [1,0,0,1,0,0|1,0,1]=4 2190 B10R1.4 OCC[C@@H]1CCCC[C@H]1F Amb27456760 [1,0,0,1,0,0|1,0,1]=4 2191 B10R1.4 [C-]#[N+]CC1CCCCC1C Amb27441232 [1,0,0,1,0,0|1,0,1]=4 2192 B10R1.5 C=CC1CCCC1CCO Amb28185135 [1,0,0,1,0,0|1,0,1]=4 2193 B10R1.5 C=CCC1CCCC1CO Amb28065113 [1,0,0,1,0,0|1,0,1]=4 2194 B10R1.5 C=CCC1CCCC1OC Amb27656760 [1,0,0,1,0,0|1,0,1]=4 2195 B10R1.5 C=CC[C@@H]1CCC[C@@H]1C=O Amb27253518 [1,0,0,1,0,0|0,0,2]=4 2196 B10R1.5 C=C[C@H]1CCC[C@H]1CCO Amb27451924 [1,0,0,1,0,0|1,0,1]=4 2197 B10R1.5 CCC1CCCC1CCN Amb27634757 [1,0,0,1,0,0|1,0,0]=3 2198 B10R1.5 CCC1CCCC1CCO Amb28400822 [1,0,0,1,0,0|0,0,1]=3 2199 B10R1.5 CCC1CCCC1CNC Amb28424281 [1,0,0,1,0,0|1,0,1]=4 2200 B10R1.5 CCC1CCCN1CCBr Amb27871576 [1,0,0,1,0,0|2,0,0]=4 2201 B10R1.5 CCC1CCCN1CCF Amb27822913 [1,0,0,1,0,0|2,0,0]=4 2202 B10R1.5 CCC1CCCN1CCI Amb27456080 [1,0,0,1,0,0|2,0,0]=4 2203 B10R1.5 CCC1CCCN1CCO Amb27396222 [1,0,0,1,0,0|1,0,1]=4 2204 B10R1.5 CCC1CCNC1CCO Amb32946707 [1,0,0,1,0,0|1,0,1]=4 2205 B10R1.5 CCC1COCC1CCN Amb35635557 [1,0,0,1,0,0|2,0,0]=4 2206 B10R1.5 CCC1COCC1NC=O Amb35617072 [1,0,0,1,0,0|2,0,0]=4 2207 B10R1.5 CCCC1CCCC1CN Amb25709046 [1,0,0,1,0,0|1,0,0]=3 2208 B10R1.5 CCCC1CCCC1CN Amb32662711 [1,0,0,1,0,0|1,0,0]=3 2209 B10R1.5 CCCC1CCNC1CC Amb18292290 [1,0,0,1,0,0|1,0,1]=4 2210 B10R1.5 CCCC1CNCC1CO Amb28293161 [1,0,0,1,0,0|1,0,1]=4 2211 B10R1.5 CCCC1COCC1C=O Amb29882921 [1,0,0,1,0,0|1,0,0]=3 2212 B10R1.5 CCCC1COCC1CBr Amb35632063 [1,0,0,1,0,0|2,0,0]=4 2213 B10R1.5 CCCC1COCC1CCl Amb35632062 [1,0,0,1,0,0|2,0,0]=4 2214 B10R1.5 CCCC1COCC1CN Amb27633583 [1,0,0,1,0,0|2,0,0]=4 2215 B10R1.5 CCCC1COCC1CO Amb35651593 [1,0,0,1,0,0|1,0,1]=4 2216 B10R1.5 CCCC1NCCC1CC Amb3788116 [1,0,0,1,0,0|1,0,1]=4 2217 B10R1.5 CCCC1OCCC1CO Amb27396359 [1,0,0,1,0,0|1,0,1]=4 2218 B10R1.5 CCCN1CCCC1CBr Amb27853988 [1,0,0,1,0,0|2,0,0]=4 2219 B10R1.5 CCCN1CCCC1CCl Amb28143573 [1,0,0,1,0,0|2,0,0]=4 2220 B10R1.5 CCCN1CCCC1CN Amb5754715 [1,0,0,1,0,0|2,0,0]=4 2221 B10R1.5 CCCN1CCCC1CO Amb25887502 [1,0,0,1,0,0|1,0,1]=4 2222 B10R1.5 CCCN1CCC[C@@H]1CBr Amb35654344 [1,0,0,1,0,0|2,0,0]=4 2223 B10R1.5 CCCN1CCC[C@@H]1CCl Amb35729758 [1,0,0,1,0,0|2,0,0]=4 2224 B10R1.5 CCCN1CCC[C@@H]1CN Amb27491024 [1,0,0,1,0,0|2,0,0]=4 2225 B10R1.5 CCCN1CCC[C@@H]1CO Amb27646126 [1,0,0,1,0,0|1,0,1]=4 2226 B10R1.5 CCCN1CCC[C@H]1CBr Amb29886434 [1,0,0,1,0,0|2,0,0]=4 2227 B10R1.5 CCCN1CCC[C@H]1CN Amb25929794 [1,0,0,1,0,0|2,0,0]=4 2228 B10R1.5 CCN1CCCC1CCN Amb18908375 [1,0,0,1,0,0|2,0,0]=4 2229 B10R1.5 CCN1CCC[C@@H]1CCN Amb24479194 [1,0,0,1,0,0|2,0,0]=4 2230 B10R1.5 CCN1CCC[C@H]1CCN Amb25069673 [1,0,0,1,0,0|2,0,0]=4 2231 B10R1.5 CCNC1CCCC1CCl Amb27868351 [1,0,0,1,0,0|2,0,0]=4 2232 B10R1.5 CCNC1CCCC1CO Amb27770377 [1,0,0,1,0,0|1,0,1]=4 2233 B10R1.5 CCOC1CCCC1CN Amb9286531 [1,0,0,1,0,0|2,0,0]=4 2234 B10R1.5 CCSC1CCCC1CN Amb9391474 [1,0,0,1,0,0|2,0,0]=4 2235 B10R1.5 CNC1CCCC1CCF Amb28285585 [1,0,0,1,0,0|2,0,0]=4 2236 B10R1.5 COC1CCCC1CCBr Amb24675783 [1,0,0,1,0,0|2,0,0]=4 2237 B10R1.5 COC1CCCC1CCCl Amb25688094 [1,0,0,1,0,0|2,0,0]=4 2238 B10R1.5 COCC1CCCN1C=O Amb26021267 [1,0,0,1,0,0|2,0,0]=4 2239 B10R1.5 COC[C@@H]1CCCN1C=O Amb22366880 [1,0,0,1,0,0|2,0,0]=4 2240 B10R1.5 COC[C@H]1CCCN1C=O Amb26430210 [1,0,0,1,0,0|2,0,0]=4 2241 B10R1.5 CSC1CCCC1NC=O Amb27865129 [1,0,0,1,0,0|2,0,0]=4 2242 B10R1.5 CSCC1CCCN1C=O Amb27779889 [1,0,0,1,0,0|2,0,0]=4 2243 B10R1.5 C\C=C/[C@@H]1CCC[C@H]1C=O Amb27248372 [1,0,0,1,0,0|0,0,2]=4 2244 B10R1.5 NCCC1CCCC1CF Amb27872717 [1,0,0,1,0,0|2,0,0]=4 2245 B10R1.5 NCCC1CCCC1CO Amb27454916 [1,0,0,1,0,0|1,0,1]=4 2246 B10R1.5 O=CCN1CCCC1CO Amb28123870 [1,0,0,1,0,0|2,0,0]=4 2247 B10R1.5 O=CCN1CCC[C@@H]1CO Amb29855350 [1,0,0,1,0,0|2,0,0]=4 2248 B10R1.5 O=CCN1CCC[C@H]1CO Amb35687991 [1,0,0,1,0,0|2,0,0]=4 2249 B10R1.5 O=CC[C@@H]1CCC[C@H]1C=O Amb27971291 [1,0,0,1,0,0|1,0,1]=4 2250 B10R1.5 O=CC[C@H]1CCC[C@@H]1C=O Amb28052715 [1,0,0,1,0,0|1,0,1]=4 2251 B10R1.5 O=CN1CCCC1CCO Amb24480455 [1,0,0,1,0,0|2,0,0]=4 2252 B10R1.5 O=CNC1CCCC1CO Amb27595568 [1,0,0,1,0,0|2,0,0]=4 2253 B10R1.5 OCC1CCCC1CCF Amb28435328 [1,0,0,1,0,0|1,0,1]=4 2254 B10R1.5 OCCC1CCCC1CO Amb28292112 [1,0,0,1,0,0|1,0,1]=4 2255 B10R1.7 BrC1CCCCCCC1Br Amb3988705 [1,0,0,1,0,0|2,0,0]=4 2256 B10R1.7 C=C1CCCCCCC1O Amb22365222 [1,0,0,1,0,0|1,0,1]=4 2257 B10R1.7 C=C1CCCCCC[C@H]1O Amb27839314 [1,0,0,1,0,0|1,0,1]=4 2258 B10R1.7 CC1=CCCCCCC1=O Amb27951533 [1,0,0,1,0,0|0,0,2]=4 2259 B10R1.7 CC1CCCCCCC1=O Amb4020430 [1,0,0,1,0,0|0,0,0]=2 2260 B10R1.7 C[C@@H]1CCCCCC[C@@H]1O Amb27805357 [1,0,0,1,0,0|0,0,1]=3 2261 B10R1.7 ClC1CCCCCCC1Cl Amb17670000 [1,0,0,1,0,0|2,0,0]=4 2262 B10R1.7 FC1CCCCCCC1Br Amb27592915 [1,0,0,1,0,0|2,0,0]=4 2263 B10R1.7 F[C@@H]1CCCCCC[C@H]1Br Amb28053496 [1,0,0,1,0,0|2,0,0]=4 2264 B10R1.7 NC1CCCCCCC1=O Amb28050100 [1,0,0,1,0,0|1,0,0]=3 2265 B10R1.7 NC1CCCCCCC1Br Amb27235922 [1,0,0,1,0,0|2,0,0]=4 2266 B10R1.7 NC1CCCCCNC1=O Amb26056483 [1,0,0,1,0,0|2,0,0]=4 2267 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O Amb27881602 [1,0,0,1,0,0|1,0,1]=4 2268 B10R1.7 N[C@@H]1CCCCCC[C@H]1O Amb27881642 [1,0,0,1,0,0|1,0,1]=4 2269 B10R1.7 N[C@@H]1CCCCCNC1=O Amb27210584 [1,0,0,1,0,0|2,0,0]=4 2270 B10R1.7 O=C1CCCCCCC1Br Amb26871305 [1,0,0,1,0,0|1,0,0]=3 2271 B10R1.7 O=C1CCCCCCC1Cl Amb22228745 [1,0,0,1,0,0|1,0,0]=3 2272 B10R1.7 O=C1CCCCCCC1F Amb27837778 [1,0,0,1,0,0|1,0,0]=3 2273 B10R1.7 O=C1CCCCCCC1O Amb22896567 [1,0,0,1,0,0|1,0,0]=3 2274 B10R1.7 O=C1NCCCCCC1Br Amb27799738 [1,0,0,1,0,0|2,0,0]=4 2275 B10R1.7 O=C1NCCCCCC1Cl Amb25706288 [1,0,0,1,0,0|2,0,0]=4 2276 B10R1.7 O=C1NCCCCCC1S Amb28074060 [1,0,0,1,0,0|2,0,0]=4 2277 B10R1.7 OC1CCCCCCC1Br Amb26583480 [1,0,0,1,0,0|1,0,1]=4 2278 B10R1.7 OC1CCCCCCC1Cl Amb27657772 [1,0,0,1,0,0|1,0,1]=4 2279 B10R1.7 OC1CCCCCCC1I Amb24675454 [1,0,0,1,0,0|1,0,1]=4 2280 B10R1.7 OC1CCCCCCC1O Amb17593625 [1,0,0,1,0,0|1,0,1]=4 2281 B10R1.7 O[C@@H]1CCCCCC[C@H]1F Amb27668749 [1,0,0,1,0,0|1,0,1]=4 2282 B10R1.7 O[C@H]1CCCCCC[C@@H]1O Amb25984160 [1,0,0,1,0,0|1,0,1]=4 2283 B10R1.7 O[C@H]1CCCCCC[C@H]1O Amb17670030 [1,0,0,1,0,0|1,0,1]=4 2284 B10R1.12 C=CC1CCN1CCCC Amb28122843 [1,0,0,1,0,0|1,0,1]=4 2285 B10R1.12 C=CCCC1CCC1CN Amb27204981 [1,0,0,1,0,0|1,0,1]=4 2286 B10R1.12 C=CCCN1CCC1CC Amb27466590 [1,0,0,1,0,0|1,0,1]=4 2287 B10R1.12 C=CCNC1CCC1CC Amb28453450 [1,0,0,1,0,0|1,0,1]=4 2288 B10R1.12 CCC1CCN1CCCO Amb27805726 [1,0,0,1,0,0|1,0,1]=4 2289 B10R1.12 CCCCC1CCC1CN Amb24427713 [1,0,0,1,0,0|1,0,0]=3 2290 B10R1.12 CCCCN1CCC1CN Amb33251955 [1,0,0,1,0,0|2,0,0]=4 2291 B10R1.12 CCCC[C@H]1CN[C@@H]1CO Amb27446832 [1,0,0,1,0,0|1,0,1]=4 2292 B10R1.12 CCNCC1CCC1CC Amb28049530 [1,0,0,1,0,0|1,0,1]=4 2293 B10R1.17 BrCCCC1CCCCC1 Amb3940591 [1,0,0,1,0,0|1,0,0]=3 2294 B10R1.17 BrCCCC1CCCCN1 Amb22274731 [1,0,0,1,0,0|2,0,0]=4 2295 B10R1.17 BrCCCC1CCCCO1 Amb25684382 [1,0,0,1,0,0|1,0,1]=4 2296 B10R1.17 BrCCCC1CCCNC1 Amb22288924 [1,0,0,1,0,0|2,0,0]=4 2297 B10R1.17 BrCCCC1CCCOC1 Amb26397982 [1,0,0,1,0,0|2,0,0]=4 2298 B10R1.17 BrCCCC1CCCSC1 Amb33008107 [1,0,0,1,0,0|2,0,0]=4 2299 B10R1.17 BrCCCC1CCNCC1 Amb22274049 [1,0,0,1,0,0|2,0,0]=4 2300 B10R1.17 BrCCCC1CCOCC1 Amb27865226 [1,0,0,1,0,0|2,0,0]=4 2301 B10R1.17 BrCCCN1CCCCC1 Amb10608787 [1,0,0,1,0,0|2,0,0]=4 2302 B10R1.17 BrCCCN1CCCCC1 Amb22058914 [1,0,0,1,0,0|2,0,0]=4 2303 B10R1.17 BrCCOC1CCCCC1 Amb6255378 [1,0,0,1,0,0|2,0,0]=4 2304 B10R1.17 BrCCSC1CCCCC1 Amb25852355 [1,0,0,1,0,0|2,0,0]=4 2305 B10R1.17 Br[Mg]CCC1CCCCC1 Amb6300512 [1,0,0,1,0,0|2,0,0]=4 2306 B10R1.17 Br[Zn]CCC1CCCCC1 Amb22000504 [1,0,0,1,0,0|2,0,0]=4 2307 B10R1.17 Br\C=C\CC1CCCCC1 Amb33135221 [1,0,0,1,0,0|1,0,1]=4 2308 B10R1.17 C#CCCC1CCCCC1 Amb19888351 [1,0,0,1,0,0|0,0,2]=4 2309 B10R1.17 C=CCCC1CCCCN1 Amb27262240 [1,0,0,1,0,0|1,0,1]=4 2310 B10R1.17 C=CCCC1CCCOC1 Amb28050486 [1,0,0,1,0,0|1,0,1]=4 2311 B10R1.17 C=CCCC1CCOCC1 Amb27475927 [1,0,0,1,0,0|1,0,1]=4 2312 B10R1.17 C=CCCC1CCSCC1 Amb28370066 [1,0,0,1,0,0|1,0,1]=4 2313 B10R1.17 C=CCC[C@@H]1CCCOC1 Amb27396055 [1,0,0,1,0,0|1,0,1]=4 2314 B10R1.17 C=CCC[C@@H]1CCCSC1 Amb27751904 [1,0,0,1,0,0|1,0,1]=4 2315 B10R1.17 C=CCNC1CCCCC1 Amb2720306 [1,0,0,1,0,0|1,0,1]=4 2316 B10R1.17 C=CCSC1CCCCC1 Amb27224877 [1,0,0,1,0,0|1,0,1]=4 2317 B10R1.17 C=COCC1CCCCC1 Amb27792573 [1,0,0,1,0,0|1,0,1]=4 2318 B10R1.17 CCCCC1=CCCCO1 Amb27232240 [1,0,0,1,0,0|1,0,1]=4 2319 B10R1.17 CCCCC1CCCCC1 Amb8513429 [1,0,0,1,0,0|0,0,1]=3 2320 B10R1.17 CCCCC1CCCCN1 Amb2234936 [1,0,0,1,0,0|1,0,0]=3 2321 B10R1.17 CCCCC1CCCCN1 Amb2237216 [1,0,0,1,0,0|1,0,0]=3 2322 B10R1.17 CCCCC1CCCNC1 Amb18296090 [1,0,0,1,0,0|1,0,1]=4 2323 B10R1.17 CCCCC1CCNCC1 Amb10602649 [1,0,0,1,0,0|1,0,1]=4 2324 B10R1.17 CCCCC1CCNCC1 Amb2721350 [1,0,0,1,0,0|1,0,1]=4 2325 B10R1.17 CCCCC1CCOCO1 Amb27837861 [1,0,0,1,0,0|1,0,1]=4 2326 B10R1.17 CCCCC1CNCCN1 Amb25324038 [1,0,0,1,0,0|2,0,0]=4 2327 B10R1.17 CCCCC1CNCCO1 Amb17193971 [1,0,0,1,0,0|1,0,1]=4 2328 B10R1.17 CCCCC1COCCN1 Amb24587760 [1,0,0,1,0,0|2,0,0]=4 2329 B10R1.17 CCCCC1CSCCN1 Amb27157553 [1,0,0,1,0,0|2,0,0]=4 2330 B10R1.17 CCCCC1NCCCS1 Amb4032845 [1,0,0,1,0,0|1,1,0]=4 2331 B10R1.17 CCCC[C@@H]1CNCCN1 Amb27411420 [1,0,0,1,0,0|2,0,0]=4 2332 B10R1.17 CCCC[C@@H]1COCCN1 Amb27838897 [1,0,0,1,0,0|2,0,0]=4 2333 B10R1.17 CCCC[C@H]1CCCCN1 Amb27425011 [1,0,0,1,0,0|1,0,0]=3 2334 B10R1.17 CCCC[C@H]1CNCCO1 Amb28128437 [1,0,0,1,0,0|1,0,1]=4 2335 B10R1.17 CCCNC1CCCCC1 Amb1834965 [1,0,0,1,0,0|1,0,1]=4 2336 B10R1.17 CCCNC1CCCCC1 Amb6537893 [1,0,0,1,0,0|1,0,1]=4 2337 B10R1.17 CCCNC1CCCCO1 Amb27798904 [1,0,0,1,0,0|1,0,1]=4 2338 B10R1.17 CCCSC1=CCCCC1 Amb25259789 [1,0,0,1,0,0|1,0,1]=4 2339 B10R1.17 CCNCC1C=CCCC1 Amb28050368 [1,0,0,1,0,0|1,0,1]=4 2340 B10R1.17 CCNCC1CCCCC1 Amb2119472 [1,0,0,1,0,0|1,0,1]=4 2341 B10R1.17 CCNCC1CCCCC1 Amb6278188 [1,0,0,1,0,0|1,0,1]=4 2342 B10R1.17 CCNCC1CCCCO1 Amb10808747 [1,0,0,1,0,0|1,0,1]=4 2343 B10R1.17 CCNCC1CCCCO1 Amb9258711 [1,0,0,1,0,0|1,0,1]=4 2344 B10R1.17 CCOCC1CCCCN1 Amb28555406 [1,0,0,1,0,0|2,0,0]=4 2345 B10R1.17 CCOCC1CCCCN1 Amb6281647 [1,0,0,1,0,0|2,0,0]=4 2346 B10R1.17 CCSCC1CCCCN1 Amb18980992 [1,0,0,1,0,0|2,0,0]=4 2347 B10R1.17 CCSCC1CCCCN1 Amb35745532 [1,0,0,1,0,0|2,0,0]=4 2348 B10R1.17 CNCCC1=CCCCC1 Amb17309051 [1,0,0,1,0,0|1,0,1]=4 2349 B10R1.17 CNCCC1CCCCC1 Amb34913787 [1,0,0,1,0,0|1,0,1]=4 2350 B10R1.17 CNCCC1CCCCC1 Amb8853653 [1,0,0,1,0,0|1,0,1]=4 2351 B10R1.17 CNCCC1CCCCO1 Amb10607311 [1,0,0,1,0,0|1,0,1]=4 2352 B10R1.17 CNCCC1CCCCO1 Amb17505552 [1,0,0,1,0,0|1,0,1]=4 2353 B10R1.17 CNCCC1CCCCS1 Amb27966314 [1,0,0,1,0,0|1,1,0]=4 2354 B10R1.17 COCCC1CCCCC1 Amb27424751 [1,0,0,1,0,0|1,0,1]=4 2355 B10R1.17 COCCC1CCCCN1 Amb20241121 [1,0,0,1,0,0|2,0,0]=4 2356 B10R1.17 COCCC1CCCCN1 Amb3941331 [1,0,0,1,0,0|2,0,0]=4 2357 B10R1.17 COCC[C@@H]1CCCCN1 Amb28250781 [1,0,0,1,0,0|2,0,0]=4 2358 B10R1.17 CSCCC1CCCCC1 Amb28049797 [1,0,0,1,0,0|1,0,1]=4 2359 B10R1.17 CSCCC1CCCCN1 Amb18042908 [1,0,0,1,0,0|2,0,0]=4 2360 B10R1.17 ClCCCC1=CCCCC1 Amb28197612 [1,0,0,1,0,0|1,0,1]=4 2361 B10R1.17 ClCCCC1C=CCCC1 Amb27494077 [1,0,0,1,0,0|1,0,1]=4 2362 B10R1.17 ClCCCC1CCCCC1 Amb8858810 [1,0,0,1,0,0|1,0,0]=3 2363 B10R1.17 ClCCCC1CCCOC1 Amb25847837 [1,0,0,1,0,0|2,0,0]=4 2364 B10R1.17 ClCCCC1CCNCC1 Amb22299866 [1,0,0,1,0,0|2,0,0]=4 2365 B10R1.17 ClCCCC1CCOCC1 Amb18798173 [1,0,0,1,0,0|2,0,0]=4 2366 B10R1.17 ClCCCN1CCCCC1 Amb10075486 [1,0,0,1,0,0|2,0,0]=4 2367 B10R1.17 ClCCCN1CCCCC1 Amb16231350 [1,0,0,1,0,0|2,0,0]=4 2368 B10R1.17 ClCCNC1CCCCC1 Amb17334544 [1,0,0,1,0,0|2,0,0]=4 2369 B10R1.17 ClCCNC1CCCCC1 Amb19373960 [1,0,0,1,0,0|2,0,0]=4 2370 B10R1.17 ClCCOC1CCCCC1 Amb8828463 [1,0,0,1,0,0|2,0,0]=4 2371 B10R1.17 ClCCSC1CCCCC1 Amb18804844 [1,0,0,1,0,0|2,0,0]=4 2372 B10R1.17 ClCOCC1CCCCC1 Amb28283794 [1,0,0,1,0,0|2,0,0]=4 2373 B10R1.17 FCCCC1CCCCN1 Amb27448245 [1,0,0,1,0,0|2,0,0]=4 2374 B10R1.17 FCCCC1CCCNC1 Amb26857255 [1,0,0,1,0,0|2,0,0]=4 2375 B10R1.17 FCCCC1CCNCC1 Amb28348644 [1,0,0,1,0,0|2,0,0]=4 2376 B10R1.17 FCCCC1CCNCC1 Amb33804564 [1,0,0,1,0,0|2,0,0]=4 2377 B10R1.17 FCCSC1CCCCC1 Amb28315950 [1,0,0,1,0,0|2,0,0]=4 2378 B10R1.17 ICCCC1CCCCC1 Amb27273231 [1,0,0,1,0,0|1,0,0]=3 2379 B10R1.17 ICCCC1CCNCC1 Amb22296939 [1,0,0,1,0,0|2,0,0]=4 2380 B10R1.17 ICCCN1CCCCC1 Amb25072136 [1,0,0,1,0,0|2,0,0]=4 2381 B10R1.17 ICCCN1CCCCC1 Amb33734342 [1,0,0,1,0,0|2,0,0]=4 2382 B10R1.17 ICCNC1CCCCC1 Amb27945313 [1,0,0,1,0,0|2,0,0]=4 2383 B10R1.17 N#CCCC1CCCCC1 Amb7969719 [1,0,0,1,0,0|1,0,1]=4 2384 B10R1.17 NCCCC1=CCCCC1 Amb18643470 [1,0,0,1,0,0|1,0,1]=4 2385 B10R1.17 NCCCC1CCCCC1 Amb6255273 [1,0,0,1,0,0|1,0,0]=3 2386 B10R1.17 NCCCC1CCCCN1 Amb18295943 [1,0,0,1,0,0|2,0,0]=4 2387 B10R1.17 NCCCC1CCCCO1 Amb18251264 [1,0,0,1,0,0|1,0,1]=4 2388 B10R1.17 NCCCC1CCCOC1 Amb27434489 [1,0,0,1,0,0|2,0,0]=4 2389 B10R1.17 NCCCC1CCCSC1 Amb32726223 [1,0,0,1,0,0|2,0,0]=4 2390 B10R1.17 NCCCC1CCNCC1 Amb18295942 [1,0,0,1,0,0|2,0,0]=4 2391 B10R1.17 NCCCC1CCOCC1 Amb22546279 [1,0,0,1,0,0|2,0,0]=4 2392 B10R1.17 NCCCC1CCOCC1 Amb33530370 [1,0,0,1,0,0|2,0,0]=4 2393 B10R1.17 NCCCN1CCCCC1 Amb1154367 [1,0,0,1,0,0|2,0,0]=4 2394 B10R1.17 NCCCN1CCCCC1 Amb22491377 [1,0,0,1,0,0|2,0,0]=4 2395 B10R1.17 NCCNC1CCCCC1 Amb17091018 [1,0,0,1,0,0|2,0,0]=4 2396 B10R1.17 NCCNC1CCCCC1 Amb29844466 [1,0,0,1,0,0|2,0,0]=4 2397 B10R1.17 NCCOC1CCCCC1 Amb10609744 [1,0,0,1,0,0|2,0,0]=4 2398 B10R1.17 NCCOC1CCCCC1 Amb1133917 [1,0,0,1,0,0|2,0,0]=4 2399 B10R1.17 NCCSC1CCCCC1 Amb844772 [1,0,0,1,0,0|2,0,0]=4 2400 B10R1.17 NNCCC1CCCCC1 Amb33527625 [1,0,0,1,0,0|2,0,0]=4 2401 B10R1.17 NNCCC1CCCCC1 Amb6744627 [1,0,0,1,0,0|2,0,0]=4 2402 B10R1.17 NOCCC1CCCCC1 Amb26365361 [1,0,0,1,0,0|2,0,0]=4 2403 B10R1.17 O=C=NCC1CCCCC1 Amb22348012 [1,0,0,1,0,0|1,0,1]=4 2404 B10R1.17 O=CC#CC1CCCCC1 Amb17593454 [1,0,0,1,0,0|0,0,2]=4 2405 B10R1.17 O=CCCC1C=CCCC1 Amb28077624 [1,0,0,1,0,0|0,0,2]=4 2406 B10R1.17 O=CCCC1CC=CCC1 Amb18643322 [1,0,0,1,0,0|0,0,2]=4 2407 B10R1.17 O=CCCC1CCCCC1 Amb3372079 [1,0,0,1,0,0|0,0,0]=2 2408 B10R1.17 O=CCCC1CCCCN1 Amb17593576 [1,0,0,1,0,0|1,0,0]=3 2409 B10R1.17 O=CCCC1CCCCO1 Amb27634719 [1,0,0,1,0,0|1,0,0]=3 2410 B10R1.17 O=CCCC1CCCOC1 Amb25867773 [1,0,0,1,0,0|1,0,0]=3 2411 B10R1.17 O=CCCC1CCCSC1 Amb25312526 [1,0,0,1,0,0|1,0,0]=3 2412 B10R1.17 O=CCCC1CCOCC1 Amb24372180 [1,0,0,1,0,0|1,0,0]=3 2413 B10R1.17 O=CCCN1CCCCC1 Amb25957250 [1,0,0,1,0,0|1,0,0]=3 2414 B10R1.17 O=CCCN1CCNCC1 Amb18991446 [1,0,0,1,0,0|2,0,0]=4 2415 B10R1.17 O=CCCN1CCOCC1 Amb22263099 [1,0,0,1,0,0|2,0,0]=4 2416 B10R1.17 O=CCCN1CCOCC1 Amb22491435 [1,0,0,1,0,0|2,0,0]=4 2417 B10R1.17 O=CCCN1CCOCC1 Amb32882555 [1,0,0,1,0,0|2,0,0]=4 2418 B10R1.17 O=CCC[C@@H]1COCCO1 Amb27762561 [1,0,0,1,0,0|2,0,0]=4 2419 B10R1.17 O=CCOC1CCCCC1 Amb28423544 [1,0,0,1,0,0|1,0,0]=3 2420 B10R1.17 O=CCOC1CCCCO1 Amb18202407 [1,0,0,1,0,0|2,0,0]=4 2421 B10R1.17 O=CCOC1CCOCC1 Amb28381886 [1,0,0,1,0,0|2,0,0]=4 2422 B10R1.17 O=CCSC1CCOCC1 Amb18177709 [1,0,0,1,0,0|2,0,0]=4 2423 B10R1.17 O=CNCC1CCCCC1 Amb27394363 [1,0,0,1,0,0|1,0,0]=3 2424 B10R1.17 O=C\C=C\C1CCCCC1 Amb18643296 [1,0,0,1,0,0|0,0,2]=4 2425 B10R1.17 OCCCC1=CCCCC1 Amb27839367 [1,0,0,1,0,0|1,0,1]=4 2426 B10R1.17 OCCCC1CCCCC1 Amb3354800 [1,0,0,1,0,0|0,0,1]=3 2427 B10R1.17 OCCCC1CCCCN1 Amb22229403 [1,0,0,1,0,0|1,0,1]=4 2428 B10R1.17 OCCCC1CCCCN1 Amb2700051 [1,0,0,1,0,0|1,0,1]=4 2429 B10R1.17 OCCCC1CCCCO1 Amb27471574 [1,0,0,1,0,0|1,0,1]=4 2430 B10R1.17 OCCCC1CCCNC1 Amb2700052 [1,0,0,1,0,0|1,0,1]=4 2431 B10R1.17 OCCCC1CCCOC1 Amb26446849 [1,0,0,1,0,0|1,0,1]=4 2432 B10R1.17 OCCCC1CCCSC1 Amb32726174 [1,0,0,1,0,0|1,0,1]=4 2433 B10R1.17 OCCCC1CCNCC1 Amb13888748 [1,0,0,1,0,0|1,0,1]=4 2434 B10R1.17 OCCCC1CCNCC1 Amb5501634 [1,0,0,1,0,0|1,0,1]=4 2435 B10R1.17 OCCCC1CCOCC1 Amb33531031 [1,0,0,1,0,0|1,0,1]=4 2436 B10R1.17 OCCCN1CCCCC1 Amb3939468 [1,0,0,1,0,0|1,0,1]=4 2437 B10R1.17 OCCNC1CCCCC1 Amb2137276 [1,0,0,1,0,0|1,0,1]=4 2438 B10R1.17 OCCOC1CCCCC1 Amb6893053 [1,0,0,1,0,0|1,0,1]=4 2439 B10R1.17 OCCPC1CCCCC1 Amb28381747 [1,0,0,1,0,0|1,0,1]=4 2440 B10R1.17 OCCSC1CCCCC1 Amb9362993 [1,0,0,1,0,0|1,0,1]=4 2441 B10R1.17 ONCCC1CCCCC1 Amb25355289 [1,0,0,1,0,0|1,0,1]=4 2442 B10R1.17 SCCCC1CCCCC1 Amb24644638 [1,0,0,1,0,0|0,1,0]=3 2443 B10R1.17 SCCCC1CCCCO1 Amb33374893 [1,0,0,1,0,0|1,0,1]=4 2444 B10R1.17 SCCCC1CCCNC1 Amb22298497 [1,0,0,1,0,0|1,1,0]=4 2445 B10R1.17 SCCCC1CCCOC1 Amb33321774 [1,0,0,1,0,0|1,1,0]=4 2446 B10R1.17 SCCCC1CCCSC1 Amb33224505 [1,0,0,1,0,0|1,1,0]=4 2447 B10R1.17 SCCCC1CCNCC1 Amb22298495 [1,0,0,1,0,0|1,1,0]=4 2448 B10R1.17 SCCCC1CCOCC1 Amb26049814 [1,0,0,1,0,0|1,1,0]=4 2449 B10R1.17 SCCCN1CCCCC1 Amb25032260 [1,0,0,1,0,0|1,1,0]=4 2450 B10R1.17 SCCNC1CCCCC1 Amb33473728 [1,0,0,1,0,0|1,1,0]=4 2451 B10R1.17 SCCNC1CCCCC1 Amb4006446 [1,0,0,1,0,0|1,1,0]=4 2452 B10R1.17 [C-]#[N+]CCC1CCCCC1 Amb33225140 [1,0,0,1,0,0|1,0,1]=4 2453 B10R1.19 C#CC1CCCCCC1=O Amb27458674 [1,0,0,1,0,0|0,0,2]=4 2454 B10R1.19 C=C1CCCCCC1CC Amb35681185 [1,0,0,1,0,0|0,0,1]=3 2455 B10R1.19 C=CC1CCCCCC1O Amb24748257 [1,0,0,1,0,0|1,0,1]=4 2456 B10R1.19 C=C[C@@H]1CCCCC[C@H]1O Amb32945032 [1,0,0,1,0,0|1,0,1]=4 2457 B10R1.19 CC1CCCCC=C1C=O Amb28240981 [1,0,0,1,0,0|0,0,2]=4 2458 B10R1.19 CC1CCCCCC1C#N Amb35608213 [1,0,0,1,0,0|1,0,1]=4 2459 B10R1.19 CC1CCCCCC1C=O Amb28049958 [1,0,0,1,0,0|0,0,0]=2 2460 B10R1.19 CC1CCCCCC1CBr Amb35721304 [1,0,0,1,0,0|1,0,0]=3 2461 B10R1.19 CC1CCCCCC1CCl Amb35721303 [1,0,0,1,0,0|1,0,0]=3 2462 B10R1.19 CC1CCCCCC1CO Amb27978202 [1,0,0,1,0,0|0,0,1]=3 2463 B10R1.19 CC1CCCCCC1NN Amb35734053 [1,0,0,1,0,0|2,0,0]=4 2464 B10R1.19 CC1CCCCCC1NO Amb35726891 [1,0,0,1,0,0|1,0,1]=4 2465 B10R1.19 CC1CCNCCC1CN Amb27965553 [1,0,0,1,0,0|2,0,0]=4 2466 B10R1.19 CC1CCNCCC1CO Amb27633588 [1,0,0,1,0,0|1,0,1]=4 2467 B10R1.19 CC1CCNCCN1C=O Amb27591904 [1,0,0,1,0,0|2,0,0]=4 2468 B10R1.19 CCC1CCCCCC1=O Amb25948482 [1,0,0,1,0,0|0,0,0]=2 2469 B10R1.19 CCC1CCCCCC1Br Amb27197752 [1,0,0,1,0,0|1,0,0]=3 2470 B10R1.19 CCC1CCCCCC1Cl Amb18800488 [1,0,0,1,0,0|1,0,0]=3 2471 B10R1.19 CCC1CCCCCC1N Amb18279403 [1,0,0,1,0,0|1,0,0]=3 2472 B10R1.19 CCC1CCCCCC1O Amb27972743 [1,0,0,1,0,0|0,0,1]=3 2473 B10R1.19 CCC1CCCCCC1S Amb32788876 [1,0,0,1,0,0|0,1,0]=3 2474 B10R1.19 CCC1CNCCNC1=O Amb27877963 [1,0,0,1,0,0|2,0,0]=4 2475 B10R1.19 CCC1NCCCNC1=O Amb26546872 [1,0,0,1,0,0|2,0,0]=4 2476 B10R1.19 CCN1CCCNCC1=O Amb24524558 [1,0,0,1,0,0|2,0,0]=4 2477 B10R1.19 CCN1CCCNCC1=O Amb33212644 [1,0,0,1,0,0|2,0,0]=4 2478 B10R1.19 CCN1CCNCCC1=O Amb21959077 [1,0,0,1,0,0|2,0,0]=4 2479 B10R1.19 CCN1CCNCCC1=O Amb32410399 [1,0,0,1,0,0|2,0,0]=4 2480 B10R1.19 CC[C@@H]1CCCCC[C@@H]1N Amb27421958 [1,0,0,1,0,0|1,0,0]=3 2481 B10R1.19 CC[C@@H]1CCCCC[C@H]1O Amb33213860 [1,0,0,1,0,0|0,0,1]=3 2482 B10R1.19 CC[C@@H]1NCCCNC1=O Amb32671416 [1,0,0,1,0,0|2,0,0]=4 2483 B10R1.19 CC[C@H]1CCCCCC1=O Amb27951448 [1,0,0,1,0,0|0,0,0]=2 2484 B10R1.19 CC[C@H]1NCCCNC1=O Amb25726155 [1,0,0,1,0,0|2,0,0]=4 2485 B10R1.19 CN1CCCCCC1C=O Amb27633340 [1,0,0,1,0,0|1,0,0]=3 2486 B10R1.19 CN1CCCCCC1CBr Amb27477574 [1,0,0,1,0,0|2,0,0]=4 2487 B10R1.19 CN1CCCCCC1CCl Amb27813801 [1,0,0,1,0,0|2,0,0]=4 2488 B10R1.19 CN1CCCCCC1CN Amb8010482 [1,0,0,1,0,0|2,0,0]=4 2489 B10R1.19 CN1CCCCCC1CO Amb28343208 [1,0,0,1,0,0|1,0,1]=4 2490 B10R1.19 CNC1CCCCCC1O Amb18944292 [1,0,0,1,0,0|1,0,1]=4 2491 B10R1.19 CNC1CCCCNC1=O Amb9721933 [1,0,0,1,0,0|2,0,0]=4 2492 B10R1.19 CN[C@@H]1CCCCC[C@H]1O Amb27249838 [1,0,0,1,0,0|1,0,1]=4 2493 B10R1.19 COC1CCCCCC1=O Amb26329265 [1,0,0,1,0,0|1,0,0]=3 2494 B10R1.19 COC1CCCCCC1Br Amb25127098 [1,0,0,1,0,0|2,0,0]=4 2495 B10R1.19 COC1CCCCCC1I Amb28455072 [1,0,0,1,0,0|2,0,0]=4 2496 B10R1.19 COC1CCCCCC1N Amb1133373 [1,0,0,1,0,0|2,0,0]=4 2497 B10R1.19 COC1CCCCCC1N Amb20623557 [1,0,0,1,0,0|2,0,0]=4 2498 B10R1.19 COC1CCCCCC1O Amb24478034 [1,0,0,1,0,0|1,0,1]=4 2499 B10R1.19 CO[C@@H]1CCCCC[C@H]1N Amb26892171 [1,0,0,1,0,0|2,0,0]=4 2500 B10R1.19 CO[C@@H]1CCCCC[C@H]1N Amb33338821 [1,0,0,1,0,0|2,0,0]=4 2501 B10R1.19 CO[C@H]1CCCCNC1=O Amb27950636 [1,0,0,1,0,0|2,0,0]=4 2502 B10R1.19 C\C=C1\CCCCCC1=O Amb24698888 [1,0,0,1,0,0|0,0,2]=4 2503 B10R1.19 N#CC1CCCCCC1=O Amb17593482 [1,0,0,1,0,0|1,0,1]=4 2504 B10R1.19 NC1CCCCCC1CO Amb20668019 [1,0,0,1,0,0|1,0,1]=4 2505 B10R1.19 NC1CCCCCC1CO Amb2695457 [1,0,0,1,0,0|1,0,1]=4 2506 B10R1.19 NCC1CCCCCC1=O Amb27965542 [1,0,0,1,0,0|1,0,0]=3 2507 B10R1.19 NCC1CCCCCC1F Amb27958677 [1,0,0,1,0,0|2,0,0]=4 2508 B10R1.19 NCC1CCCCNC1=O Amb33097714 [1,0,0,1,0,0|2,0,0]=4 2509 B10R1.19 NCC1CCCCNC1=O Amb6667851 [1,0,0,1,0,0|2,0,0]=4 2510 B10R1.19 NC[C@@H]1CCCCC[C@@H]1O Amb6336648 [1,0,0,1,0,0|1,0,1]=4 2511 B10R1.19 NC[C@@H]1CCCCC[C@H]1O Amb27788301 [1,0,0,1,0,0|1,0,1]=4 2512 B10R1.19 N[C@@H]1CCCCC[C@@H]1CO Amb32944721 [1,0,0,1,0,0|1,0,1]=4 2513 B10R1.19 N[C@@H]1CCCCC[C@H]1CO Amb27851992 [1,0,0,1,0,0|1,0,1]=4 2514 B10R1.19 N[C@H]1CCCCC[C@H]1CBr Amb27782729 [1,0,0,1,0,0|2,0,0]=4 2515 B10R1.19 N[C@H]1CCCCC[C@H]1CO Amb27467767 [1,0,0,1,0,0|1,0,1]=4 2516 B10R1.19 O=C1CCCCCC1CO Amb27944951 [1,0,0,1,0,0|1,0,0]=3 2517 B10R1.19 O=C1CCCCCN1CCl Amb17949681 [1,0,0,1,0,0|2,0,0]=4 2518 B10R1.19 O=C1CCCCCN1CO Amb1038986 [1,0,0,1,0,0|2,0,0]=4 2519 B10R1.19 O=C1NCCCCC1CBr Amb32675168 [1,0,0,1,0,0|2,0,0]=4 2520 B10R1.19 O=C1NCCCCC1CCl Amb33457891 [1,0,0,1,0,0|2,0,0]=4 2521 B10R1.19 O=C1NCCCCC1CO Amb26391477 [1,0,0,1,0,0|2,0,0]=4 2522 B10R1.19 O=CC1CCCCCC1=O Amb33539530 [1,0,0,1,0,0|1,0,1]=4 2523 B10R1.20 C#C[C@@H]1CCCC[C@H]1C=O Amb27854749 [1,0,0,1,0,0|0,0,2]=4 2524 B10R1.20 C=CC1CCCCC1C=O Amb18643332 [1,0,0,1,0,0|0,0,2]=4 2525 B10R1.20 C=CC1CCCCC1CBr Amb27403504 [1,0,0,1,0,0|1,0,1]=4 2526 B10R1.20 C=CC1CCCCC1CC Amb27662673 [1,0,0,1,0,0|0,0,1]=3 2527 B10R1.20 C=CC1CCCCC1CO Amb27486485 [1,0,0,1,0,0|1,0,1]=4 2528 B10R1.20 C=CC1CCCCC1NC Amb28070721 [1,0,0,1,0,0|1,0,1]=4 2529 B10R1.20 C=CC1NCCCC1CC Amb27838057 [1,0,0,1,0,0|1,0,1]=4 2530 B10R1.20 C=C[C@@H]1CCCC[C@H]1CO Amb28285536 [1,0,0,1,0,0|1,0,1]=4 2531 B10R1.20 C=C[C@@H]1NCCC[C@H]1CC Amb27252158 [1,0,0,1,0,0|1,0,1]=4 2532 B10R1.20 C=N[C@@H]1CCCC[C@@H]1CO Amb27456702 [1,0,0,1,0,0|2,0,0]=4 2533 B10R1.20 CCC1=C(C=O)CCCC1 Amb28050009 [1,0,0,1,0,0|0,0,2]=4 2534 B10R1.20 CCC1CCCCC1C#N Amb25848765 [1,0,0,1,0,0|1,0,1]=4 2535 B10R1.20 CCC1CCCCC1C=O Amb28069911 [1,0,0,1,0,0|0,0,0]=2 2536 B10R1.20 CCC1CCCCC1CCl Amb28315710 [1,0,0,1,0,0|1,0,0]=3 2537 B10R1.20 CCC1CCCCC1CN Amb25805484 [1,0,0,1,0,0|1,0,0]=3 2538 B10R1.20 CCC1CCCCC1CN Amb28555482 [1,0,0,1,0,0|1,0,0]=3 2539 B10R1.20 CCC1CCCCC1CO Amb28185435 [1,0,0,1,0,0|0,0,1]=3 2540 B10R1.20 CCC1CCCCC1CS Amb25972128 [1,0,0,1,0,0|0,1,0]=3 2541 B10R1.20 CCC1CCCCC1NC Amb18958571 [1,0,0,1,0,0|1,0,1]=4 2542 B10R1.20 CCC1CCCCC1NN Amb27632539 [1,0,0,1,0,0|2,0,0]=4 2543 B10R1.20 CCC1CCCCN1N=O Amb27855215 [1,0,0,1,0,0|2,0,0]=4 2544 B10R1.20 CCC1CCCNC1CC Amb27252033 [1,0,0,1,0,0|1,0,1]=4 2545 B10R1.20 CCC1CCCNC1CN Amb28201465 [1,0,0,1,0,0|2,0,0]=4 2546 B10R1.20 CCC1CCCNC1CO Amb28313797 [1,0,0,1,0,0|1,0,1]=4 2547 B10R1.20 CCC1CCSCC1CN Amb27440939 [1,0,0,1,0,0|2,0,0]=4 2548 B10R1.20 CCC1CSCCC1CN Amb28455744 [1,0,0,1,0,0|2,0,0]=4 2549 B10R1.20 CCC1CSCCN1C=O Amb25374033 [1,0,0,1,0,0|2,0,0]=4 2550 B10R1.20 CCC1NCCCC1CN Amb24477204 [1,0,0,1,0,0|2,0,0]=4 2551 B10R1.20 CCC1NCCCC1CO Amb27495614 [1,0,0,1,0,0|1,0,1]=4 2552 B10R1.20 CCC1OCCCC1CN Amb27219903 [1,0,0,1,0,0|2,0,0]=4 2553 B10R1.20 CCN1CCCCC1C=O Amb23586129 [1,0,0,1,0,0|1,0,0]=3 2554 B10R1.20 CCN1CCCCC1CN Amb9731140 [1,0,0,1,0,0|2,0,0]=4 2555 B10R1.20 CCN1CCCCC1CO Amb15701255 [1,0,0,1,0,0|1,0,1]=4 2556 B10R1.20 CCN1CCCC[C@@H]1CN Amb33218350 [1,0,0,1,0,0|2,0,0]=4 2557 B10R1.20 CCN1CCCC[C@H]1CN Amb33218402 [1,0,0,1,0,0|2,0,0]=4 2558 B10R1.20 CC[C@@H]1CNCC[C@H]1CC Amb27473416 [1,0,0,1,0,0|1,0,1]=4 2559 B10R1.20 CC[C@@H]1NCCC[C@H]1CN Amb18202517 [1,0,0,1,0,0|2,0,0]=4 2560 B10R1.20 CC[C@H]1CCCN[C@@H]1CO Amb27258939 [1,0,0,1,0,0|1,0,1]=4 2561 B10R1.20 CC[C@H]1NCCC[C@@H]1CO Amb27787453 [1,0,0,1,0,0|1,0,1]=4 2562 B10R1.20 CNC1CCCCC1CN Amb26405720 [1,0,0,1,0,0|2,0,0]=4 2563 B10R1.20 CN[C@@H]1CCCC[C@@H]1CN Amb27877870 [1,0,0,1,0,0|2,0,0]=4 2564 B10R1.20 CN[C@@H]1CCCC[C@@H]1CO Amb27857106 [1,0,0,1,0,0|1,0,1]=4 2565 B10R1.20 CN[C@@H]1CCCC[C@H]1CN Amb27234607 [1,0,0,1,0,0|2,0,0]=4 2566 B10R1.20 CN[C@H]1CCCC[C@@H]1CN Amb28423333 [1,0,0,1,0,0|2,0,0]=4 2567 B10R1.20 COC1CCCCC1C=O Amb24647644 [1,0,0,1,0,0|1,0,0]=3 2568 B10R1.20 COC1CCCCC1CN Amb9286527 [1,0,0,1,0,0|2,0,0]=4 2569 B10R1.20 COC1CCCCC1CO Amb26560099 [1,0,0,1,0,0|1,0,1]=4 2570 B10R1.20 COC1CCCCN1C=O Amb22228863 [1,0,0,1,0,0|2,0,0]=4 2571 B10R1.20 COC1COCCC1C=O Amb26475803 [1,0,0,1,0,0|2,0,0]=4 2572 B10R1.20 CO[C@@H]1CCCC[C@@H]1CN Amb32664727 [1,0,0,1,0,0|2,0,0]=4 2573 B10R1.20 CO[C@H]1CCCC[C@H]1CN Amb28142030 [1,0,0,1,0,0|2,0,0]=4 2574 B10R1.20 CSC1CCCCC1C=O Amb27973686 [1,0,0,1,0,0|1,0,0]=3 2575 B10R1.20 CSC1CCCCC1CN Amb18281652 [1,0,0,1,0,0|2,0,0]=4 2576 B10R1.20 CS[C@@H]1CCCC[C@@H]1C=O Amb27855012 [1,0,0,1,0,0|1,0,0]=3 2577 B10R1.20 NCC1CCCCC1CBr Amb28344684 [1,0,0,1,0,0|2,0,0]=4 2578 B10R1.20 NCC1CCCCC1CF Amb20668106 [1,0,0,1,0,0|2,0,0]=4 2579 B10R1.20 NCC1CCCCC1CN Amb27166717 [1,0,0,1,0,0|2,0,0]=4 2580 B10R1.20 NCC1CCCC[C@@H]1CN Amb32988623 [1,0,0,1,0,0|2,0,0]=4 2581 B10R1.20 NC[C@@H]1CCCC[C@@H]1CO Amb24724999 [1,0,0,1,0,0|1,0,1]=4 2582 B10R1.20 NC[C@@H]1CCCC[C@H]1CN Amb24567677 [1,0,0,1,0,0|2,0,0]=4 2583 B10R1.20 NC[C@H]1CCCC[C@H]1CN Amb16233760 [1,0,0,1,0,0|2,0,0]=4 2584 B10R1.20 O=CC1CCCCC1CO Amb18643890 [1,0,0,1,0,0|1,0,0]=3 2585 B10R1.20 O=C[C@H]1CCCC[C@H]1C=O Amb28122054 [1,0,0,1,0,0|1,0,1]=4 2586 B10R1.20 OCC1CCCCC1CBr Amb28140801 [1,0,0,1,0,0|1,0,1]=4 2587 B10R1.20 OCC1CCCCC1CO Amb17593632 [1,0,0,1,0,0|1,0,1]=4 2588 B10R1.20 OCC1CCCCC1CS Amb27651651 [1,0,0,1,0,0|1,0,1]=4 2589 B10R1.20 OC[C@@H]1CCCC[C@H]1CO Amb22224834 [1,0,0,1,0,0|1,0,1]=4 2590 B10R1.20 OC[C@H]1CCCC[C@H]1CO Amb10070740 [1,0,0,1,0,0|1,0,1]=4 2591 B10R1.21 BrCCCCC1CCCC1 Amb25317874 [1,0,0,1,0,0|1,0,0]=3 2592 B10R1.21 BrCCCCC1CCCO1 Amb25839950 [1,0,0,1,0,0|1,0,1]=4 2593 B10R1.21 BrCCCCC1CCOC1 Amb28074179 [1,0,0,1,0,0|2,0,0]=4 2594 B10R1.21 BrCCCCN1CCCC1 Amb20668948 [1,0,0,1,0,0|2,0,0]=4 2595 B10R1.21 BrCCCCN1CCCC1 Amb22058911 [1,0,0,1,0,0|2,0,0]=4 2596 B10R1.21 BrCCCNC1CCCC1 Amb27247203 [1,0,0,1,0,0|2,0,0]=4 2597 B10R1.21 BrCCCOC1CCCC1 Amb8828203 [1,0,0,1,0,0|2,0,0]=4 2598 B10R1.21 BrCCOCC1CCCC1 Amb27593775 [1,0,0,1,0,0|2,0,0]=4 2599 B10R1.21 BrCCSCC1CCCC1 Amb27603105 [1,0,0,1,0,0|2,0,0]=4 2600 B10R1.21 C#CCCCC1CCCC1 Amb33378004 [1,0,0,1,0,0|0,0,2]=4 2601 B10R1.21 C=CCCCC1CCCC1 Amb27390216 [1,0,0,1,0,0|0,0,1]=3 2602 B10R1.21 C=CCCCC1CCCN1 Amb27839002 [1,0,0,1,0,0|1,0,1]=4 2603 B10R1.21 C=CCCCC1CCSC1 Amb28344683 [1,0,0,1,0,0|1,0,1]=4 2604 B10R1.21 C=CCCCN1CCCC1 Amb27192320 [1,0,0,1,0,0|1,0,1]=4 2605 B10R1.21 C=CCNCC1CCCC1 Amb17231913 [1,0,0,1,0,0|1,0,1]=4 2606 B10R1.21 CCCCCC1=CCCC1 Amb27248740 [1,0,0,1,0,0|0,0,1]=3 2607 B10R1.21 CCCCCC1CCCC1 Amb22731546 [1,0,0,1,0,0|0,0,1]=3 2608 B10R1.21 CCCCCC1CCCN1 Amb20669608 [1,0,0,1,0,0|1,0,0]=3 2609 B10R1.21 CCCCCC1CCCN1 Amb3788114 [1,0,0,1,0,0|1,0,0]=3 2610 B10R1.21 CCCCCC1CCNC1 Amb25726522 [1,0,0,1,0,0|1,0,1]=4 2611 B10R1.21 CCCCCN1CCCN1 Amb27874449 [1,0,0,1,0,0|2,0,0]=4 2612 B10R1.21 CCCCCN1CCCO1 Amb28139187 [1,0,0,1,0,0|1,0,1]=4 2613 B10R1.21 CCCCC[C@@H]1CCNC1 Amb27950140 [1,0,0,1,0,0|1,0,1]=4 2614 B10R1.21 CCCCC[C@H]1CCCN1 Amb28050068 [1,0,0,1,0,0|1,0,0]=3 2615 B10R1.21 CCCCC[C@H]1CCNC1 Amb28041520 [1,0,0,1,0,0|1,0,1]=4 2616 B10R1.21 CCCCNC1C=CCC1 Amb27252122 [1,0,0,1,0,0|1,0,1]=4 2617 B10R1.21 CCCCNC1CCCC1 Amb2111931 [1,0,0,1,0,0|1,0,1]=4 2618 B10R1.21 CCCCNC1CCCC1 Amb6690971 [1,0,0,1,0,0|1,0,1]=4 2619 B10R1.21 CCCCSC1CCCC1 Amb28345161 [1,0,0,1,0,0|1,0,1]=4 2620 B10R1.21 CCCNCC1CCCC1 Amb9214739 [1,0,0,1,0,0|1,0,1]=4 2621 B10R1.21 CCCNCC1CCCN1 Amb17231950 [1,0,0,1,0,0|2,0,0]=4 2622 B10R1.21 CCCNCC1CCCO1 Amb9751758 [1,0,0,1,0,0|1,0,1]=4 2623 B10R1.21 CCCNC[C@@H]1CCCN1 Amb27404235 [1,0,0,1,0,0|2,0,0]=4 2624 B10R1.21 CCCNC[C@@H]1CCCO1 Amb27605440 [1,0,0,1,0,0|1,0,1]=4 2625 B10R1.21 CCCNC[C@H]1CCCN1 Amb27606064 [1,0,0,1,0,0|2,0,0]=4 2626 B10R1.21 CCCNC[C@H]1CCCO1 Amb27466411 [1,0,0,1,0,0|1,0,1]=4 2627 B10R1.21 CCCOCC1CCCN1 Amb27816067 [1,0,0,1,0,0|2,0,0]=4 2628 B10R1.21 CCCOC[C@@H]1CCCN1 Amb17083725 [1,0,0,1,0,0|2,0,0]=4 2629 B10R1.21 CCCSCC1CCCC1 Amb27775688 [1,0,0,1,0,0|1,0,1]=4 2630 B10R1.21 CCCSC[C@@H]1CCCN1 Amb27222876 [1,0,0,1,0,0|2,0,0]=4 2631 B10R1.21 CCCSC[C@H]1CCCN1 Amb28142509 [1,0,0,1,0,0|2,0,0]=4 2632 B10R1.21 CCOCCC1CCCN1 Amb4134991 [1,0,0,1,0,0|2,0,0]=4 2633 B10R1.21 CCSCCC1CCCN1 Amb25261952 [1,0,0,1,0,0|2,0,0]=4 2634 B10R1.21 CNCCCC1=CCCC1 Amb28135278 [1,0,0,1,0,0|1,0,1]=4 2635 B10R1.21 CNCCCC1CCCC1 Amb22586912 [1,0,0,1,0,0|1,0,1]=4 2636 B10R1.21 CNCCCC1CCCC1 Amb8853673 [1,0,0,1,0,0|1,0,1]=4 2637 B10R1.21 CNCCCC1CCCO1 Amb10607820 [1,0,0,1,0,0|1,0,1]=4 2638 B10R1.21 CNCCCC1CCCS1 Amb27482007 [1,0,0,1,0,0|1,1,0]=4 2639 B10R1.21 COCCCC1CCCN1 Amb19023186 [1,0,0,1,0,0|2,0,0]=4 2640 B10R1.21 CSCCCC1CCCN1 Amb18311378 [1,0,0,1,0,0|2,0,0]=4 2641 B10R1.21 ClCCCCC1CCCC1 Amb24480526 [1,0,0,1,0,0|1,0,0]=3 2642 B10R1.21 ClCCCCC1CCCO1 Amb25318134 [1,0,0,1,0,0|1,0,1]=4 2643 B10R1.21 ClCCCCC1CCOC1 Amb25196200 [1,0,0,1,0,0|2,0,0]=4 2644 B10R1.21 ClCCCCN1CCCC1 Amb17334548 [1,0,0,1,0,0|2,0,0]=4 2645 B10R1.21 ClCCCNC1CCCC1 Amb28068281 [1,0,0,1,0,0|2,0,0]=4 2646 B10R1.21 ClCCCOC1CCCC1 Amb6255538 [1,0,0,1,0,0|2,0,0]=4 2647 B10R1.21 ClCCOCC1CCCC1 Amb28126759 [1,0,0,1,0,0|2,0,0]=4 2648 B10R1.21 FCCCSC1CCCC1 Amb27883644 [1,0,0,1,0,0|2,0,0]=4 2649 B10R1.21 FCCNCC1CCCC1 Amb28186719 [1,0,0,1,0,0|2,0,0]=4 2650 B10R1.21 ICCCNC1CCCC1 Amb27761161 [1,0,0,1,0,0|2,0,0]=4 2651 B10R1.21 N#CCCCC1CCCC1 Amb24700210 [1,0,0,1,0,0|1,0,1]=4 2652 B10R1.21 NCCCCC1CCCC1 Amb17569962 [1,0,0,1,0,0|1,0,0]=3 2653 B10R1.21 NCCCCC1CCCO1 Amb10607819 [1,0,0,1,0,0|1,0,1]=4 2654 B10R1.21 NCCCCC1CCCO1 Amb22587022 [1,0,0,1,0,0|1,0,1]=4 2655 B10R1.21 NCCCCC1CCCS1 Amb33416799 [1,0,0,1,0,0|1,1,0]=4 2656 B10R1.21 NCCCCC1CCNC1 Amb27874093 [1,0,0,1,0,0|2,0,0]=4 2657 B10R1.21 NCCCCC1CCOC1 Amb26867511 [1,0,0,1,0,0|2,0,0]=4 2658 B10R1.21 NCCCCC1CCSC1 Amb18199618 [1,0,0,1,0,0|2,0,0]=4 2659 B10R1.21 NCCCCN1CCCC1 Amb2721816 [1,0,0,1,0,0|2,0,0]=4 2660 B10R1.21 NCCCNC1CCCC1 Amb17315275 [1,0,0,1,0,0|2,0,0]=4 2661 B10R1.21 NCCCOC1CCCC1 Amb1137564 [1,0,0,1,0,0|2,0,0]=4 2662 B10R1.21 NCCCSC1CCCC1 Amb27768846 [1,0,0,1,0,0|2,0,0]=4 2663 B10R1.21 NCCOCC1CCCC1 Amb33530050 [1,0,0,1,0,0|2,0,0]=4 2664 B10R1.21 NNCCCC1CCCC1 Amb6249524 [1,0,0,1,0,0|2,0,0]=4 2665 B10R1.21 NOCCCC1CCCC1 Amb33378621 [1,0,0,1,0,0|2,0,0]=4 2666 B10R1.21 O=C=NCCC1CCCC1 Amb6267222 [1,0,0,1,0,0|1,0,1]=4 2667 B10R1.21 O=CC#CCC1CCCC1 Amb28186614 [1,0,0,1,0,0|0,0,2]=4 2668 B10R1.21 O=CCCCC1C=CCC1 Amb18643323 [1,0,0,1,0,0|0,0,2]=4 2669 B10R1.21 O=CCCCC1CCCC1 Amb25838994 [1,0,0,1,0,0|0,0,0]=2 2670 B10R1.21 O=CCCCC1CCCO1 Amb25714393 [1,0,0,1,0,0|1,0,0]=3 2671 B10R1.21 O=CCCCC1CCCS1 Amb33415400 [1,0,0,1,0,0|1,0,0]=3 2672 B10R1.21 O=CCCCC1CCOC1 Amb26996770 [1,0,0,1,0,0|1,0,0]=3 2673 B10R1.21 O=CCCCC1CCSC1 Amb33225844 [1,0,0,1,0,0|1,0,0]=3 2674 B10R1.21 O=CCCCC1OCCO1 Amb6752057 [1,0,0,1,0,0|2,0,0]=4 2675 B10R1.21 O=CCCCN1CCCC1 Amb33445897 [1,0,0,1,0,0|1,0,0]=3 2676 B10R1.21 O=CCCOC1CCCC1 Amb33540933 [1,0,0,1,0,0|1,0,0]=3 2677 B10R1.21 O=CCCOC1CCCO1 Amb28049924 [1,0,0,1,0,0|2,0,0]=4 2678 B10R1.21 O=CCCOC1CCOC1 Amb27835293 [1,0,0,1,0,0|2,0,0]=4 2679 B10R1.21 O=CCOCC1CCCO1 Amb28064332 [1,0,0,1,0,0|2,0,0]=4 2680 B10R1.21 O=CCSCC1CCCC1 Amb28197773 [1,0,0,1,0,0|1,0,0]=3 2681 B10R1.21 O=CCSCC1CCCO1 Amb27839516 [1,0,0,1,0,0|2,0,0]=4 2682 B10R1.21 O=C\C=C\CC1CCCC1 Amb33358587 [1,0,0,1,0,0|0,0,2]=4 2683 B10R1.21 OCCCCC1=CCCC1 Amb28077745 [1,0,0,1,0,0|1,0,1]=4 2684 B10R1.21 OCCCCC1C=CCC1 Amb28139719 [1,0,0,1,0,0|1,0,1]=4 2685 B10R1.21 OCCCCC1CCCC1 Amb25228243 [1,0,0,1,0,0|0,0,1]=3 2686 B10R1.21 OCCCCC1CCCO1 Amb25321554 [1,0,0,1,0,0|1,0,1]=4 2687 B10R1.21 OCCCCC1CCCS1 Amb27766950 [1,0,0,1,0,0|1,0,1]=4 2688 B10R1.21 OCCCCC1CCNC1 Amb27637887 [1,0,0,1,0,0|1,0,1]=4 2689 B10R1.21 OCCCCN1CCCC1 Amb3204767 [1,0,0,1,0,0|1,0,1]=4 2690 B10R1.21 OCCCNC1CCCC1 Amb6733581 [1,0,0,1,0,0|1,0,1]=4 2691 B10R1.21 OCCCOC1CCCC1 Amb6893050 [1,0,0,1,0,0|1,0,1]=4 2692 B10R1.21 OCCOCC1CCCC1 Amb21957925 [1,0,0,1,0,0|1,0,1]=4 2693 B10R1.21 ONCCCC1CCCC1 Amb33481443 [1,0,0,1,0,0|1,0,1]=4 2694 B10R1.21 SCCCCC1CCCC1 Amb33377954 [1,0,0,1,0,0|0,1,0]=3 2695 B10R1.21 SCCCCN1CCCC1 Amb25768806 [1,0,0,1,0,0|1,1,0]=4 2696 B10R1.21 SCCCSC1CCCC1 Amb27662535 [1,0,0,1,0,0|1,1,0]=4 2697 B10R1.21 [C-]#[N+]CCCC1CCCC1 Amb24708173 [1,0,0,1,0,0|1,0,1]=4 2698 B10R1.29 C=CCCC1CCCC1=O Amb26474240 [1,0,0,1,0,0|0,0,2]=4 2699 B10R1.29 C=CCCC1CCCC1Br Amb27838998 [1,0,0,1,0,0|1,0,1]=4 2700 B10R1.29 C=CCCC1CCCC1O Amb24615229 [1,0,0,1,0,0|1,0,1]=4 2701 B10R1.29 C=CCCN1CCCC1C Amb28289636 [1,0,0,1,0,0|1,0,1]=4 2702 B10R1.29 C=CCC[C@@H]1CCC[C@H]1O Amb26913579 [1,0,0,1,0,0|1,0,1]=4 2703 B10R1.29 C=CCNC1CCCC1C Amb27883396 [1,0,0,1,0,0|1,0,1]=4 2704 B10R1.29 CC#CCC1CCCC1=O Amb28388198 [1,0,0,1,0,0|0,0,2]=4 2705 B10R1.29 CC1CCCC1CCCN Amb28455816 [1,0,0,1,0,0|1,0,0]=3 2706 B10R1.29 CC1CCCC1NCCF Amb27219301 [1,0,0,1,0,0|2,0,0]=4 2707 B10R1.29 CC1CCCC1NCCN Amb27431524 [1,0,0,1,0,0|2,0,0]=4 2708 B10R1.29 CC1CCCC1NCCO Amb24271129 [1,0,0,1,0,0|1,0,1]=4 2709 B10R1.29 CC1CCCC1OCCS Amb26335321 [1,0,0,1,0,0|1,1,0]=4 2710 B10R1.29 CC1CCCN1CCCBr Amb28398656 [1,0,0,1,0,0|2,0,0]=4 2711 B10R1.29 CC1CCCN1CCCCl Amb18177763 [1,0,0,1,0,0|2,0,0]=4 2712 B10R1.29 CC1CCCN1CCCF Amb28138240 [1,0,0,1,0,0|2,0,0]=4 2713 B10R1.29 CC1CCCN1CCCN Amb18993936 [1,0,0,1,0,0|2,0,0]=4 2714 B10R1.29 CC1OCCC1CCC=O Amb33426817 [1,0,0,1,0,0|1,0,0]=3 2715 B10R1.29 CC1OCCC1CCCBr Amb33334061 [1,0,0,1,0,0|2,0,0]=4 2716 B10R1.29 CC1OCCC1CCCN Amb33427697 [1,0,0,1,0,0|2,0,0]=4 2717 B10R1.29 CC1OCCC1CCCO Amb33426819 [1,0,0,1,0,0|1,0,1]=4 2718 B10R1.29 CC1OCCC1CCCS Amb33426769 [1,0,0,1,0,0|1,1,0]=4 2719 B10R1.29 CCCCC1CCCC1=O Amb19301037 [1,0,0,1,0,0|0,0,0]=2 2720 B10R1.29 CCCCC1CCCC1N Amb18977599 [1,0,0,1,0,0|1,0,0]=3 2721 B10R1.29 CCCCC1CCCC1O Amb27188610 [1,0,0,1,0,0|0,0,1]=3 2722 B10R1.29 CCCCC1CCNC1C Amb27772735 [1,0,0,1,0,0|1,0,1]=4 2723 B10R1.29 CCCCC1CNCC1O Amb28077183 [1,0,0,1,0,0|1,0,1]=4 2724 B10R1.29 CCCCC1COCC1=O Amb29885828 [1,0,0,1,0,0|1,0,0]=3 2725 B10R1.29 CCCCC1COCC1Br Amb29866241 [1,0,0,1,0,0|2,0,0]=4 2726 B10R1.29 CCCCC1COCC1N Amb30025739 [1,0,0,1,0,0|2,0,0]=4 2727 B10R1.29 CCCCC1COCC1O Amb27981737 [1,0,0,1,0,0|1,0,1]=4 2728 B10R1.29 CCCCC1CSCC1Br Amb27753176 [1,0,0,1,0,0|2,0,0]=4 2729 B10R1.29 CCCCC1CSCC1N Amb27594264 [1,0,0,1,0,0|2,0,0]=4 2730 B10R1.29 CCCCC1OCCC1Br Amb27754539 [1,0,0,1,0,0|2,0,0]=4 2731 B10R1.29 CCCCC1OCCC1N Amb27770405 [1,0,0,1,0,0|2,0,0]=4 2732 B10R1.29 CCCCC1SCCC1O Amb28398994 [1,0,0,1,0,0|1,0,1]=4 2733 B10R1.29 CCCCN1CCCC1=N Amb7777898 [1,0,0,1,0,0|2,0,0]=4 2734 B10R1.29 CCCCN1CCCC1=O Amb4605894 [1,0,0,1,0,0|1,0,0]=3 2735 B10R1.29 CCCCN1CCCC1=S Amb26564122 [1,0,0,1,0,0|1,1,0]=4 2736 B10R1.29 CCCCN1CCCC1C Amb28078289 [1,0,0,1,0,0|1,0,1]=4 2737 B10R1.29 CCCCN1CNCC1=O Amb28139296 [1,0,0,1,0,0|2,0,0]=4 2738 B10R1.29 CCCC[C@@H]1CCC[C@H]1O Amb26393355 [1,0,0,1,0,0|0,0,1]=3 2739 B10R1.29 CCCC[C@@H]1CCN[C@H]1C Amb27422037 [1,0,0,1,0,0|1,0,1]=4 2740 B10R1.29 CCCC[C@@H]1CNC[C@@H]1N Amb32709346 [1,0,0,1,0,0|2,0,0]=4 2741 B10R1.29 CCCC[C@@H]1CNC[C@H]1O Amb28203928 [1,0,0,1,0,0|1,0,1]=4 2742 B10R1.29 CCCC[C@@H]1COC[C@H]1O Amb32944880 [1,0,0,1,0,0|1,0,1]=4 2743 B10R1.29 CCCC[C@@H]1OCC[C@H]1O Amb27431543 [1,0,0,1,0,0|1,0,1]=4 2744 B10R1.29 CCCC[C@H]1CNC[C@@H]1O Amb28283631 [1,0,0,1,0,0|1,0,1]=4 2745 B10R1.29 CCCNC1CCCC1C Amb18977607 [1,0,0,1,0,0|1,0,1]=4 2746 B10R1.29 CCCNC1CCCC1N Amb23559233 [1,0,0,1,0,0|2,0,0]=4 2747 B10R1.29 CCCNC1CCCC1O Amb18969168 [1,0,0,1,0,0|1,0,1]=4 2748 B10R1.29 CCCOC1CCCC1Br Amb24478020 [1,0,0,1,0,0|2,0,0]=4 2749 B10R1.29 CCCOC1CCCC1I Amb28050457 [1,0,0,1,0,0|2,0,0]=4 2750 B10R1.29 CCCO[C@@H]1CCC[C@H]1O Amb27420309 [1,0,0,1,0,0|1,0,1]=4 2751 B10R1.29 CCCS[C@H]1CCC[C@@H]1O Amb27822819 [1,0,0,1,0,0|1,0,1]=4 2752 B10R1.29 CCC\C=C1/CCCC1=O Amb25936513 [1,0,0,1,0,0|0,0,2]=4 2753 B10R1.29 CCC\C=C1\CCCC1=O Amb27432602 [1,0,0,1,0,0|0,0,2]=4 2754 B10R1.29 CCNCC1CCCC1O Amb18644022 [1,0,0,1,0,0|1,0,1]=4 2755 B10R1.29 CCNC[C@@H]1CCC[C@@H]1N Amb35663445 [1,0,0,1,0,0|2,0,0]=4 2756 B10R1.29 CCOCC1CCCC1=O Amb24431926 [1,0,0,1,0,0|1,0,0]=3 2757 B10R1.29 CCOCC1CCCC1O Amb27810580 [1,0,0,1,0,0|1,0,1]=4 2758 B10R1.29 CCOCC1COCC1=O Amb35639027 [1,0,0,1,0,0|2,0,0]=4 2759 B10R1.29 CCOC[C@@H]1CCC[C@H]1O Amb33213074 [1,0,0,1,0,0|1,0,1]=4 2760 B10R1.29 CN1CCCC1CCC=O Amb25305618 [1,0,0,1,0,0|1,0,0]=3 2761 B10R1.29 CN1CCCC1CCCBr Amb24475416 [1,0,0,1,0,0|2,0,0]=4 2762 B10R1.29 CN1CCCC1CCCCl Amb28207734 [1,0,0,1,0,0|2,0,0]=4 2763 B10R1.29 CN1CCCC1CCCN Amb18251255 [1,0,0,1,0,0|2,0,0]=4 2764 B10R1.29 CN1CCCC1CCCO Amb23541272 [1,0,0,1,0,0|1,0,1]=4 2765 B10R1.29 CN1CCCC1CCCS Amb33325946 [1,0,0,1,0,0|1,1,0]=4 2766 B10R1.29 CNCCC1CCCC1C Amb27427395 [1,0,0,1,0,0|1,0,1]=4 2767 B10R1.29 CNCCC1CCCC1F Amb27193255 [1,0,0,1,0,0|2,0,0]=4 2768 B10R1.29 CNCCC1CCCC1N Amb29867784 [1,0,0,1,0,0|2,0,0]=4 2769 B10R1.29 CNCCN1CCCC1=O Amb18292044 [1,0,0,1,0,0|2,0,0]=4 2770 B10R1.29 CNCCN1CCCC1=O Amb19515123 [1,0,0,1,0,0|2,0,0]=4 2771 B10R1.29 CNCC[C@@H]1CCC[C@H]1N Amb29867666 [1,0,0,1,0,0|2,0,0]=4 2772 B10R1.29 COCCC1CCCC1=O Amb27665846 [1,0,0,1,0,0|1,0,0]=3 2773 B10R1.29 COCCC1CCNC1=O Amb25824666 [1,0,0,1,0,0|2,0,0]=4 2774 B10R1.29 COCCN1CCCC1=O Amb20621492 [1,0,0,1,0,0|2,0,0]=4 2775 B10R1.29 COCOC1CCCC1=O Amb25319346 [1,0,0,1,0,0|2,0,0]=4 2776 B10R1.29 CSCCC1CCCC1=O Amb27794162 [1,0,0,1,0,0|1,0,0]=3 2777 B10R1.29 CSCCC1CCCC1O Amb27857239 [1,0,0,1,0,0|1,0,1]=4 2778 B10R1.29 CSCCC1CCOC1=O Amb27467850 [1,0,0,1,0,0|2,0,0]=4 2779 B10R1.29 CSCCC1CSCC1=O Amb27166207 [1,0,0,1,0,0|2,0,0]=4 2780 B10R1.29 CSCCC1NCCC1=O Amb27192382 [1,0,0,1,0,0|2,0,0]=4 2781 B10R1.29 CSCC[C@@H]1NCCC1=O Amb18830317 [1,0,0,1,0,0|2,0,0]=4 2782 B10R1.29 CSCOC1CCCC1=O Amb25236984 [1,0,0,1,0,0|2,0,0]=4 2783 B10R1.29 C[C@@H]1CCCN1CCCN Amb26569273 [1,0,0,1,0,0|2,0,0]=4 2784 B10R1.29 C[C@@H]1CCC[C@H]1CCCBr Amb27488920 [1,0,0,1,0,0|1,0,0]=3 2785 B10R1.29 C[C@@H]1CCC[C@H]1OCCS Amb24626124 [1,0,0,1,0,0|1,1,0]=4 2786 B10R1.29 C[C@H]1CCCN1CCCN Amb33483730 [1,0,0,1,0,0|2,0,0]=4 2787 B10R1.29 N#CCCC1CCCC1=O Amb4477198 [1,0,0,1,0,0|1,0,1]=4 2788 B10R1.29 NC1CCCC1CCCO Amb9783186 [1,0,0,1,0,0|1,0,1]=4 2789 B10R1.29 NCCCC1CCCC1O Amb9783183 [1,0,0,1,0,0|1,0,1]=4 2790 B10R1.29 NCCCC1CCNC1=O Amb27860538 [1,0,0,1,0,0|2,0,0]=4 2791 B10R1.29 NCCCC1CCOC1=O Amb32668910 [1,0,0,1,0,0|2,0,0]=4 2792 B10R1.29 NCCCC1CCOC1=O Amb32674869 [1,0,0,1,0,0|2,0,0]=4 2793 B10R1.29 NCCCN1CCCC1=O Amb534575 [1,0,0,1,0,0|2,0,0]=4 2794 B10R1.29 O=C1CCCC1CCCF Amb26876720 [1,0,0,1,0,0|1,0,0]=3 2795 B10R1.29 O=C1CCCN1CCCCl Amb1141152 [1,0,0,1,0,0|2,0,0]=4 2796 B10R1.29 O=C1CCCN1CCCO Amb3939639 [1,0,0,1,0,0|2,0,0]=4 2797 B10R1.29 O=C1CCCN1CCCS Amb27837899 [1,0,0,1,0,0|2,0,0]=4 2798 B10R1.29 O=C1CCC[C@@H]1CCCBr Amb27233151 [1,0,0,1,0,0|1,0,0]=3 2799 B10R1.29 O=C1CSCC1CCCF Amb27487070 [1,0,0,1,0,0|2,0,0]=4 2800 B10R1.29 O=C1CSCC1CCCO Amb27218665 [1,0,0,1,0,0|2,0,0]=4 2801 B10R1.29 O=C1NCCC1CCCO Amb27460992 [1,0,0,1,0,0|2,0,0]=4 2802 B10R1.29 O=C1NCCC1CCCO Amb32667562 [1,0,0,1,0,0|2,0,0]=4 2803 B10R1.29 O=C1OCCC1CCCO Amb27977861 [1,0,0,1,0,0|2,0,0]=4 2804 B10R1.29 O=C1OCC[C@H]1CCCF Amb27949209 [1,0,0,1,0,0|2,0,0]=4 2805 B10R1.29 O=CCCC1CCCC1O Amb27636929 [1,0,0,1,0,0|1,0,0]=3 2806 B10R1.29 OC1CCCC1CCCF Amb28456212 [1,0,0,1,0,0|1,0,1]=4 2807 B10R1.29 OCCC[C@@H]1CCC[C@@H]1O Amb27627473 [1,0,0,1,0,0|1,0,1]=4 2808 B10R1.29 [C-]#[N+]CCC1CCCC1C Amb28070463 [1,0,0,1,0,0|1,0,1]=4 2809 B10R1.37 C=CCCCC1CCC1O Amb33213639 [1,0,0,1,0,0|1,0,1]=4 2810 B10R1.37 CC1CCC1CNCCN Amb32419805 [1,0,0,1,0,0|2,0,0]=4 2811 B10R1.37 CC1CCC1NCCCF Amb27771857 [1,0,0,1,0,0|2,0,0]=4 2812 B10R1.37 CCCCCC1CCC1O Amb32945102 [1,0,0,1,0,0|0,0,1]=3 2813 B10R1.37 CCCOCC1CCC1O Amb32950463 [1,0,0,1,0,0|1,0,1]=4 2814 B10R1.37 CCSCCC1CCC1N Amb28205334 [1,0,0,1,0,0|2,0,0]=4 2815 B10R1.37 CNCCCN1CCC1=O Amb27619422 [1,0,0,1,0,0|2,0,0]=4 2816 B10R1.37 COCCCC1CCC1O Amb33213972 [1,0,0,1,0,0|1,0,1]=4 2817 B10R1.56 CC1CC1CNCCCO Amb27836573 [1,0,0,1,0,0|1,0,1]=4 2818 B10R1.56 CC1CC1NCCCCF Amb27793977 [1,0,0,1,0,0|2,0,0]=4 2819 B10R1.56 CC1CC1NCCCCO Amb27403384 [1,0,0,1,0,0|1,0,1]=4 2820 B10R1.56 CCCCCCC1CC1Cl Amb27634322 [1,0,0,1,0,0|1,0,0]=3 2821 B10R1.56 CCCCCCC1CC1O Amb27836897 [1,0,0,1,0,0|0,0,1]=3 2822 B10R1.56 CCCCCC[C@@H]1CC1Br Amb27647510 [1,0,0,1,0,0|1,0,0]=3 2823 B10R1.56 CCCCCC[C@@H]1C[C@@H]1Cl Amb28320529 [1,0,0,1,0,0|1,0,0]=3 2824 B10R1.56 CCCCCC[C@@H]1C[C@@H]1O Amb27220217 [1,0,0,1,0,0|0,0,1]=3 2825 B10R1.56 CCCCCC[C@@H]1C[C@H]1Br Amb28053493 [1,0,0,1,0,0|1,0,0]=3 2826 B10R1.56 CCCCCC[C@H]1C[C@@H]1Br Amb27619249 [1,0,0,1,0,0|1,0,0]=3 2827 B10R1.56 CCCCCC[C@H]1C[C@H]1Br Amb27625664 [1,0,0,1,0,0|1,0,0]=3 2828 B10R1.56 CCCCCNC1CC1C Amb27649332 [1,0,0,1,0,0|1,0,1]=4 2829 B10R1.57 BrCCCCCN1CCC1 Amb27776419 [1,0,0,1,0,0|2,0,0]=4 2830 B10R1.57 BrCCCCOC1CCC1 Amb27643205 [1,0,0,1,0,0|2,0,0]=4 2831 B10R1.57 BrCCCNCC1CCC1 Amb27770420 [1,0,0,1,0,0|2,0,0]=4 2832 B10R1.57 BrCCOCCC1CCC1 Amb28119463 [1,0,0,1,0,0|2,0,0]=4 2833 B10R1.57 C=CCCCCC1CSC1 Amb27856624 [1,0,0,1,0,0|1,0,1]=4 2834 B10R1.57 C=CCCNCC1CCC1 Amb27426711 [1,0,0,1,0,0|1,0,1]=4 2835 B10R1.57 C=CCNCCC1CCC1 Amb27450427 [1,0,0,1,0,0|1,0,1]=4 2836 B10R1.57 CCCCCCC1CCN1 Amb27617080 [1,0,0,1,0,0|1,0,0]=3 2837 B10R1.57 CCCCCCC1CNC1 Amb27589877 [1,0,0,1,0,0|1,0,1]=4 2838 B10R1.57 CCCCCCN1CCC1 Amb27809414 [1,0,0,1,0,0|1,0,1]=4 2839 B10R1.57 CCCNCCC1CCC1 Amb28322921 [1,0,0,1,0,0|1,0,1]=4 2840 B10R1.57 COCCCCC1CCN1 Amb27613113 [1,0,0,1,0,0|2,0,0]=4 2841 B10R1.57 ICCCNCC1CCC1 Amb27220391 [1,0,0,1,0,0|2,0,0]=4 2842 B10R1.57 ICCNCCC1CCC1 Amb28346016 [1,0,0,1,0,0|2,0,0]=4 2843 B10R1.57 NCCCNCC1CCC1 Amb28133297 [1,0,0,1,0,0|2,0,0]=4 2844 B10R1.57 NCCNCCC1CCC1 Amb28364543 [1,0,0,1,0,0|2,0,0]=4 2845 B10R1.57 NCCOCCC1CCC1 Amb23510296 [1,0,0,1,0,0|2,0,0]=4 2846 B10R1.57 O=C=NCCCC1CCC1 Amb27201843 [1,0,0,1,0,0|1,0,1]=4 2847 B10R1.57 O=CNCCCC1CCN1 Amb28368901 [1,0,0,1,0,0|2,0,0]=4 2848 B10R1.57 O=CNCCCC1CNC1 Amb27462115 [1,0,0,1,0,0|2,0,0]=4 2849 B10R1.57 OCCCCCC1CCC1 Amb27432269 [1,0,0,1,0,0|0,0,1]=3 2850 B10R1.57 OCCCCNC1CCC1 Amb27482224 [1,0,0,1,0,0|1,0,1]=4 2851 B10R1.57 OCCCNCC1CCC1 Amb23580075 [1,0,0,1,0,0|1,0,1]=4 2852 B10R1.57 OCCNCCC1CCC1 Amb27880136 [1,0,0,1,0,0|1,0,1]=4 2853 B10R1.57 SCCCCOC1CCC1 Amb28044747 [1,0,0,1,0,0|1,1,0]=4 2854 B10R1.57 SCCOCCC1CCC1 Amb27780066 [1,0,0,1,0,0|1,1,0]=4 2855 B10R1.60 C=CCC1CC1CCC=O Amb27823173 [1,0,0,1,0,0|0,0,2]=4 2856 B10R1.60 C=CCC1CC1CCCO Amb27651586 [1,0,0,1,0,0|1,0,1]=4 2857 B10R1.60 C=CC[C@H]1C[C@H]1CCC=O Amb27488205 [1,0,0,1,0,0|0,0,2]=4 2858 B10R1.60 CCCC1CC1NCCN Amb28185857 [1,0,0,1,0,0|2,0,0]=4 2859 B10R1.60 CCCCC1OC1CCCl Amb27841681 [1,0,0,1,0,0|2,0,0]=4 2860 B10R1.60 CCCC[C@@H]1C[C@H]1N=C=O Amb28285545 [1,0,0,1,0,0|1,0,1]=4 2861 B10R1.60 CCCC[C@@H]1O[C@@H]1CCCl Amb27623425 [1,0,0,1,0,0|2,0,0]=4 2862 B10R1.60 CCCC[C@@H]1O[C@H]1CCCl Amb27975822 [1,0,0,1,0,0|2,0,0]=4 2863 B10R1.60 CCCC[C@@H]1O[C@H]1CCO Amb27457916 [1,0,0,1,0,0|1,0,1]=4 2864 B10R1.60 CCCC[C@H]1O[C@@H]1CCCl Amb27630529 [1,0,0,1,0,0|2,0,0]=4 2865 B10R1.60 CCCC[C@H]1O[C@H]1CCO Amb27422277 [1,0,0,1,0,0|1,0,1]=4 2866 B10R1.60 CCC[C@@H]1O[C@H]1CCCO Amb27969140 [1,0,0,1,0,0|1,0,1]=4 2867 B10R1.60 CCC[C@H]1O[C@@H]1CCC=O Amb27235308 [1,0,0,1,0,0|1,0,0]=3 2868 B10R1.78 BrC1C=CCCCCCC1 Amb24638769 [1,0,0,1,0,0|1,0,1]=4 2869 B10R1.78 CC1CCCCCCCC1 Amb22356358 [1,0,0,1,0,0|0,0,1]=3 2870 B10R1.78 ClC1CCCCCCCC1 Amb28342224 [1,0,0,1,0,0|1,0,0]=3 2871 B10R1.78 NC1CCCCCCCC1 Amb27595434 [1,0,0,1,0,0|1,0,0]=3 2872 B10R1.78 O=C1C#CCCCCCC1 Amb27409529 [1,0,0,1,0,0|0,0,2]=4 2873 B10R1.78 O=C1C=CCCCCCC1 Amb22363956 [1,0,0,1,0,0|0,0,2]=4 2874 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [1,0,0,1,0,0|0,0,0]=2 2875 B10R1.78 O=C1CCCCCCCN1 Amb8513494 [1,0,0,1,0,0|1,0,0]=3 2876 B10R1.78 O=C1CCCCOCCN1 Amb27201667 [1,0,0,1,0,0|2,0,0]=4 2877 B10R1.78 O=C1CCCCSCCC1 Amb28144124 [1,0,0,1,0,0|1,0,0]=3 2878 B10R1.78 O=C1CSCCCCSC1 Amb27267071 [1,0,0,1,0,0|2,0,0]=4 2879 B10R1.78 OC1CCCCCCCC1 Amb26514614 [1,0,0,1,0,0|0,0,1]=3 2880 B10R1.78 OC1CCCCCCCO1 Amb27219804 [1,0,0,1,0,0|1,0,1]=4 2881 B10R1.78 OC1CCCCNCCC1 Amb27169610 [1,0,0,1,0,0|1,0,1]=4 2882 B10R1.85 BrCCC1CCCCCC1 Amb25286236 [1,0,0,1,0,0|1,0,0]=3 2883 B10R1.85 BrCCN1CCCCCC1 Amb24719049 [1,0,0,1,0,0|2,0,0]=4 2884 B10R1.85 BrCCN1CCCCCC1 Amb33527027 [1,0,0,1,0,0|2,0,0]=4 2885 B10R1.85 Br\C=C\C1CCCCCC1 Amb33135243 [1,0,0,1,0,0|1,0,1]=4 2886 B10R1.85 C#CCC1CCCCCC1 Amb33267281 [1,0,0,1,0,0|0,0,2]=4 2887 B10R1.85 C=CCC1CCCCNC1 Amb27167243 [1,0,0,1,0,0|1,0,1]=4 2888 B10R1.85 CCCC1=NCCCCC1 Amb27483664 [1,0,0,1,0,0|1,0,1]=4 2889 B10R1.85 CCCC1CCCCCN1 Amb2237241 [1,0,0,1,0,0|1,0,0]=3 2890 B10R1.85 CCCC1CCCNCC1 Amb9316858 [1,0,0,1,0,0|1,0,1]=4 2891 B10R1.85 CCCC1CCNCCO1 Amb32679920 [1,0,0,1,0,0|1,0,1]=4 2892 B10R1.85 CCNC1CCCCCC1 Amb6279360 [1,0,0,1,0,0|1,0,1]=4 2893 B10R1.85 CNCC1CCCCCC1 Amb18962588 [1,0,0,1,0,0|1,0,1]=4 2894 B10R1.85 CNCC1CCCCCN1 Amb27945607 [1,0,0,1,0,0|2,0,0]=4 2895 B10R1.85 COCC1CCCCCN1 Amb28423663 [1,0,0,1,0,0|2,0,0]=4 2896 B10R1.85 CSCC1CCCCCC1 Amb28049613 [1,0,0,1,0,0|1,0,1]=4 2897 B10R1.85 ClCCC1CCCCCC1 Amb10807941 [1,0,0,1,0,0|1,0,0]=3 2898 B10R1.85 ClCCN1CCCCCC1 Amb17334546 [1,0,0,1,0,0|2,0,0]=4 2899 B10R1.85 ClCCN1CCCCCC1 Amb8629210 [1,0,0,1,0,0|2,0,0]=4 2900 B10R1.85 N#CCC1CCCCCC1 Amb25757856 [1,0,0,1,0,0|1,0,1]=4 2901 B10R1.85 NCCC1=CCCCCC1 Amb25359914 [1,0,0,1,0,0|1,0,1]=4 2902 B10R1.85 NCCC1=CCCCCC1 Amb28555549 [1,0,0,1,0,0|1,0,1]=4 2903 B10R1.85 NCCC1CCCCCC1 Amb10607689 [1,0,0,1,0,0|1,0,0]=3 2904 B10R1.85 NCCC1CCCCCC1 Amb21964928 [1,0,0,1,0,0|1,0,0]=3 2905 B10R1.85 NCCC1CCCCCN1 Amb27798970 [1,0,0,1,0,0|2,0,0]=4 2906 B10R1.85 NCCC1CCCOCC1 Amb18202432 [1,0,0,1,0,0|2,0,0]=4 2907 B10R1.85 NCCC1CCCSCC1 Amb18199581 [1,0,0,1,0,0|2,0,0]=4 2908 B10R1.85 NCCN1CCCCCC1 Amb1133288 [1,0,0,1,0,0|2,0,0]=4 2909 B10R1.85 NCCN1CCCCCC1 Amb22587137 [1,0,0,1,0,0|2,0,0]=4 2910 B10R1.85 NCCN1CCCCCC1 Amb8631402 [1,0,0,1,0,0|2,0,0]=4 2911 B10R1.85 NNCC1CCCCCC1 Amb24477918 [1,0,0,1,0,0|2,0,0]=4 2912 B10R1.85 NOCC1CCCCCC1 Amb33267301 [1,0,0,1,0,0|2,0,0]=4 2913 B10R1.85 O=C=NC1CCCCCC1 Amb5750732 [1,0,0,1,0,0|1,0,1]=4 2914 B10R1.85 O=CCC1CCCCCC1 Amb28315719 [1,0,0,1,0,0|0,0,0]=2 2915 B10R1.85 O=CNC1CCCOCC1 Amb27660499 [1,0,0,1,0,0|2,0,0]=4 2916 B10R1.85 O=CNC1CCCSCC1 Amb35691519 [1,0,0,1,0,0|2,0,0]=4 2917 B10R1.85 OCCC1=CCCCCC1 Amb27219797 [1,0,0,1,0,0|1,0,1]=4 2918 B10R1.85 OCCC1CCCCCC1 Amb18202549 [1,0,0,1,0,0|0,0,1]=3 2919 B10R1.85 OCCC1CCCCCN1 Amb26603628 [1,0,0,1,0,0|1,0,1]=4 2920 B10R1.85 OCCC1CCCCCN1 Amb32652293 [1,0,0,1,0,0|1,0,1]=4 2921 B10R1.85 OCCC1CCCNCC1 Amb23453242 [1,0,0,1,0,0|1,0,1]=4 2922 B10R1.85 OCCC1CCCOCC1 Amb18202400 [1,0,0,1,0,0|1,0,1]=4 2923 B10R1.85 OCCC1CCCSCC1 Amb18199193 [1,0,0,1,0,0|1,0,1]=4 2924 B10R1.85 OCCN1CCCCCC1 Amb2720466 [1,0,0,1,0,0|1,0,1]=4 2925 B10R1.85 ONCC1CCCCCC1 Amb25283715 [1,0,0,1,0,0|1,0,1]=4 2926 B10R1.85 SCCC1CCCCCC1 Amb24726700 [1,0,0,1,0,0|0,1,0]=3 2927 B10R1.85 SCCN1CCCCCC1 Amb4428919 [1,0,0,1,0,0|1,1,0]=4 2928 B10R1.85 [C-]#[N+]CC1CCCCCC1 Amb32877148 [1,0,0,1,0,0|1,0,1]=4 2929 B10R1.129 C=CCCC[C@@H]1C[C@@H]1C=O Amb27252225 [1,0,0,1,0,0|0,0,2]=4 2930 B10R1.129 C=CCCC[C@@H]1C[C@H]1CO Amb27446236 [1,0,0,1,0,0|1,0,1]=4 2931 B10R1.129 C=CCCNC1CC1CC Amb27839386 [1,0,0,1,0,0|1,0,1]=4 2932 B10R1.129 C=CCNCC1CC1CC Amb27781138 [1,0,0,1,0,0|1,0,1]=4 2933 B10R1.129 C=CCNC[C@@H]1C[C@H]1CC Amb28455862 [1,0,0,1,0,0|1,0,1]=4 2934 B10R1.129 CCC1CC1CNCCF Amb28146090 [1,0,0,1,0,0|2,0,0]=4 2935 B10R1.129 CCC1CC1NCCCN Amb28126002 [1,0,0,1,0,0|2,0,0]=4 2936 B10R1.129 CCC1OC1CCCCN Amb28428407 [1,0,0,1,0,0|2,0,0]=4 2937 B10R1.129 CCC1OC1CCCCO Amb27661005 [1,0,0,1,0,0|1,0,1]=4 2938 B10R1.129 CCCCCC1CC1C=O Amb26343852 [1,0,0,1,0,0|0,0,0]=2 2939 B10R1.129 CCCCCC1OC1CC Amb28400729 [1,0,0,1,0,0|1,0,1]=4 2940 B10R1.129 CCCCCC1OC1CO Amb27839244 [1,0,0,1,0,0|1,0,1]=4 2941 B10R1.129 CCCCC[C@@H]1O[C@@H]1C=O Amb27640547 [1,0,0,1,0,0|1,0,0]=3 2942 B10R1.129 CCCCC[C@@H]1O[C@@H]1CO Amb28344365 [1,0,0,1,0,0|1,0,1]=4 2943 B10R1.129 CCCCC[C@H]1O[C@@H]1CBr Amb27218276 [1,0,0,1,0,0|2,0,0]=4 2944 B10R1.129 CCCNCC1CC1CC Amb27394136 [1,0,0,1,0,0|1,0,1]=4 2945 B10R1.129 CCCOC[C@H]1C[C@H]1CO Amb27451301 [1,0,0,1,0,0|1,0,1]=4 2946 B10R1.129 CC[C@@H]1O[C@H]1CCCCN Amb27419991 [1,0,0,1,0,0|2,0,0]=4 2947 B10R1.129 CC[C@H]1O[C@H]1CCCCBr Amb28388687 [1,0,0,1,0,0|2,0,0]=4 2948 B10R1.129 CC[C@H]1O[C@H]1CCCCO Amb27970969 [1,0,0,1,0,0|1,0,1]=4 2949 B10R1.132 C=CCC1CCC1CNC Amb27807258 [1,0,0,1,0,0|1,0,1]=4 2950 B10R1.132 CCCC1CCC1CNC Amb27468157 [1,0,0,1,0,0|1,0,1]=4 2951 B10R1.132 NCCC1CCC1CCN Amb27783542 [1,0,0,1,0,0|2,0,0]=4 2952 B10R1.132 NCC[C@@H]1CC[C@H]1CCN Amb27845753 [1,0,0,1,0,0|2,0,0]=4 2953 B10R1.161 BrCC1C=CCCCCC1 Amb27830072 [1,0,0,1,0,0|1,0,1]=4 2954 B10R1.161 BrCC1CCCCCCC1 Amb28043687 [1,0,0,1,0,0|1,0,0]=3 2955 B10R1.161 CC=C1CCCCCCC1 Amb22730433 [1,0,0,1,0,0|1,0,1]=4 2956 B10R1.161 CCC1CCCCCCN1 Amb33069617 [1,0,0,1,0,0|1,0,0]=3 2957 B10R1.161 CCC1OCCCCCO1 Amb27461108 [1,0,0,1,0,0|1,0,1]=4 2958 B10R1.161 CCN1CCCCCCC1 Amb27809490 [1,0,0,1,0,0|1,0,1]=4 2959 B10R1.161 CNC1CCCCCCC1 Amb1118420 [1,0,0,1,0,0|1,0,1]=4 2960 B10R1.161 COC1=CCCCCCC1 Amb2721275 [1,0,0,1,0,0|1,0,1]=4 2961 B10R1.161 ICC1CCCCCCC1 Amb24428840 [1,0,0,1,0,0|1,0,0]=3 2962 B10R1.161 N#CC1CCCCCCC1 Amb8950082 [1,0,0,1,0,0|1,0,1]=4 2963 B10R1.161 NCC1CCCCCCC1 Amb10610273 [1,0,0,1,0,0|1,0,0]=3 2964 B10R1.161 NCC1CCCCCCC1 Amb8950177 [1,0,0,1,0,0|1,0,0]=3 2965 B10R1.161 O=CC1=CCCCCCC1 Amb17621598 [1,0,0,1,0,0|0,0,2]=4 2966 B10R1.161 O=CC1CCC=CCCC1 Amb25766561 [1,0,0,1,0,0|0,0,2]=4 2967 B10R1.161 O=CC1CCCCCCC1 Amb31307750 [1,0,0,1,0,0|0,0,0]=2 2968 B10R1.161 O=CC1CCCCCCC1 Amb8390588 [1,0,0,1,0,0|0,0,0]=2 2969 B10R1.161 O=CN1CCCCCCC1 Amb27150999 [1,0,0,1,0,0|1,0,0]=3 2970 B10R1.161 O=CN1CCCCNCC1 Amb28126835 [1,0,0,1,0,0|2,0,0]=4 2971 B10R1.161 O=NN1CCCCCCC1 Amb22730533 [1,0,0,1,0,0|2,0,0]=4 2972 B10R1.161 OCC1=CCCCCCC1 Amb28185100 [1,0,0,1,0,0|1,0,1]=4 2973 B10R1.161 OCC1CCCCCCC1 Amb10807382 [1,0,0,1,0,0|0,0,1]=3 2974 B10R1.161 ONC1CCCCCCC1 Amb27857660 [1,0,0,1,0,0|1,0,1]=4 2975 B10R1.161 SCC1CCCCCCC1 Amb24522730 [1,0,0,1,0,0|0,1,0]=3 2976 B10R1.177 BrCCCCOCC1CC1 Amb8855465 [1,0,0,1,0,0|2,0,0]=4 2977 B10R1.177 BrCCCOCCC1CC1 Amb27400209 [1,0,0,1,0,0|2,0,0]=4 2978 B10R1.177 C=CCCCCNC1CC1 Amb26437254 [1,0,0,1,0,0|1,0,1]=4 2979 B10R1.177 CCCCCCCC1CO1 Amb26986702 [1,0,0,1,0,0|0,0,1]=3 2980 B10R1.177 CCCCCCC[C@@H]1CO1 Amb27175386 [1,0,0,1,0,0|0,0,1]=3 2981 B10R1.177 CCCCCCNC1CC1 Amb7761069 [1,0,0,1,0,0|1,0,1]=4 2982 B10R1.177 CCCCCOCC1CO1 Amb8873732 [1,0,0,1,0,0|1,0,1]=4 2983 B10R1.177 CCCCCOC[C@H]1CO1 Amb22225159 [1,0,0,1,0,0|1,0,1]=4 2984 B10R1.177 CCCCCSC[C@H]1CO1 Amb27272945 [1,0,0,1,0,0|1,0,1]=4 2985 B10R1.177 CCCCSCCC1CO1 Amb27780799 [1,0,0,1,0,0|1,0,1]=4 2986 B10R1.177 FCCCNCCC1CC1 Amb27425078 [1,0,0,1,0,0|2,0,0]=4 2987 B10R1.177 FCCCSCCC1CC1 Amb28316106 [1,0,0,1,0,0|2,0,0]=4 2988 B10R1.177 ICCCNCCC1CC1 Amb27766789 [1,0,0,1,0,0|2,0,0]=4 2989 B10R1.177 NCCCCCCC1CC1 Amb27426764 [1,0,0,1,0,0|1,0,0]=3 2990 B10R1.177 NCCCCCNC1CC1 Amb27807863 [1,0,0,1,0,0|2,0,0]=4 2991 B10R1.177 NCCCCOCC1CC1 Amb6681127 [1,0,0,1,0,0|2,0,0]=4 2992 B10R1.177 NCCOCCCC1CC1 Amb23570783 [1,0,0,1,0,0|2,0,0]=4 2993 B10R1.177 O=CCCCOCC1CC1 Amb33167106 [1,0,0,1,0,0|1,0,0]=3 2994 B10R1.177 O=COCCCCC1CC1 Amb8384805 [1,0,0,1,0,0|1,0,0]=3 2995 B10R1.177 OCCCCNCC1CC1 Amb25887483 [1,0,0,1,0,0|1,0,1]=4 2996 B10R1.177 OCCCCSCC1CC1 Amb27406544 [1,0,0,1,0,0|1,0,1]=4 2997 B10R1.177 OCCNCCCC1CC1 Amb27235411 [1,0,0,1,0,0|1,0,1]=4 2998 B10R1.177 SCCCOCCC1CC1 Amb27785266 [1,0,0,1,0,0|1,1,0]=4 2999 B10R1.185 C1CCCCCCCCC1 Amb22230445 [1,0,0,1,0,0|0,0,1]=3 3000 B10R1.185 C1CCCCNCCCC1 Amb28075304 [1,0,0,1,0,0|1,0,0]=3 3001 B10R1.185 C1CCCNCCNCC1 Amb27164128 [1,0,0,1,0,0|2,0,0]=4 3002 B12R1.8 BrCCCCCN1CCCCC1 Amb33624633 [0,1,0,1,0,0|1,0,1]=4 3003 B12R1.8 BrCCCCOC1CCCCC1 Amb8855440 [0,1,0,1,0,0|1,0,1]=4 3004 B12R1.8 C#CCCCNC1CCCCC1 Amb33033438 [0,1,0,1,0,0|1,0,1]=4 3005 B12R1.8 C=CCSCCC1CCCCN1 Amb17503509 [0,1,0,1,0,0|2,0,0]=4 3006 B12R1.8 CCCCCCC1CCCCC1 Amb22230753 [0,1,0,1,0,0|1,0,1]=4 3007 B12R1.8 CCCCCCC1CCCCN1 Amb2235857 [0,1,0,1,0,0|1,0,1]=4 3008 B12R1.8 CCCCCCC1CCCCN1 Amb3788214 [0,1,0,1,0,0|1,0,1]=4 3009 B12R1.8 CCCCCCC1CCCNC1 Amb22642853 [0,1,0,1,0,0|1,0,1]=4 3010 B12R1.8 CCCCCCC1CCNCC1 Amb35745608 [0,1,0,1,0,0|1,0,1]=4 3011 B12R1.8 CCCCCCC1CCNCC1 Amb3933576 [0,1,0,1,0,0|1,0,1]=4 3012 B12R1.8 CCCCCCN1CC=CCC1 Amb32428385 [0,1,0,1,0,0|1,0,1]=4 3013 B12R1.8 CCCCCNC1CCCSC1 Amb19059613 [0,1,0,1,0,0|2,0,0]=4 3014 B12R1.8 CCCCOCC1CCCCN1 Amb18802453 [0,1,0,1,0,0|1,0,1]=4 3015 B12R1.8 CCCCOCC1CCCNC1 Amb18802451 [0,1,0,1,0,0|2,0,0]=4 3016 B12R1.8 CCCC\C=C\C1C=CCCC1 Amb22546770 [0,1,0,1,0,0|1,0,1]=4 3017 B12R1.8 CCCSCCC1CCCCN1 Amb17503510 [0,1,0,1,0,0|1,0,1]=4 3018 B12R1.8 CNCCCCN1CCCCC1 Amb18793821 [0,1,0,1,0,0|2,0,0]=4 3019 B12R1.8 CNCCCNC1CCCCC1 Amb18802059 [0,1,0,1,0,0|2,0,0]=4 3020 B12R1.8 COCCCNC1CCCCC1 Amb35750760 [0,1,0,1,0,0|2,0,0]=4 3021 B12R1.8 COCCCNC1CCCCC1 Amb6730320 [0,1,0,1,0,0|2,0,0]=4 3022 B12R1.8 COCCNCC1CCCCC1 Amb6685600 [0,1,0,1,0,0|2,0,0]=4 3023 B12R1.8 CSCCCNC1CCCCC1 Amb6719476 [0,1,0,1,0,0|2,0,0]=4 3024 B12R1.8 ClCCCCCN1CCCCC1 Amb19515039 [0,1,0,1,0,0|1,0,1]=4 3025 B12R1.8 ClCCCCOC1CCCCC1 Amb19073215 [0,1,0,1,0,0|1,0,1]=4 3026 B12R1.8 N#CCCCCN1CCCCC1 Amb4011659 [0,1,0,1,0,0|1,0,1]=4 3027 B12R1.8 N#CCCCNC1CCCCC1 Amb6706957 [0,1,0,1,0,0|1,0,1]=4 3028 B12R1.8 NCCCCCC1CCCCC1 Amb18825833 [0,1,0,1,0,0|1,0,1]=4 3029 B12R1.8 NCCCCCN1CCCCC1 Amb34914067 [0,1,0,1,0,0|1,0,1]=4 3030 B12R1.8 NCCCCCN1CCCCC1 Amb5357882 [0,1,0,1,0,0|1,0,1]=4 3031 B12R1.8 NCCCOCC1CCCCC1 Amb18802489 [0,1,0,1,0,0|1,0,1]=4 3032 B12R1.8 O=C=NCCCC1CCCCC1 Amb33449653 [0,1,0,1,0,0|0,0,1]=3 3033 B12R1.8 O=CCCC#CC1CCCCC1 Amb27816394 [0,1,0,1,0,0|0,0,1]=3 3034 B12R1.8 O=CCCCCC1CCCCC1 Amb33359606 [0,1,0,1,0,0|0,0,0]=2 3035 B12R1.8 O=CCCCCN1CCOCC1 Amb33324401 [0,1,0,1,0,0|1,0,0]=3 3036 B12R1.8 OCCCCCN1CCCCC1 Amb13883419 [0,1,0,1,0,0|0,0,2]=4 3037 B12R1.8 OCCCCNC1CCCCC1 Amb6334829 [0,1,0,1,0,0|0,0,2]=4 3038 B12R1.8 OCCCNCC1CCCCC1 Amb6733597 [0,1,0,1,0,0|0,0,2]=4 3039 B12R1.8 [N-]=[N+]=NCCCC1CCCCC1 Amb33429707 [0,1,0,1,0,0|2,0,0]=4 3040 B12R1.18 C#CCCC1CCCCCC1=O Amb27814092 [0,1,0,1,0,0|0,0,1]=3 3041 B12R1.18 C#CCCC1CCCCCC1Br Amb27637578 [0,1,0,1,0,0|1,0,1]=4 3042 B12R1.18 C#CCCC1CCCCCC1N Amb27955048 [0,1,0,1,0,0|1,0,1]=4 3043 B12R1.18 C#CCCC1CCCCCC1O Amb25764667 [0,1,0,1,0,0|1,0,1]=4 3044 B12R1.18 C#CCCC1CCCCNC1=O Amb27952658 [0,1,0,1,0,0|0,0,2]=4 3045 B12R1.18 C#CCCN1CCCCCC1=O Amb27455906 [0,1,0,1,0,0|0,0,2]=4 3046 B12R1.18 C#CCCN1CCCCCC1C Amb28200151 [0,1,0,1,0,0|1,0,1]=4 3047 B12R1.18 C#CCC[C@@H]1CCCCC[C@H]1O Amb32945566 [0,1,0,1,0,0|1,0,1]=4 3048 B12R1.18 C=C1CCCCCC1CCCO Amb27457881 [0,1,0,1,0,0|1,0,0]=3 3049 B12R1.18 C=CCCC1CCCCCC1O Amb27480225 [0,1,0,1,0,0|1,0,0]=3 3050 B12R1.18 C=CCCN1CCCCCC1C Amb27756864 [0,1,0,1,0,0|1,0,0]=3 3051 B12R1.18 C=CCCN1CCCOCC1C Amb27414258 [0,1,0,1,0,0|2,0,0]=4 3052 B12R1.18 C=CCCN1CCOCCC1C Amb27809448 [0,1,0,1,0,0|2,0,0]=4 3053 B12R1.18 C=CCC[C@@H]1CCCCC[C@H]1O Amb33213933 [0,1,0,1,0,0|1,0,0]=3 3054 B12R1.18 C=CCNC1CCCCCC1Cl Amb28256726 [0,1,0,1,0,0|2,0,0]=4 3055 B12R1.18 C=CCOC1CCCCCC1O Amb27206059 [0,1,0,1,0,0|2,0,0]=4 3056 B12R1.18 C=CCO[C@@H]1CCCCC[C@@H]1O Amb27653264 [0,1,0,1,0,0|2,0,0]=4 3057 B12R1.18 CC1CCCCCC1NCCF Amb28286000 [0,1,0,1,0,0|1,0,1]=4 3058 B12R1.18 CC1CCCCCN1CCC#N Amb27195624 [0,1,0,1,0,0|1,0,1]=4 3059 B12R1.18 CC1CCCCCN1CCC=O Amb27779071 [0,1,0,1,0,0|0,0,0]=2 3060 B12R1.18 CC1CCCCCN1CCCCl Amb27212852 [0,1,0,1,0,0|1,0,1]=4 3061 B12R1.18 CC1CCCCCN1CCCO Amb27254073 [0,1,0,1,0,0|0,0,2]=4 3062 B12R1.18 CC1CCCCCN1C\C=C\Cl Amb27649530 [0,1,0,1,0,0|1,0,1]=4 3063 B12R1.18 CCCCC1CCCC=CC1=O Amb28199947 [0,1,0,1,0,0|0,0,1]=3 3064 B12R1.18 CCCCC1CCCCCC1=O Amb18799266 [0,1,0,1,0,0|0,0,0]=2 3065 B12R1.18 CCCCC1CCCCCC1Br Amb28365719 [0,1,0,1,0,0|1,0,1]=4 3066 B12R1.18 CCCCC1CCCCCC1Cl Amb28187102 [0,1,0,1,0,0|1,0,1]=4 3067 B12R1.18 CCCCC1CCCCCC1O Amb18806714 [0,1,0,1,0,0|0,0,2]=4 3068 B12R1.18 CCCCC1CCCCNC1=O Amb27770065 [0,1,0,1,0,0|0,0,0]=2 3069 B12R1.18 CCCCC1NCCCCC1C Amb27986201 [0,1,0,1,0,0|1,0,1]=4 3070 B12R1.18 CCCCC1NCCCNC1=O Amb32719900 [0,1,0,1,0,0|1,0,0]=3 3071 B12R1.18 CCCCN1CCCNCC1=O Amb26644654 [0,1,0,1,0,0|1,0,0]=3 3072 B12R1.18 CCCCN1CCNCCC1=O Amb21959310 [0,1,0,1,0,0|1,0,0]=3 3073 B12R1.18 CCCC[C@@H]1C=CCCC[C@H]1O Amb27443011 [0,1,0,1,0,0|1,0,0]=3 3074 B12R1.18 CCCC[C@@H]1CCCCC[C@H]1O Amb26435137 [0,1,0,1,0,0|0,0,2]=4 3075 B12R1.18 CCCOC1CCCCCC1Br Amb26431584 [0,1,0,1,0,0|1,0,1]=4 3076 B12R1.18 CCCOC1CCCCCC1I Amb25188247 [0,1,0,1,0,0|1,0,1]=4 3077 B12R1.18 CCCSC1CCCCCC1O Amb27444903 [0,1,0,1,0,0|0,0,2]=4 3078 B12R1.18 CCCSC1CCCCNC1=O Amb27203415 [0,1,0,1,0,0|1,0,0]=3 3079 B12R1.18 CCOCC1CCCCCC1=O Amb27465325 [0,1,0,1,0,0|0,0,0]=2 3080 B12R1.18 CCOCC1CCCCCC1O Amb27628602 [0,1,0,1,0,0|0,0,2]=4 3081 B12R1.18 CCOC[C@@H]1CCCCC[C@H]1O Amb33212821 [0,1,0,1,0,0|0,0,2]=4 3082 B12R1.18 CCOC[C@@H]1NCCCNC1=O Amb32719941 [0,1,0,1,0,0|2,0,0]=4 3083 B12R1.18 CCO\C=C1/CCCCCC1=O Amb33291539 [0,1,0,1,0,0|0,0,2]=4 3084 B12R1.18 CCO\C=C1\CCCCCC1=O Amb27402811 [0,1,0,1,0,0|0,0,2]=4 3085 B12R1.18 CN1CCCCCC1CCCN Amb18198764 [0,1,0,1,0,0|1,0,1]=4 3086 B12R1.18 CNCCN1CCCCCC1=O Amb18977654 [0,1,0,1,0,0|1,0,0]=3 3087 B12R1.18 COCCC1CCCCCC1Br Amb27397473 [0,1,0,1,0,0|1,0,1]=4 3088 B12R1.18 COCCC1CCCCCC1O Amb18807461 [0,1,0,1,0,0|0,0,2]=4 3089 B12R1.18 COCCC1NCCCNC1=O Amb32719932 [0,1,0,1,0,0|2,0,0]=4 3090 B12R1.18 COCCN1CCCNCC1=O Amb33547963 [0,1,0,1,0,0|2,0,0]=4 3091 B12R1.18 COCCN1CCNCCC1=O Amb21959308 [0,1,0,1,0,0|2,0,0]=4 3092 B12R1.18 COCCN1CCNCCC1=O Amb28988472 [0,1,0,1,0,0|2,0,0]=4 3093 B12R1.18 CSCCC1CCCCCC1Br Amb27770850 [0,1,0,1,0,0|1,0,1]=4 3094 B12R1.18 CSCCC1NCCCNC1=O Amb32719907 [0,1,0,1,0,0|2,0,0]=4 3095 B12R1.18 CSCCN1CCNCCC1=O Amb35641615 [0,1,0,1,0,0|2,0,0]=4 3096 B12R1.18 CSCC[C@@H]1NCCCNC1=O Amb32719926 [0,1,0,1,0,0|2,0,0]=4 3097 B12R1.18 C\C=C\CC1CCCCNC1=O Amb27615324 [0,1,0,1,0,0|0,0,2]=4 3098 B12R1.18 N#CCCC1CCCCCC1O Amb27587561 [0,1,0,1,0,0|1,0,1]=4 3099 B12R1.18 N#CCCN1CCCCCC1=O Amb5720330 [0,1,0,1,0,0|1,0,1]=4 3100 B12R1.18 NCCCN1CCCCCC1=O Amb1153735 [0,1,0,1,0,0|1,0,0]=3 3101 B12R1.18 NCCCN1CCCCCC1=O Amb28991407 [0,1,0,1,0,0|1,0,0]=3 3102 B12R1.18 O=C1CCCCCC1CCCO Amb27614789 [0,1,0,1,0,0|0,0,0]=2 3103 B12R1.18 O=C1CCCCCC1C\C=C\Cl Amb28118877 [0,1,0,1,0,0|0,0,2]=4 3104 B12R1.18 O=C1NCCCCC1CCCO Amb27157529 [0,1,0,1,0,0|1,0,0]=3 3105 B12R1.18 O=C1NCCCCC1NCCF Amb27860047 [0,1,0,1,0,0|2,0,0]=4 3106 B12R1.18 O=CCCC1CCCCCC1=O Amb28123079 [0,1,0,1,0,0|0,0,1]=3 3107 B12R1.18 OCCCN1CCCCCC1=S Amb27853954 [0,1,0,1,0,0|1,1,0]=4 3108 B12R1.37 BrCCCCCCN1CCCC1 Amb33624789 [0,1,0,1,0,0|1,0,1]=4 3109 B12R1.37 BrCCCCCOC1CCCC1 Amb32689538 [0,1,0,1,0,0|1,0,1]=4 3110 B12R1.37 BrCCCCOCC1CCCC1 Amb32690549 [0,1,0,1,0,0|1,0,1]=4 3111 B12R1.37 CCCCCCCC1CCCN1 Amb3788212 [0,1,0,1,0,0|1,0,1]=4 3112 B12R1.37 CCCCCCCC1OCCO1 Amb25368281 [0,1,0,1,0,0|0,0,2]=4 3113 B12R1.37 CCCCCCNC1CCCC1 Amb6730518 [0,1,0,1,0,0|1,0,1]=4 3114 B12R1.37 CCCCCCNC1CCSC1 Amb6730523 [0,1,0,1,0,0|2,0,0]=4 3115 B12R1.37 CCCCCNCC1CCCO1 Amb6708057 [0,1,0,1,0,0|0,0,2]=4 3116 B12R1.37 COCCCCNC1CCCC1 Amb18807086 [0,1,0,1,0,0|2,0,0]=4 3117 B12R1.37 ClCCCCCOC1CCCC1 Amb9001646 [0,1,0,1,0,0|1,0,1]=4 3118 B12R1.37 ClCCCCOCC1CCCC1 Amb32690548 [0,1,0,1,0,0|1,0,1]=4 3119 B12R1.37 NCCCCCCC1CCCC1 Amb33380241 [0,1,0,1,0,0|1,0,1]=4 3120 B12R1.37 NCCCCCCN1CCCC1 Amb2613450 [0,1,0,1,0,0|1,0,1]=4 3121 B12R1.37 NCCCOCCC1CCCC1 Amb33449988 [0,1,0,1,0,0|1,0,1]=4 3122 B12R1.37 O=C=NCCCCC1CCCC1 Amb33374588 [0,1,0,1,0,0|0,0,1]=3 3123 B12R1.37 O=C=NCCCCN1CCCC1 Amb33449712 [0,1,0,1,0,0|1,0,1]=4 3124 B12R1.37 O=CCCCCCC1CCCC1 Amb33380237 [0,1,0,1,0,0|0,0,0]=2 3125 B12R1.37 O=CCCCCCN1CCCC1 Amb33274869 [0,1,0,1,0,0|0,0,0]=2 3126 B12R1.37 [N-]=[N+]=NCCCCC1CCCC1 Amb33379886 [0,1,0,1,0,0|2,0,0]=4 3127 B12R1.52 C=CCC1CCCCCCC1O Amb27604455 [0,1,0,1,0,0|1,0,0]=3 3128 B12R1.52 C=CC[C@@H]1CCCCCC[C@H]1O Amb27457903 [0,1,0,1,0,0|1,0,0]=3 3129 B12R1.52 CCOC1CCCCCCC1Br Amb26615083 [0,1,0,1,0,0|1,0,1]=4 3130 B12R1.52 CCOC1CCCCCCC1I Amb25130056 [0,1,0,1,0,0|1,0,1]=4 3131 B12R1.52 CCOC1CCCCCCC1O Amb18807444 [0,1,0,1,0,0|0,0,2]=4 3132 B12R1.52 CCSC1CCCCCCC1N Amb28288745 [0,1,0,1,0,0|1,0,1]=4 3133 B12R1.52 CC\C=C1/CCCCCCC1=O Amb27954034 [0,1,0,1,0,0|0,0,1]=3 3134 B12R1.52 CC\C=C1\CCCCCCC1=O Amb26484217 [0,1,0,1,0,0|0,0,1]=3 3135 B12R1.52 N#CCC1CCCCCCC1=O Amb28058875 [0,1,0,1,0,0|0,0,1]=3 3136 B12R1.52 N#CCC1CCCCCCC1O Amb27451097 [0,1,0,1,0,0|1,0,1]=4 3137 B12R1.52 O=CCC1CCCCCCC1=O Amb27830090 [0,1,0,1,0,0|0,0,1]=3 3138 B12R1.52 OC1CCCCCCC1\C=C\Cl Amb28320770 [0,1,0,1,0,0|1,0,1]=4 3139 B12R1.52 [N-]=[N+]=NC1CCCCCCC1=O Amb27794754 [0,1,0,1,0,0|2,0,0]=4 3140 B12R1.73 CN1CCCCCCCC1C#N Amb27966230 [0,1,0,1,0,0|1,0,1]=4 3141 B12R1.73 CN1CCCCCCCC1CN Amb27636671 [0,1,0,1,0,0|1,0,1]=4 3142 B12R1.73 CN1CCCCCCCC1CO Amb28368837 [0,1,0,1,0,0|0,0,2]=4 3143 B12R1.73 [N-]=[N+]=C1CCCCCCCC1=O Amb17594137 [0,1,0,1,0,0|1,0,1]=4 3144 B12R1.121 C#CCCC1CCCCC1CN Amb27391001 [0,1,0,1,0,0|1,0,1]=4 3145 B12R1.121 CC#CCN1CCCCC1C=O Amb18798439 [0,1,0,1,0,0|0,0,2]=4 3146 B12R1.121 CCC1CCCCC1NCCO Amb19018948 [0,1,0,1,0,0|0,0,2]=4 3147 B12R1.121 CCC1CCCCC1OCCO Amb18807445 [0,1,0,1,0,0|0,0,2]=4 3148 B12R1.121 CCC1CCCCC1\C=C\CO Amb27960104 [0,1,0,1,0,0|0,0,2]=4 3149 B12R1.121 CCC1CCCCN1CCC#N Amb8872864 [0,1,0,1,0,0|1,0,1]=4 3150 B12R1.121 CCC1CCCCN1CCCCl Amb17336179 [0,1,0,1,0,0|1,0,1]=4 3151 B12R1.121 CCC1CCCCN1CCCN Amb9703676 [0,1,0,1,0,0|1,0,1]=4 3152 B12R1.121 CCC1CCCCN1CCCO Amb9246593 [0,1,0,1,0,0|0,0,2]=4 3153 B12R1.121 CCC1CCCCN1CCNC Amb8894089 [0,1,0,1,0,0|2,0,0]=4 3154 B12R1.121 CCC1CCCCN1C\C=C\Cl Amb27456173 [0,1,0,1,0,0|1,0,1]=4 3155 B12R1.121 CCCCC1NCCCC1CN Amb33500847 [0,1,0,1,0,0|1,0,1]=4 3156 B12R1.121 CCCCN1CCCCC1CN Amb9731141 [0,1,0,1,0,0|1,0,1]=4 3157 B12R1.121 CCCCN1CCCC[C@@H]1CN Amb33218413 [0,1,0,1,0,0|1,0,1]=4 3158 B12R1.121 CCCCN1CCCC[C@H]1CN Amb33218400 [0,1,0,1,0,0|1,0,1]=4 3159 B12R1.121 CCN1CCCCC1CN=C=O Amb27186727 [0,1,0,1,0,0|1,0,1]=4 3160 B12R1.121 COC1CCCCC1CN=C=O Amb25159373 [0,1,0,1,0,0|1,0,1]=4 3161 B12R1.121 C\C=C\CN1CCCCC1CC Amb27211425 [0,1,0,1,0,0|1,0,1]=4 3162 B12R1.121 O=C=NCC1CCCCC1CF Amb27186753 [0,1,0,1,0,0|1,0,1]=4 3163 B12R1.121 [C-]#[N+]CCC1CCCCC1CF Amb27791332 [0,1,0,1,0,0|2,0,0]=4 3164 B12R1.150 C=C1CCCCCCCCC1O Amb27432139 [0,1,0,1,0,0|1,0,0]=3 3165 B12R1.150 CC1CC=CCCCCNC1=O Amb25936084 [0,1,0,1,0,0|0,0,2]=4 3166 B12R1.150 C[C@@H]1CC=CCCCCNC1=O Amb28243785 [0,1,0,1,0,0|0,0,2]=4 3167 B12R1.150 C[C@@H]1CCCCCCCNC1=O Amb28047251 [0,1,0,1,0,0|0,0,0]=2 3168 B12R1.150 C[C@H]1CC=CCCCCNC1=O Amb28367817 [0,1,0,1,0,0|0,0,2]=4 3169 B12R1.150 C[C@H]1CCCCCCCNC1=O Amb28059295 [0,1,0,1,0,0|0,0,0]=2 3170 B12R1.150 Cl[C@@H]1CCCCCCCC[C@H]1Cl Amb28130442 [0,1,0,1,0,0|1,0,1]=4 3171 B12R1.150 NC1CCCCCCCCC1O Amb25152507 [0,1,0,1,0,0|0,0,2]=4 3172 B12R1.150 O=C1CCCCCCCCC1=O Amb17594209 [0,1,0,1,0,0|0,0,1]=3 3173 B12R1.150 O=C1CCCCCCCCC1Br Amb28244232 [0,1,0,1,0,0|0,0,0]=2 3174 B12R1.150 O=C1CCCCCCCCC1Cl Amb27233508 [0,1,0,1,0,0|0,0,0]=2 3175 B12R1.150 O=C1CCCCCCCCC1F Amb27828822 [0,1,0,1,0,0|0,0,0]=2 3176 B12R1.150 O=C1CCCCCCCCC1O Amb4017052 [0,1,0,1,0,0|0,0,0]=2 3177 B12R1.150 O=C1NCCCCCCCC1Br Amb27410410 [0,1,0,1,0,0|1,0,0]=3 3178 B12R1.150 OC1CCCCCCCCC1Cl Amb27828119 [0,1,0,1,0,0|0,0,2]=4 3179 B12R1.150 OC1CCCCCCCCC1O Amb17594327 [0,1,0,1,0,0|0,0,2]=4 3180 B12R1.150 O[C@@H]1CCCCCCCC[C@H]1Cl Amb28132360 [0,1,0,1,0,0|0,0,2]=4 3181 B12R1.150 O[C@@H]1CCCCCCCC[C@H]1O Amb28290410 [0,1,0,1,0,0|0,0,2]=4 3182 B12R1.169 C#CCC1CCCCC1CNC Amb27808915 [0,1,0,1,0,0|1,0,1]=4 3183 B12R1.169 C#CCC1CCCCC1NCC Amb18798499 [0,1,0,1,0,0|1,0,1]=4 3184 B12R1.169 C#CCN1CCCCC1CC=O Amb28241397 [0,1,0,1,0,0|0,0,2]=4 3185 B12R1.169 C=C=CC1CCCCC1CC=O Amb27177462 [0,1,0,1,0,0|0,0,2]=4 3186 B12R1.169 C=CCC1CCCCC1NC=O Amb35719495 [0,1,0,1,0,0|0,0,2]=4 3187 B12R1.169 CCCC1CCCCN1CC#N Amb27976634 [0,1,0,1,0,0|1,0,1]=4 3188 B12R1.173 OCCN1CCCCCCCC1 Amb27980603 [0,1,0,1,0,0|0,0,2]=4 3189 B12R1.215 CN1CCCCCCNCCC1 Amb32753622 [0,1,0,1,0,0|2,0,0]=4 3190 B12R1.215 O=C1CCC#CCCCCCC1 Amb27869824 [0,1,0,1,0,0|0,0,1]=3 3191 B12R1.215 O=C1CCCC#CCCCCC1 Amb27234351 [0,1,0,1,0,0|0,0,1]=3 3192 B12R1.215 O=C1CCCCCCCCCC1 Amb2778534 [0,1,0,1,0,0|0,0,0]=2 3193 B12R1.215 O=C1CCCCCCCCCN1 Amb26068652 [0,1,0,1,0,0|0,0,0]=2 3194 B12R1.215 O=C1CCCCCOCCCC1 Amb27177976 [0,1,0,1,0,0|0,0,0]=2 3195 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,1,0,1,0,0|1,0,0]=3 3196 B12R1.215 OC1CC#CCCCCCCC1 Amb28188285 [0,1,0,1,0,0|1,0,1]=4 3197 B12R1.215 O[C@H]1C=C=CCCCCCCC1 Amb27665486 [0,1,0,1,0,0|1,0,1]=4 3198 B12R1.267 C#CCCCC1CCCCC1=O Amb27175821 [0,1,0,1,0,0|0,0,1]=3 3199 B12R1.267 C#CCCCC1CCCCC1N Amb27416555 [0,1,0,1,0,0|1,0,1]=4 3200 B12R1.267 C#CCCCC1CCCCC1O Amb24416932 [0,1,0,1,0,0|1,0,1]=4 3201 B12R1.267 C#CCCCC1CCCNC1=O Amb27603127 [0,1,0,1,0,0|0,0,2]=4 3202 B12R1.267 C#CCCCC1CNCCC1=O Amb27976717 [0,1,0,1,0,0|0,0,2]=4 3203 B12R1.267 C#CCCCN1CCCCC1C Amb27195311 [0,1,0,1,0,0|1,0,1]=4 3204 B12R1.267 C#CCCC[C@@H]1CCCC[C@H]1O Amb26426712 [0,1,0,1,0,0|1,0,1]=4 3205 B12R1.267 C=C=CCCC1CCCCC1=O Amb28053969 [0,1,0,1,0,0|0,0,2]=4 3206 B12R1.267 C=C=CCC[C@H]1CCCC[C@@H]1O Amb27422493 [0,1,0,1,0,0|2,0,0]=4 3207 B12R1.267 C=CCCCC1CCCCC1=O Amb17594142 [0,1,0,1,0,0|0,0,1]=3 3208 B12R1.267 C=CCCCC1CCCCC1O Amb33213369 [0,1,0,1,0,0|1,0,0]=3 3209 B12R1.267 C=CCCC[C@@H]1CCCC[C@H]1O Amb32945331 [0,1,0,1,0,0|1,0,0]=3 3210 B12R1.267 CC#CCCC1CCCCC1=O Amb27256491 [0,1,0,1,0,0|0,0,1]=3 3211 B12R1.267 CC#CCCC1CCCNC1=O Amb27863720 [0,1,0,1,0,0|0,0,2]=4 3212 B12R1.267 CC#CCCC1CNCCC1=O Amb27178430 [0,1,0,1,0,0|0,0,2]=4 3213 B12R1.267 CC#CCCC1COCCC1=O Amb27831773 [0,1,0,1,0,0|0,0,2]=4 3214 B12R1.267 CC1CCCCC1CNCC#N Amb18979886 [0,1,0,1,0,0|1,0,1]=4 3215 B12R1.267 CC1CCCCC1NCCC#N Amb6736393 [0,1,0,1,0,0|1,0,1]=4 3216 B12R1.267 CC1CCCCC1NCCCN Amb17315297 [0,1,0,1,0,0|1,0,1]=4 3217 B12R1.267 CC1CCCCC1NCCCO Amb4304111 [0,1,0,1,0,0|0,0,2]=4 3218 B12R1.267 CC1CCCCC1NC\C=C\Cl Amb27587496 [0,1,0,1,0,0|1,0,1]=4 3219 B12R1.267 CC1CCCCN1CCCC#N Amb6268645 [0,1,0,1,0,0|1,0,1]=4 3220 B12R1.267 CC1CCCCN1CCCCCl Amb17336177 [0,1,0,1,0,0|1,0,1]=4 3221 B12R1.267 CC1CCCCN1CCCCN Amb5357863 [0,1,0,1,0,0|1,0,1]=4 3222 B12R1.267 CC1CCCCN1CCCON Amb17104890 [0,1,0,1,0,0|2,0,0]=4 3223 B12R1.267 CC1CCCCN1CCN=C=O Amb27803090 [0,1,0,1,0,0|1,0,1]=4 3224 B12R1.267 CCC#CCC1CCCCC1=O Amb27599447 [0,1,0,1,0,0|0,0,1]=3 3225 B12R1.267 CCCCCC1CCCCC1=O Amb18788895 [0,1,0,1,0,0|0,0,0]=2 3226 B12R1.267 CCCCCC1CCCCC1O Amb18806707 [0,1,0,1,0,0|0,0,2]=4 3227 B12R1.267 CCCCC[C@@H]1CCCC[C@H]1O Amb32944228 [0,1,0,1,0,0|0,0,2]=4 3228 B12R1.267 CCCCNC1CCCCC1C Amb6690979 [0,1,0,1,0,0|1,0,1]=4 3229 B12R1.267 CCCCOC1CCCCC1Br Amb33349372 [0,1,0,1,0,0|1,0,1]=4 3230 B12R1.267 CCCCOC1CCCCC1I Amb33349604 [0,1,0,1,0,0|1,0,1]=4 3231 B12R1.267 CCCC\C=C1/CCCCC1=O Amb27176057 [0,1,0,1,0,0|0,0,1]=3 3232 B12R1.267 CCCC\C=C1\CCCCC1=O Amb26548610 [0,1,0,1,0,0|0,0,1]=3 3233 B12R1.267 CCCNCC1CCCNC1=O Amb32756838 [0,1,0,1,0,0|1,0,0]=3 3234 B12R1.267 CCCOCC1CCCCC1O Amb33213642 [0,1,0,1,0,0|0,0,2]=4 3235 B12R1.267 CCCOC[C@@H]1CCCC[C@H]1O Amb32945321 [0,1,0,1,0,0|0,0,2]=4 3236 B12R1.267 CCC\C=C\[C@H]1CCCCC1=O Amb28321855 [0,1,0,1,0,0|0,0,1]=3 3237 B12R1.267 CCC\C=N\N1CCCCC1=O Amb28293820 [0,1,0,1,0,0|1,0,1]=4 3238 B12R1.267 CN1CCCCC1CCCC=O Amb33322453 [0,1,0,1,0,0|0,0,0]=2 3239 B12R1.267 CN1CCCCC1CCCCN Amb33322457 [0,1,0,1,0,0|1,0,1]=4 3240 B12R1.267 CN1CCCCC1CCN=C=O Amb33323466 [0,1,0,1,0,0|1,0,1]=4 3241 B12R1.267 COCCCC1CCCCC1O Amb18807460 [0,1,0,1,0,0|0,0,2]=4 3242 B12R1.267 COCCC[C@@H]1CCCC[C@H]1O Amb32945788 [0,1,0,1,0,0|0,0,2]=4 3243 B12R1.267 COCCNC1CCCCC1C Amb6685591 [0,1,0,1,0,0|2,0,0]=4 3244 B12R1.267 C\C=C\CCC1CCCCC1=O Amb26592783 [0,1,0,1,0,0|0,0,1]=3 3245 B12R1.267 C\C=C\COC1CCCCC1=O Amb25179608 [0,1,0,1,0,0|0,0,2]=4 3246 B12R1.267 N#CCCCC1CCCCC1=O Amb18646376 [0,1,0,1,0,0|0,0,1]=3 3247 B12R1.267 NCCCCN1CCCCC1=O Amb6751260 [0,1,0,1,0,0|1,0,0]=3 3248 B12R1.267 NCCCCN1CCOCC1=O Amb18254549 [0,1,0,1,0,0|2,0,0]=4 3249 B12R1.267 O=C1CCCCC1CNCCBr Amb1146038 [0,1,0,1,0,0|1,0,0]=3 3250 B12R1.267 O=C1CCCCC1CNCCBr Amb2602398 [0,1,0,1,0,0|1,0,0]=3 3251 B12R1.267 O=C1CCCCC1C\C=C/CO Amb27409618 [0,1,0,1,0,0|0,0,2]=4 3252 B12R1.267 O=C1CCCCC1C\C=C\CO Amb25108064 [0,1,0,1,0,0|0,0,2]=4 3253 B12R1.267 O=C=NCCC1CCCCC1F Amb27209068 [0,1,0,1,0,0|1,0,1]=4 3254 B12R1.267 O=C\C=C\CC1CCCCC1O Amb27859379 [0,1,0,1,0,0|0,0,2]=4 3255 B12R1.267 [C-]#[N+]CCCN1CCCCC1C Amb33747524 [0,1,0,1,0,0|2,0,0]=4 3256 B12R1.271 CNCCCCNCC1CC1C Amb28963358 [0,1,0,1,0,0|2,0,0]=4 3257 B12R1.271 CNCCCCNCC1CC1C Amb32670700 [0,1,0,1,0,0|2,0,0]=4 3258 B12R1.272 C=CCCCCCOC1CNC1 Amb32941472 [0,1,0,1,0,0|2,0,0]=4 3259 B12R1.272 CCCCCCCOC1CNC1 Amb18802643 [0,1,0,1,0,0|2,0,0]=4 3260 B12R1.272 COCCCCCNC1CCC1 Amb33133272 [0,1,0,1,0,0|2,0,0]=4 3261 B12R1.281 C#CCC1CCCCCC1CN Amb27170406 [0,1,0,1,0,0|1,0,1]=4 3262 B12R1.281 C=CCC1CCCCCC1NC Amb18799003 [0,1,0,1,0,0|1,0,0]=3 3263 B12R1.281 C=CCN1CCCCCC1CBr Amb27468425 [0,1,0,1,0,0|2,0,0]=4 3264 B12R1.281 C=CCN1CCCCCC1CO Amb27881501 [0,1,0,1,0,0|2,0,0]=4 3265 B12R1.281 CCC1CCCCCC1CCN Amb35733868 [0,1,0,1,0,0|1,0,1]=4 3266 B12R1.281 CCC1CCCCCC1NOC Amb35725726 [0,1,0,1,0,0|1,0,1]=4 3267 B12R1.281 CCC1CCCCCN1CCI Amb28207013 [0,1,0,1,0,0|1,0,1]=4 3268 B12R1.281 CCC1CCCCCN1CCO Amb27601383 [0,1,0,1,0,0|0,0,2]=4 3269 B12R1.281 CCC1CCCCCN1CCS Amb27640921 [0,1,0,1,0,0|0,1,1]=4 3270 B12R1.281 CCC1CCCCC\C1=C/C#N Amb35611349 [0,1,0,1,0,0|1,0,1]=4 3271 B12R1.281 CCC1CCCCC\C1=C/CN Amb35734026 [0,1,0,1,0,0|1,0,1]=4 3272 B12R1.281 CCCC1CCCCCC1NC Amb18801600 [0,1,0,1,0,0|1,0,1]=4 3273 B12R1.281 CCN1CCCCCC1CC#N Amb27246476 [0,1,0,1,0,0|1,0,1]=4 3274 B12R1.281 CCN1CCCCCC1CCO Amb27187666 [0,1,0,1,0,0|0,0,2]=4 3275 B12R1.281 CCNC1CCCCCC1CO Amb27190715 [0,1,0,1,0,0|0,0,2]=4 3276 B12R1.281 CCSC1CCCCCC1CN Amb9391478 [0,1,0,1,0,0|1,0,1]=4 3277 B12R1.329 C#CCNC1CCCCCCC1 Amb5262822 [0,1,0,1,0,0|1,0,1]=4 3278 B12R1.329 C=CCCC1=CCCCCCC1 Amb30012337 [0,1,0,1,0,0|1,0,1]=4 3279 B12R1.329 C=CCNC1CCCCCCC1 Amb32652162 [0,1,0,1,0,0|1,0,0]=3 3280 B12R1.329 C=CCNC1CCCCCCC1 Amb6683796 [0,1,0,1,0,0|1,0,0]=3 3281 B12R1.329 CCCNC1C=CCCCCC1 Amb27770740 [0,1,0,1,0,0|1,0,0]=3 3282 B12R1.329 CCNCC1CCCCCCN1 Amb27465063 [0,1,0,1,0,0|1,0,1]=4 3283 B12R1.329 CNCCC1CCCCCCC1 Amb18563069 [0,1,0,1,0,0|1,0,1]=4 3284 B12R1.329 COCCN1CCCCCCC1 Amb13979396 [0,1,0,1,0,0|2,0,0]=4 3285 B12R1.329 ClC\C=C\C1CCCCCCC1 Amb27805869 [0,1,0,1,0,0|1,0,1]=4 3286 B12R1.329 FCCNC1CCCCCCC1 Amb27950263 [0,1,0,1,0,0|1,0,1]=4 3287 B12R1.329 ICCCN1CCCCCCC1 Amb27451540 [0,1,0,1,0,0|1,0,1]=4 3288 B12R1.329 N#CCCN1CCCCCCC1 Amb6750398 [0,1,0,1,0,0|1,0,1]=4 3289 B12R1.329 O=CCCC1C=CCCCCC1 Amb28255663 [0,1,0,1,0,0|0,0,1]=3 3290 B12R1.329 O=CNN=C1CCCCCCC1 Amb27163825 [0,1,0,1,0,0|1,0,1]=4 3291 B12R1.329 O=C\C=C\C1CCCCCCC1 Amb28315294 [0,1,0,1,0,0|0,0,1]=3 3292 B12R1.329 OCCCC1CCCCCCN1 Amb18198426 [0,1,0,1,0,0|0,0,2]=4 3293 B12R1.329 OCCCN1CCCCCCC1 Amb9246713 [0,1,0,1,0,0|0,0,2]=4 3294 B12R1.329 OCCNC1CCCCCCC1 Amb32729413 [0,1,0,1,0,0|0,0,2]=4 3295 B12R1.329 OCCNC1CCCCCCC1 Amb6710305 [0,1,0,1,0,0|0,0,2]=4 3296 B12R1.329 SCCNC1CCCCCCC1 Amb26371947 [0,1,0,1,0,0|0,1,1]=4 3297 B12R1.372 CCCCCCC1=CCCC1=O Amb533163 [0,1,0,1,0,0|0,0,1]=3 3298 B12R1.372 CCCCCCC1CCCC1=O Amb621142 [0,1,0,1,0,0|0,0,0]=2 3299 B12R1.372 CCCCCCN1CCCC1=O Amb8387412 [0,1,0,1,0,0|0,0,0]=2 3300 B12R1.372 CCCCCOC1CCCC1Br Amb33129925 [0,1,0,1,0,0|1,0,1]=4 3301 B12R1.372 CCCCCOC1CCCC1I Amb33348895 [0,1,0,1,0,0|1,0,1]=4 3302 B12R1.372 CCOCCCN1CCNC1=O Amb32427138 [0,1,0,1,0,0|2,0,0]=4 3303 B12R1.372 CN1CCCC1CCCCC=O Amb33320354 [0,1,0,1,0,0|0,0,0]=2 3304 B12R1.372 CN1CCCC1CCCCCN Amb33320356 [0,1,0,1,0,0|1,0,1]=4 3305 B12R1.372 CN1CCCC1CCCN=C=O Amb33321397 [0,1,0,1,0,0|1,0,1]=4 3306 B12R1.372 COCCCNC1CCCC1C Amb33496277 [0,1,0,1,0,0|2,0,0]=4 3307 B12R1.373 CCCCCCN1CCC1CN Amb33252021 [0,1,0,1,0,0|1,0,1]=4 3308 B12R1.375 CCCCNCCCCC1CC1 Amb32675845 [0,1,0,1,0,0|1,0,1]=4 3309 B12R1.375 COCCNCCCCC1CC1 Amb32675835 [0,1,0,1,0,0|2,0,0]=4 3310 B12R1.383 CC1CCC1CNCCCCO Amb32421511 [0,1,0,1,0,0|0,0,2]=4 3311 B12R1.399 CNC1CCCCCCC1SC Amb27952593 [0,1,0,1,0,0|2,0,0]=4 3312 B12R1.399 COC1CCCCCC\C1=N/O Amb27813364 [0,1,0,1,0,0|1,0,1]=4 3313 B12R1.399 O=CN1CCCCCCC1CO Amb27179762 [0,1,0,1,0,0|1,0,0]=3 3314 B12R1.399 OCC1CCCCCCC1CO Amb27472666 [0,1,0,1,0,0|0,0,2]=4 3315 B12R1.410 CCC1CCCCCCCCC1 Amb6359494 [0,1,0,1,0,0|1,0,1]=4 3316 B12R1.410 CNC1CCCCCCCCC1 Amb13883575 [0,1,0,1,0,0|1,0,1]=4 3317 B12R1.410 OCC1CCCCCCCCC1 Amb28189439 [0,1,0,1,0,0|0,0,2]=4 3318 B12R1.410 OCC1CCCCNCCCC1 Amb27259380 [0,1,0,1,0,0|0,0,2]=4 3319 B12R1.410 ON=C1CCCCCCCCC1 Amb17671029 [0,1,0,1,0,0|0,0,1]=3 3320 B12R1.458 CCCC1CCC1CNCCN Amb32420104 [0,1,0,1,0,0|1,0,1]=4 3321 B12R1.550 C1=CCCCCCCCCCC1 Amb534273 [0,1,0,1,0,0|1,0,0]=3 3322 B12R1.550 C1=CCCCCCCCCCC1 Amb9787102 [0,1,0,1,0,0|1,0,0]=3 3323 B12R1.550 C1CCCCNCCNCCC1 Amb28135408 [0,1,0,1,0,0|1,0,1]=4 3324 B12R1.550 C1CCNCCCCCNCC1 Amb24743503 [0,1,0,1,0,0|1,0,1]=4 3325 B12R1.1414 C#CCCCC1CCCCNC1 Amb27873618 [0,1,0,1,0,0|1,0,1]=4 3326 B12R1.1414 C#CCNCC1CCCCCC1 Amb27389942 [0,1,0,1,0,0|1,0,1]=4 3327 B12R1.1414 CCCCNC1CCCCCC1 Amb22587068 [0,1,0,1,0,0|1,0,1]=4 3328 B12R1.1414 CCCCNC1CCCCCC1 Amb6690970 [0,1,0,1,0,0|1,0,1]=4 3329 B12R1.1414 CNCCCN1CCCCCC1 Amb10607516 [0,1,0,1,0,0|2,0,0]=4 3330 B12R1.1414 COCCCN1CCCCCC1 Amb17232846 [0,1,0,1,0,0|2,0,0]=4 3331 B12R1.1414 COCCNC1CCCCCC1 Amb6685581 [0,1,0,1,0,0|2,0,0]=4 3332 B12R1.1414 ClCCCCN1CCCCCC1 Amb17336176 [0,1,0,1,0,0|1,0,1]=4 3333 B12R1.1414 N#CCCCN1CCCCCC1 Amb4010764 [0,1,0,1,0,0|1,0,1]=4 3334 B12R1.1414 NCCCCC1CCCCCC1 Amb33079329 [0,1,0,1,0,0|1,0,1]=4 3335 B12R1.1414 NCCCCN1CCCCCC1 Amb22586873 [0,1,0,1,0,0|1,0,1]=4 3336 B12R1.1414 NCCCCN1CCCCCC1 Amb5357868 [0,1,0,1,0,0|1,0,1]=4 3337 B12R1.1414 NCCCNC1CCCCCC1 Amb17315279 [0,1,0,1,0,0|1,0,1]=4 3338 B12R1.1414 NCCCOC1CCCCCC1 Amb19025686 [0,1,0,1,0,0|1,0,1]=4 3339 B12R1.1414 NOCCCN1CCCCCC1 Amb17104889 [0,1,0,1,0,0|2,0,0]=4 3340 B12R1.1414 O=C=NCCC1CCCCCC1 Amb25222900 [0,1,0,1,0,0|0,0,1]=3 3341 B12R1.1414 O=CCCCC1CCCCCC1 Amb32880555 [0,1,0,1,0,0|0,0,0]=2 3342 B12R1.1414 OCCCCN1CCCCCC1 Amb3204766 [0,1,0,1,0,0|0,0,2]=4 3343 B12R1.1414 OCCCNC1CCCCCC1 Amb35752311 [0,1,0,1,0,0|0,0,2]=4 3344 B12R1.1414 OCCCNC1CCCCCC1 Amb6733580 [0,1,0,1,0,0|0,0,2]=4 3345 B12R1.1414 [N-]=[N+]=NCCC1CCCCCC1 Amb32881852 [0,1,0,1,0,0|2,0,0]=4 3346 B12R1.28 C#CCCCC1CCCC(=O)C1 Amb28126616 [0,1,0,1,0,0|0,0,2]=4 3347 B12R1.28 C#CCCCC1CCCC(O)C1 Amb27416557 [0,1,0,1,0,0|1,0,1]=4 3348 B12R1.28 CC1CCCC(CCNC=O)C1 Amb28075880 [0,1,0,1,0,0|1,0,0]=3 3349 B12R1.28 CCCCCC1CCCC(=O)O1 Amb4493671 [0,1,0,1,0,0|0,0,0]=2 3350 B12R1.28 CCCCNC1=CC(=O)CCC1 Amb25258387 [0,1,0,1,0,0|1,0,1]=4 3351 B12R1.28 CCCNCC1CCCC(=O)N1 Amb32721825 [0,1,0,1,0,0|1,0,0]=3 3352 B12R1.28 CCCOCC1CCNC(=O)C1 Amb32654949 [0,1,0,1,0,0|2,0,0]=4 3353 B12R1.28 CC\C=C\CC1CCCC(=O)O1 Amb25227687 [0,1,0,1,0,0|0,0,2]=4 3354 B12R1.32 C#CCC(O)CC1CCCCC1 Amb28364490 [0,1,0,1,0,0|1,0,1]=4 3355 B12R1.32 CC(CC1CCCCC1)N=C=O Amb33418829 [0,1,0,1,0,0|1,0,1]=4 3356 B12R1.32 CC(CC1CCCCC1)NC=O Amb28119882 [0,1,0,1,0,0|1,0,0]=3 3357 B12R1.32 CC(CCN)CC1CCCCC1 Amb33079790 [0,1,0,1,0,0|1,0,1]=4 3358 B12R1.32 CC(CON)CC1CCCCC1 Amb33422437 [0,1,0,1,0,0|2,0,0]=4 3359 B12R1.32 CCCC(C)CC1CCCNC1 Amb33475063 [0,1,0,1,0,0|2,0,0]=4 3360 B12R1.32 CNCC(O)CC1CCCCC1 Amb33474747 [0,1,0,1,0,0|2,0,0]=4 3361 B12R1.32 N#CCC(O)CC1CCCCC1 Amb26860909 [0,1,0,1,0,0|1,0,1]=4 3362 B12R1.32 N#CC[C@@H](O)CC1CCCCC1 Amb27981895 [0,1,0,1,0,0|1,0,1]=4 3363 B12R1.32 NC(CCO)CC1CCCCC1 Amb32946569 [0,1,0,1,0,0|0,0,2]=4 3364 B12R1.32 NCCC(F)CC1CCCCC1 Amb33223783 [0,1,0,1,0,0|1,0,1]=4 3365 B12R1.32 NCCC(O)CC1CCCCC1 Amb22643044 [0,1,0,1,0,0|1,0,1]=4 3366 B12R1.32 NCC[C@@H](O)CC1CCCCC1 Amb33422507 [0,1,0,1,0,0|1,0,1]=4 3367 B12R1.32 NCC[C@H](O)CC1CCCCC1 Amb33422506 [0,1,0,1,0,0|1,0,1]=4 3368 B12R1.51 CC(CCC1CCCC1)CON Amb33374550 [0,1,0,1,0,0|2,0,0]=4 3369 B12R1.51 CC(CCC1CCCC1)N=C=O Amb33374587 [0,1,0,1,0,0|1,0,1]=4 3370 B12R1.51 CC(CCN)CCC1CCCC1 Amb33449612 [0,1,0,1,0,0|1,0,1]=4 3371 B12R1.51 CNCC(O)CCC1CCCC1 Amb33481737 [0,1,0,1,0,0|2,0,0]=4 3372 B12R1.51 N#CCC(O)CCC1CCCC1 Amb33374532 [0,1,0,1,0,0|1,0,1]=4 3373 B12R1.51 NC(CCO)CCC1CCCC1 Amb33374919 [0,1,0,1,0,0|0,0,2]=4 3374 B12R1.51 NCCC(F)CCC1CCCC1 Amb33172225 [0,1,0,1,0,0|1,0,1]=4 3375 B12R1.51 NCCC(O)CCC1CCCC1 Amb33172573 [0,1,0,1,0,0|1,0,1]=4 3376 B12R1.51 NCC[C@@H](O)CCC1CCCC1 Amb33374556 [0,1,0,1,0,0|1,0,1]=4 3377 B12R1.51 NCC[C@H](O)CCC1CCCC1 Amb33374555 [0,1,0,1,0,0|1,0,1]=4 3378 B12R1.69 CC1CCN(CCC=O)C(C)C1 Amb18789087 [0,1,0,1,0,0|1,0,0]=3 3379 B12R1.69 CC1CCN(CCCBr)C(=O)C1 Amb28075118 [0,1,0,1,0,0|2,0,0]=4 3380 B12R1.69 CC1CCN(CCCCl)C(=O)C1 Amb28396821 [0,1,0,1,0,0|2,0,0]=4 3381 B12R1.69 CCCCN1CCC(N)CC1=O Amb26346751 [0,1,0,1,0,0|1,0,0]=3 3382 B12R1.69 CCCC[C@H]1CC[C@@H](C)CC1=O Amb27434158 [0,1,0,1,0,0|0,0,0]=2 3383 B12R1.69 CCC\C=C1\CCC(C)CC1=O Amb27433537 [0,1,0,1,0,0|0,0,2]=4 3384 B12R1.69 CCC\C=C1\CC[C@@H](C)CC1=O Amb27177906 [0,1,0,1,0,0|0,0,2]=4 3385 B12R1.69 COCCN1CCC(N)CC1=O Amb25716315 [0,1,0,1,0,0|2,0,0]=4 3386 B12R1.90 CCC1C(=O)CCCCCC1=O Amb28253731 [0,1,0,1,0,0|0,0,1]=3 3387 B12R1.141 C=C1CCCCCCCC(O)C1 Amb28345283 [0,1,0,1,0,0|1,0,0]=3 3388 B12R1.141 CC1=CC(=O)CCCCCCC1 Amb28253959 [0,1,0,1,0,0|0,0,1]=3 3389 B12R1.141 CC1CCCCCCCC(=O)N1 Amb27616243 [0,1,0,1,0,0|0,0,0]=2 3390 B12R1.141 CC1CCCCNCCC(=O)N1 Amb32657052 [0,1,0,1,0,0|1,0,0]=3 3391 B12R1.141 O=C1CCCCCCCC(=O)O1 Amb26420851 [0,1,0,1,0,0|1,0,1]=4 3392 B12R1.141 O=C1CCCCCCCC(O)C1 Amb27262870 [0,1,0,1,0,0|0,0,0]=2 3393 B12R1.141 O=C1CCCCCCOC(=O)C1 Amb27177481 [0,1,0,1,0,0|1,0,1]=4 3394 B12R1.141 OC1CCCCCCCC(O)C1 Amb27835984 [0,1,0,1,0,0|0,0,2]=4 3395 B12R1.154 CC1CCNCCC(=O)NCC1 Amb32674208 [0,1,0,1,0,0|2,0,0]=4 3396 B12R1.154 O=C1CCCC(O)CCCCO1 Amb27853898 [0,1,0,1,0,0|1,0,0]=3 3397 B12R1.154 OC1CCCCCC(O)CCC1 Amb27260254 [0,1,0,1,0,0|0,0,2]=4 3398 B12R1.170 C=CCC1CCCCCC(=O)C1 Amb28253648 [0,1,0,1,0,0|0,0,2]=4 3399 B12R1.170 C=CCC1CCCCCC(O)C1 Amb27416826 [0,1,0,1,0,0|1,0,0]=3 3400 B12R1.170 CCOC1CCCCCC(=O)C1 Amb27177931 [0,1,0,1,0,0|1,0,0]=3 3401 B12R1.170 OC1CCCCCC(\C=C\Cl)C1 Amb27231837 [0,1,0,1,0,0|1,0,1]=4 3402 B12R1.278 CCCC1CCCC(CC#N)O1 Amb27416810 [0,1,0,1,0,0|1,0,1]=4 3403 B12R1.308 C=CCC(C)C1CCCCC1O Amb28400825 [0,1,0,1,0,0|2,0,0]=4 3404 B12R1.308 C=CCC(C)[C@@H]1CCCC[C@H]1O Amb32950585 [0,1,0,1,0,0|2,0,0]=4 3405 B12R1.308 C=CCC(N)C1CCCCN1C Amb35668296 [0,1,0,1,0,0|2,0,0]=4 3406 B12R1.308 C=CCC(N)C1CCOCC1C Amb28313194 [0,1,0,1,0,0|2,0,0]=4 3407 B12R1.308 C=CCC(O)C1CCCCC1N Amb35587133 [0,1,0,1,0,0|2,0,0]=4 3408 B12R1.308 C=CCC(O)C1CCCCN1C Amb35662869 [0,1,0,1,0,0|2,0,0]=4 3409 B12R1.308 C=CCC(O)C1CCCNC1C Amb35742264 [0,1,0,1,0,0|2,0,0]=4 3410 B12R1.308 C=CCC(O)C1CCNCC1C Amb35587185 [0,1,0,1,0,0|2,0,0]=4 3411 B12R1.308 C=CCC(O)C1CNCCC1C Amb35625286 [0,1,0,1,0,0|2,0,0]=4 3412 B12R1.308 C=CC[C@@H](C)[C@H]1CCCC[C@@H]1O Amb28053730 [0,1,0,1,0,0|2,0,0]=4 3413 B12R1.308 C=CC[C@@H](C)[C@H]1CCCC[C@H]1O Amb28053729 [0,1,0,1,0,0|2,0,0]=4 3414 B12R1.308 CC(CC#N)C1CCCCC1=O Amb27177825 [0,1,0,1,0,0|1,0,1]=4 3415 B12R1.308 CC1CCCCC1C(O)CC#N Amb27483543 [0,1,0,1,0,0|1,0,1]=4 3416 B12R1.308 CC1CCCCC1C(O)CCN Amb25257640 [0,1,0,1,0,0|1,0,1]=4 3417 B12R1.308 CCCC(=O)C1CCCCC1=O Amb17940808 [0,1,0,1,0,0|0,0,1]=3 3418 B12R1.308 CCCC(=O)C1COCCC1=O Amb28188224 [0,1,0,1,0,0|1,0,1]=4 3419 B12R1.308 CCCC(C)C1CCCCC1Cl Amb27391502 [0,1,0,1,0,0|1,0,1]=4 3420 B12R1.308 CCCC(C)C1CCCCC1O Amb24358472 [0,1,0,1,0,0|0,0,2]=4 3421 B12R1.308 CCCC(C)C1CNCCC1=O Amb28139220 [0,1,0,1,0,0|1,0,0]=3 3422 B12R1.308 CCCC(C)N1CCNCC1=O Amb27860134 [0,1,0,1,0,0|2,0,0]=4 3423 B12R1.308 CCCC(C)[C@@H]1CCCC[C@H]1O Amb33213289 [0,1,0,1,0,0|0,0,2]=4 3424 B12R1.308 CCCC(N)C1CCCCC1O Amb35606671 [0,1,0,1,0,0|0,0,2]=4 3425 B12R1.308 CCCC(N)C1CCCCN1C Amb35668297 [0,1,0,1,0,0|2,0,0]=4 3426 B12R1.308 CCCC(O)C1CCCCC1=O Amb27256362 [0,1,0,1,0,0|0,0,0]=2 3427 B12R1.308 CCCC(O)C1CCCCC1N Amb35587348 [0,1,0,1,0,0|1,0,1]=4 3428 B12R1.308 CCCC(O)C1CCCCN1C Amb35662870 [0,1,0,1,0,0|2,0,0]=4 3429 B12R1.308 CCCC(O)C1SCCNC1=O Amb27254268 [0,1,0,1,0,0|2,0,0]=4 3430 B12R1.308 CCCN(C)C1CCCCC1=O Amb9661935 [0,1,0,1,0,0|1,0,0]=3 3431 B12R1.308 CCCS(=O)C1CCCCC1=O Amb27268174 [0,1,0,1,0,0|1,0,0]=3 3432 B12R1.308 CCC[C@@H](N)C1CCCCN1C Amb35598175 [0,1,0,1,0,0|2,0,0]=4 3433 B12R1.308 CCC[C@H](N)C1CCCCN1C Amb35598174 [0,1,0,1,0,0|2,0,0]=4 3434 B12R1.308 CCOC(=O)C1CCCCC1=O Amb533076 [0,1,0,1,0,0|1,0,1]=4 3435 B12R1.308 CCOC(C)C1CCCCC1=O Amb27640809 [0,1,0,1,0,0|1,0,0]=3 3436 B12R1.308 CCOC(O)C1CNCCC1=O Amb27653812 [0,1,0,1,0,0|2,0,0]=4 3437 B12R1.308 CN(CCO)C1CCCCC1=O Amb18806938 [0,1,0,1,0,0|2,0,0]=4 3438 B12R1.308 CNCC(C)N1CCCCC1=O Amb27390254 [0,1,0,1,0,0|2,0,0]=4 3439 B12R1.308 COCC(=O)C1CCCCC1=O Amb27177952 [0,1,0,1,0,0|1,0,1]=4 3440 B12R1.308 COCC(C)C1CCCNC1=O Amb27952659 [0,1,0,1,0,0|2,0,0]=4 3441 B12R1.308 COCC(O)C1CCCCC1C Amb27862003 [0,1,0,1,0,0|2,0,0]=4 3442 B12R1.308 C\C=C\C(C)C1CCCCC1=O Amb25792990 [0,1,0,1,0,0|0,0,2]=4 3443 B12R1.311 CCCN(C)CCC1CCC1=O Amb32697986 [0,1,0,1,0,0|1,0,0]=3 3444 B12R1.316 CCCC(=O)N1CCCC1C=O Amb32993469 [0,1,0,1,0,0|1,0,1]=4 3445 B12R1.318 CCCC(C)CC1CCCC1O Amb18806726 [0,1,0,1,0,0|0,0,2]=4 3446 B12R1.318 CCCC(C)C[C@@H]1CCC[C@H]1O Amb32950721 [0,1,0,1,0,0|0,0,2]=4 3447 B12R1.318 CCCC(C)\C=C1/CCCC1=O Amb28324420 [0,1,0,1,0,0|0,0,2]=4 3448 B12R1.318 CCOC(=O)CC1CCCC1=O Amb9785151 [0,1,0,1,0,0|1,0,1]=4 3449 B12R1.318 CNCC(O)CN1CCCC1=O Amb6678516 [0,1,0,1,0,0|2,0,0]=4 3450 B12R1.348 C=CCCN1CCCC(C)CC1 Amb27414388 [0,1,0,1,0,0|2,0,0]=4 3451 B12R1.348 C=CCNC1CCCC(C)CC1 Amb27251148 [0,1,0,1,0,0|2,0,0]=4 3452 B12R1.348 CN1CCCC(CCC=O)CC1 Amb28435592 [0,1,0,1,0,0|1,0,0]=3 3453 B12R1.348 O=CCCN1CCCC(O)CC1 Amb27256266 [0,1,0,1,0,0|1,0,0]=3 3454 B12R1.456 CCCCCN1CC(N)CC1=O Amb9382332 [0,1,0,1,0,0|1,0,0]=3 3455 B12R1.456 COCCCN1CC(N)CC1=O Amb8011317 [0,1,0,1,0,0|2,0,0]=4 3456 B12R1.542 CCCC1CC=CC(C)C1C=O Amb28042889 [0,1,0,1,0,0|0,0,2]=4 3457 B12R1.1028 C[C@@H]1CCCCCC(=O)C(=O)C1 Amb28202301 [0,1,0,1,0,0|1,0,1]=4 3458 B12R1.1028 O=C1OCCCC[C@H](Cl)C[C@H]1Cl Amb28130470 [0,1,0,1,0,0|2,0,0]=4 3459 B12R1.1141 C=CCC1CCCC(=O)CC1C Amb27748593 [0,1,0,1,0,0|1,0,1]=4 3460 B12R1.1141 CCCN1CCNC(C)CC1=O Amb25381324 [0,1,0,1,0,0|2,0,0]=4 3461 B12R1.1444 CCC1CN(CC=O)CCCO1 Amb27873056 [0,1,0,1,0,0|2,0,0]=4 3462 B12R1.1444 COCC1CCCCN(C=O)C1 Amb35610699 [0,1,0,1,0,0|2,0,0]=4 3463 B12R1.1444 O=CCN1CCCCC(CO)C1 Amb29854426 [0,1,0,1,0,0|2,0,0]=4 3464 B12R1.1469 C#CCC1(O)CCCCC1CC Amb28240734 [0,1,0,1,0,0|1,0,1]=4 3465 B12R1.1469 C=CCC1(O)CCCCC1C=O Amb27802613 [0,1,0,1,0,0|0,0,2]=4 3466 B12R1.1469 C=CCC1(O)CCNCC1CC Amb28054483 [0,1,0,1,0,0|2,0,0]=4 3467 B12R1.1469 C=CC[C@]1(O)CCCC[C@@H]1CO Amb27422325 [0,1,0,1,0,0|2,0,0]=4 3468 B12R1.1469 CCC1CCCCC1(O)CCN Amb25722620 [0,1,0,1,0,0|1,0,1]=4 3469 B12R1.1469 CCC1CCCCC1(O)CCO Amb27978003 [0,1,0,1,0,0|0,0,2]=4 3470 B12R1.1469 CCCC1(N)CCCCC1CC Amb27614558 [0,1,0,1,0,0|1,0,1]=4 3471 B12R1.1469 COC1COCCC1(O)CC=O Amb27212651 [0,1,0,1,0,0|2,0,0]=4 3472 B12R1.1482 C#CCC1(C)CCCCCC1=O Amb28381275 [0,1,0,1,0,0|0,0,2]=4 3473 B12R1.1482 C#CCC1(O)CCCCCC1C Amb35721267 [0,1,0,1,0,0|1,0,1]=4 3474 B12R1.1482 C=CCC1(O)CCCCCC1=O Amb28381099 [0,1,0,1,0,0|0,0,2]=4 3475 B12R1.1482 C=CCC1(O)CCCCCC1C Amb35721160 [0,1,0,1,0,0|1,0,0]=3 3476 B12R1.1482 C=CC[C@]1(F)CCCCCC1=O Amb27175918 [0,1,0,1,0,0|0,0,2]=4 3477 B12R1.1482 CC1CCCCCC1(N)CCO Amb35681118 [0,1,0,1,0,0|0,0,2]=4 3478 B12R1.1482 CC1CCCCCC1(O)CC#N Amb35681123 [0,1,0,1,0,0|1,0,1]=4 3479 B12R1.1482 CC1CCCCCC1(O)CC=O Amb35725691 [0,1,0,1,0,0|0,0,0]=2 3480 B12R1.1482 CC1CCCCCC1(O)CCN Amb32694062 [0,1,0,1,0,0|1,0,1]=4 3481 B12R1.1482 CCCC1(C)CCCCCC1=O Amb27177644 [0,1,0,1,0,0|0,0,0]=2 3482 B12R1.1482 CCCC1(O)CCCCCC1C Amb35721271 [0,1,0,1,0,0|1,0,1]=4 3483 B12R1.1482 CCC[C@]1(C)CCCCCC1=O Amb28243853 [0,1,0,1,0,0|0,0,0]=2 3484 B12R1.1482 CNCC1(O)CCCCCC1C Amb35733935 [0,1,0,1,0,0|2,0,0]=4 3485 B12R1.1482 COCC1(C)CCCCCC1=O Amb27426817 [0,1,0,1,0,0|1,0,0]=3 3486 B12R1.1482 COCC1(O)CCCCCC1C Amb35721273 [0,1,0,1,0,0|2,0,0]=4 3487 B12R1.1483 C#CCC1(N)CCCCCCC1 Amb30030529 [0,1,0,1,0,0|1,0,1]=4 3488 B12R1.1483 C=CCC1(N)CCCCCCC1 Amb27449587 [0,1,0,1,0,0|1,0,0]=3 3489 B12R1.1483 CNCC1(O)CCCCCCC1 Amb18964409 [0,1,0,1,0,0|2,0,0]=4 3490 B12R1.1483 OC1(CCBr)CCCCCCC1 Amb33097439 [0,1,0,1,0,0|1,0,1]=4 3491 B12R1.1483 OC1(CCCl)CCCCCCC1 Amb33097462 [0,1,0,1,0,0|1,0,1]=4 3492 B12R1.1564 C=CCC(N)C1CCCSCC1 Amb35615884 [0,1,0,1,0,0|2,0,0]=4 3493 B12R1.1564 C=CCC(O)C1CCCCCC1 Amb28381576 [0,1,0,1,0,0|1,0,0]=3 3494 B12R1.1564 C=CCC(O)C1CCCCCN1 Amb35582341 [0,1,0,1,0,0|2,0,0]=4 3495 B12R1.1564 C=CCC(O)C1CCCSCC1 Amb35615614 [0,1,0,1,0,0|2,0,0]=4 3496 B12R1.1564 CC(CCN)C1CCCCCC1 Amb25830292 [0,1,0,1,0,0|1,0,1]=4 3497 B12R1.1564 CC(CON)C1CCCCCC1 Amb33224816 [0,1,0,1,0,0|2,0,0]=4 3498 B12R1.1564 CC(N=C=O)C1CCCCCC1 Amb25207976 [0,1,0,1,0,0|1,0,1]=4 3499 B12R1.1564 CCCC(O)C1CCCCCC1 Amb27235430 [0,1,0,1,0,0|1,0,1]=4 3500 B12R1.1564 CCCC(O)C1CCCCCN1 Amb27257239 [0,1,0,1,0,0|1,0,1]=4 3501 B12R1.1564 CCC[C@@H](O)C1CCCCCC1 Amb27176218 [0,1,0,1,0,0|1,0,1]=4 3502 B12R1.1564 CCC[C@H](N)C1CCCCCC1 Amb27177474 [0,1,0,1,0,0|1,0,1]=4 3503 B12R1.1564 CCC[C@H](O)C1CCCCCC1 Amb27176216 [0,1,0,1,0,0|1,0,1]=4 3504 B12R1.1564 CN(CC=O)C1CCCSCC1 Amb29860765 [0,1,0,1,0,0|2,0,0]=4 3505 B12R1.1564 CNCC(N)C1CCCCCC1 Amb33229351 [0,1,0,1,0,0|2,0,0]=4 3506 B12R1.1564 CNCC(O)C1CCCCCC1 Amb25331274 [0,1,0,1,0,0|2,0,0]=4 3507 B12R1.1564 COCC(O)C1CCCCCC1 Amb28064217 [0,1,0,1,0,0|2,0,0]=4 3508 B12R1.1564 N#CCC(O)C1CCCCCC1 Amb27792521 [0,1,0,1,0,0|1,0,1]=4 3509 B12R1.1564 NC(CCF)C1CCCCCC1 Amb29870263 [0,1,0,1,0,0|1,0,1]=4 3510 B12R1.1564 NC(CCO)C1CCCCCC1 Amb24400224 [0,1,0,1,0,0|0,0,2]=4 3511 B12R1.1564 NCCC(F)C1CCCCCC1 Amb26050465 [0,1,0,1,0,0|1,0,1]=4 3512 B12R1.1564 NCCC(O)C1CCCCCC1 Amb27413195 [0,1,0,1,0,0|1,0,1]=4 3513 B12R1.1564 NCC[C@@H](O)C1CCCCCC1 Amb33267303 [0,1,0,1,0,0|1,0,1]=4 3514 B12R1.1564 NCC[C@H](O)C1CCCCCC1 Amb33267854 [0,1,0,1,0,0|1,0,1]=4 3515 B12R1.1564 [C-]#[N+]CC(F)C1CCCCCC1 Amb27872738 [0,1,0,1,0,0|2,0,0]=4 3516 B12R1.1 CC1CCC(CCCC=O)CC1 Amb33475009 [0,1,0,1,0,0|0,0,0]=2 3517 B12R1.1 CC1CCC(CCCCN)CC1 Amb33474833 [0,1,0,1,0,0|1,0,1]=4 3518 B12R1.1 CC1CCC(CCN=C=O)CC1 Amb27587411 [0,1,0,1,0,0|1,0,1]=4 3519 B12R1.1 CCCCCC1CC=C(Br)CC1 Amb22001437 [0,1,0,1,0,0|1,0,1]=4 3520 B12R1.1 CCCCCC1CCC(O)CC1 Amb16203683 [0,1,0,1,0,0|1,0,1]=4 3521 B12R1.1 CN1CCC(CCCC=O)CC1 Amb33271355 [0,1,0,1,0,0|1,0,0]=3 3522 B12R1.1 COCCC[C@H]1CC[C@H](N)CC1 Amb32413123 [0,1,0,1,0,0|2,0,0]=4 3523 B12R1.1 N#CCCCC1CCC(O)CC1 Amb18646802 [0,1,0,1,0,0|1,0,1]=4 3524 B12R1.7 CCCC#CCC1CCC(=O)O1 Amb22172847 [0,1,0,1,0,0|0,0,2]=4 3525 B12R1.7 CCCCCCC1CCC(=O)O1 Amb569753 [0,1,0,1,0,0|0,0,0]=2 3526 B12R1.25 C=CCCC1CCCC(=O)C1C Amb27828933 [0,1,0,1,0,0|1,0,1]=4 3527 B12R1.25 C=CCC[C@@H]1CCCC(=O)[C@@H]1C Amb28246581 [0,1,0,1,0,0|1,0,1]=4 3528 B12R1.25 CC#CCC1CCCC(C)C1=O Amb27256401 [0,1,0,1,0,0|0,0,2]=4 3529 B12R1.25 CC1CCCN(CCC=O)C1C Amb18789086 [0,1,0,1,0,0|1,0,0]=3 3530 B12R1.25 CCCCC1NCCN(C)C1=O Amb10607760 [0,1,0,1,0,0|2,0,0]=4 3531 B12R1.25 CCCCN1CCCC(=O)C1=O Amb27177698 [0,1,0,1,0,0|1,0,1]=4 3532 B12R1.25 CCCCN1CCCC(N)C1=O Amb28369178 [0,1,0,1,0,0|1,0,0]=3 3533 B12R1.25 CCCCN1CCNC(C)C1=O Amb27628302 [0,1,0,1,0,0|2,0,0]=4 3534 B12R1.25 CCCNC1CCCN(C)C1=O Amb28139302 [0,1,0,1,0,0|2,0,0]=4 3535 B12R1.25 CCC\C=C1/CCCC(C)C1=O Amb27750365 [0,1,0,1,0,0|0,0,2]=4 3536 B12R1.25 C[C@H]1CCC[C@H](CCC#N)C1=O Amb28141327 [0,1,0,1,0,0|1,0,1]=4 3537 B12R1.25 O=C1C(Br)CCCN1CCCO Amb28369180 [0,1,0,1,0,0|2,0,0]=4 3538 B12R1.27 CC(C=O)CCN1CCOCC1 Amb33325911 [0,1,0,1,0,0|2,0,0]=4 3539 B12R1.27 CC(CBr)CCC1CCCCC1 Amb32688337 [0,1,0,1,0,0|1,0,1]=4 3540 B12R1.27 CC(CCl)CCC1CCCCC1 Amb32688336 [0,1,0,1,0,0|1,0,1]=4 3541 B12R1.27 CC(CN)CCC1CCCCC1 Amb33743228 [0,1,0,1,0,0|1,0,1]=4 3542 B12R1.27 CC(CO)CCC1CCCCC1 Amb33727433 [0,1,0,1,0,0|0,0,2]=4 3543 B12R1.27 CCC(N)CCC1CCCCC1 Amb13951692 [0,1,0,1,0,0|1,0,1]=4 3544 B12R1.27 CCC(N)CCC1CCCCC1 Amb9031875 [0,1,0,1,0,0|1,0,1]=4 3545 B12R1.27 C[C@@H](CN)CCC1CCCCC1 Amb33731707 [0,1,0,1,0,0|1,0,1]=4 3546 B12R1.27 C[C@@H](CO)CCC1CCCCC1 Amb33740970 [0,1,0,1,0,0|0,0,2]=4 3547 B12R1.27 C[C@H](CN)CCC1CCCCC1 Amb33737020 [0,1,0,1,0,0|1,0,1]=4 3548 B12R1.27 C[C@H](CO)CCC1CCCCC1 Amb33737848 [0,1,0,1,0,0|0,0,2]=4 3549 B12R1.27 C\C(C=O)=C/CC1CCCCC1 Amb28388685 [0,1,0,1,0,0|0,0,2]=4 3550 B12R1.27 N#CC(Br)CCC1CCCCC1 Amb27433773 [0,1,0,1,0,0|1,0,1]=4 3551 B12R1.27 NC(CO)CCC1CCCCC1 Amb33475130 [0,1,0,1,0,0|0,0,2]=4 3552 B12R1.27 NCC(O)CCC1CCCCC1 Amb33475072 [0,1,0,1,0,0|1,0,1]=4 3553 B12R1.77 C#CC(O)C1CCCCC1CC Amb28073652 [0,1,0,1,0,0|1,0,1]=4 3554 B12R1.77 C=CC(O)C1CCCCC1CN Amb35586825 [0,1,0,1,0,0|2,0,0]=4 3555 B12R1.77 CC(C=O)N1CCCCC1CO Amb35640869 [0,1,0,1,0,0|2,0,0]=4 3556 B12R1.77 CC(CO)C1CCCCN1C=O Amb29854446 [0,1,0,1,0,0|2,0,0]=4 3557 B12R1.77 CCC(C)C1CCCCC1CN Amb28124604 [0,1,0,1,0,0|1,0,1]=4 3558 B12R1.77 CCC(Cl)C1CCCCC1CC Amb27165530 [0,1,0,1,0,0|1,0,1]=4 3559 B12R1.77 CCC(Cl)C1CCCCC1OC Amb27600513 [0,1,0,1,0,0|2,0,0]=4 3560 B12R1.77 CCC(O)C1CCCCC1CN Amb35586892 [0,1,0,1,0,0|1,0,1]=4 3561 B12R1.77 CCC1CCCCC1C(C)NN Amb27856584 [0,1,0,1,0,0|2,0,0]=4 3562 B12R1.77 CCC1CCCCC1C(N)C#N Amb28060436 [0,1,0,1,0,0|1,0,1]=4 3563 B12R1.77 CCC1CCCCC1C(O)C#N Amb27959996 [0,1,0,1,0,0|1,0,1]=4 3564 B12R1.77 CCC1CCCCN1C(C)C=O Amb35640833 [0,1,0,1,0,0|1,0,0]=3 3565 B12R1.77 CCC1COCCN1C(C)C=O Amb35640863 [0,1,0,1,0,0|2,0,0]=4 3566 B12R1.82 O=CC1CCCN1CC(O)CF Amb33220406 [0,1,0,1,0,0|2,0,0]=4 3567 B12R1.171 OC1CCCCC(\C=C\Cl)CC1 Amb27192164 [0,1,0,1,0,0|1,0,1]=4 3568 B12R1.206 CC1C#CCCCCC(=O)CC1 Amb27954069 [0,1,0,1,0,0|0,0,2]=4 3569 B12R1.206 CC1CCCNCCC(=O)NC1 Amb32674206 [0,1,0,1,0,0|2,0,0]=4 3570 B12R1.206 O[C@H]1CCCCCC[C@@H](O)CC1 Amb28138648 [0,1,0,1,0,0|0,0,2]=4 3571 B12R1.353 COC(=O)CCC1CCCC1=O Amb17400325 [0,1,0,1,0,0|1,0,1]=4 3572 B12R1.365 C=CC(C)C1CCCCCC1O Amb18799272 [0,1,0,1,0,0|2,0,0]=4 3573 B12R1.365 C=CC(O)C1CCCCCC1=O Amb28243961 [0,1,0,1,0,0|0,0,2]=4 3574 B12R1.365 C=CC(O)C1CCCCCC1N Amb35622451 [0,1,0,1,0,0|2,0,0]=4 3575 B12R1.365 CC(C=O)N1CCCCCC1C Amb35640823 [0,1,0,1,0,0|1,0,0]=3 3576 B12R1.365 CC(C=O)N1CCCOCC1C Amb30036944 [0,1,0,1,0,0|2,0,0]=4 3577 B12R1.365 CC(C=O)N1CCSCCC1C Amb30036821 [0,1,0,1,0,0|2,0,0]=4 3578 B12R1.365 CC(CN)C1CCCCCC1C Amb27193390 [0,1,0,1,0,0|1,0,1]=4 3579 B12R1.365 CC(CO)C1CCCCNC1=O Amb26051571 [0,1,0,1,0,0|2,0,0]=4 3580 B12R1.365 CC1CCCCCC1N(C)C=O Amb35681361 [0,1,0,1,0,0|1,0,0]=3 3581 B12R1.365 CCC(=O)C1CCCCCC1=O Amb18799098 [0,1,0,1,0,0|0,0,1]=3 3582 B12R1.365 CCC(Br)C1CCCCCC1C Amb35721311 [0,1,0,1,0,0|1,0,1]=4 3583 B12R1.365 CCC(C)C1CCCCCC1N Amb27620184 [0,1,0,1,0,0|1,0,1]=4 3584 B12R1.365 CCC(C)C1CCCCCC1O Amb27601311 [0,1,0,1,0,0|0,0,2]=4 3585 B12R1.365 CCC(C)C1CCCCNC1=N Amb27244838 [0,1,0,1,0,0|2,0,0]=4 3586 B12R1.365 CCC(C)C1NCCCNC1=O Amb32719909 [0,1,0,1,0,0|2,0,0]=4 3587 B12R1.365 CCC(C)N1CCCNCC1=O Amb26862227 [0,1,0,1,0,0|2,0,0]=4 3588 B12R1.365 CCC(C)N1CCNCCC1=O Amb25159835 [0,1,0,1,0,0|2,0,0]=4 3589 B12R1.365 CCC(C)[C@@H]1CCCCC[C@H]1O Amb32945186 [0,1,0,1,0,0|0,0,2]=4 3590 B12R1.365 CCC(Cl)C1CCCCCC1C Amb35721310 [0,1,0,1,0,0|1,0,1]=4 3591 B12R1.365 CCC(N)C1CCCCCC1C Amb35671761 [0,1,0,1,0,0|1,0,1]=4 3592 B12R1.365 CCC(N)C1CCCCCC1O Amb35593178 [0,1,0,1,0,0|0,0,2]=4 3593 B12R1.365 CCC(O)C1CCCCCC1C Amb35672757 [0,1,0,1,0,0|1,0,1]=4 3594 B12R1.365 CCC(O)C1CCCCCC1N Amb35622443 [0,1,0,1,0,0|1,0,1]=4 3595 B12R1.365 CCN(C)C1CCCCCC1=O Amb18793461 [0,1,0,1,0,0|1,0,0]=3 3596 B12R1.365 CC[C@H](C)[C@@H]1NCCCNC1=O Amb32719923 [0,1,0,1,0,0|2,0,0]=4 3597 B12R1.365 CC\C(C)=C1/CCCCCC1=O Amb27177783 [0,1,0,1,0,0|0,0,2]=4 3598 B12R1.365 CC\C(C)=C1\CCCCCC1=O Amb28381157 [0,1,0,1,0,0|0,0,2]=4 3599 B12R1.365 CNC(C)C1CCCCCC1C Amb35671762 [0,1,0,1,0,0|2,0,0]=4 3600 B12R1.365 COC(=O)C1CCCCCC1=O Amb4507049 [0,1,0,1,0,0|1,0,1]=4 3601 B12R1.371 C=C(CC)CC1CCCNC1=O Amb27648656 [0,1,0,1,0,0|1,0,1]=4 3602 B12R1.371 C=CC(O)CC1CCCCC1N Amb35584444 [0,1,0,1,0,0|2,0,0]=4 3603 B12R1.371 CC(CBr)CN1CCCCC1=O Amb27221405 [0,1,0,1,0,0|2,0,0]=4 3604 B12R1.371 CC(CO)CC1CCCCC1=O Amb27857353 [0,1,0,1,0,0|1,0,0]=3 3605 B12R1.371 CC(CO)CC1CCCNC1=O Amb26040354 [0,1,0,1,0,0|2,0,0]=4 3606 B12R1.371 CC(CO)CC1CNCCC1=O Amb28127069 [0,1,0,1,0,0|2,0,0]=4 3607 B12R1.371 CC(CS)CN1CCCCC1=O Amb27389202 [0,1,0,1,0,0|2,0,0]=4 3608 B12R1.371 CC1CCCCC1OC(=O)C=O Amb28141351 [0,1,0,1,0,0|1,0,1]=4 3609 B12R1.371 CCC(=O)CN1CCCCC1=O Amb18806133 [0,1,0,1,0,0|1,0,1]=4 3610 B12R1.371 CCC(=O)OC1CCCCC1=O Amb25298682 [0,1,0,1,0,0|1,0,1]=4 3611 B12R1.371 CCC(C)CC1CCCCC1=O Amb18806012 [0,1,0,1,0,0|0,0,0]=2 3612 B12R1.371 CCC(C)CC1CCCCC1Br Amb27848516 [0,1,0,1,0,0|1,0,1]=4 3613 B12R1.371 CCC(C)CC1CCCCC1O Amb18806722 [0,1,0,1,0,0|0,0,2]=4 3614 B12R1.371 CCC(C)CC1CNCCC1=O Amb27950657 [0,1,0,1,0,0|1,0,0]=3 3615 B12R1.371 CCC(C)C[C@@H]1CCCC[C@H]1O Amb32950717 [0,1,0,1,0,0|0,0,2]=4 3616 B12R1.371 CCC(N)CC1CCCCC1O Amb35593052 [0,1,0,1,0,0|0,0,2]=4 3617 B12R1.371 CCC(N)CC1CCCCN1C Amb27478570 [0,1,0,1,0,0|2,0,0]=4 3618 B12R1.371 CCC(N)CN1CCCCC1=O Amb18294750 [0,1,0,1,0,0|1,0,0]=3 3619 B12R1.371 CCC(N)CN1CCCNC1=O Amb27879368 [0,1,0,1,0,0|2,0,0]=4 3620 B12R1.371 CCC(N)CN1CCCOC1=O Amb27621363 [0,1,0,1,0,0|2,0,0]=4 3621 B12R1.371 CCC(O)CC1CCCCC1N Amb35584291 [0,1,0,1,0,0|1,0,1]=4 3622 B12R1.371 CCC(O)CC1CCCNC1=O Amb27985773 [0,1,0,1,0,0|1,0,0]=3 3623 B12R1.371 CC[C@H](C)C[C@@H]1NCCNC1=O Amb27627392 [0,1,0,1,0,0|2,0,0]=4 3624 B12R1.371 CNC(C)CC1CCCNC1=O Amb28430794 [0,1,0,1,0,0|2,0,0]=4 3625 B12R1.371 CNC(C)CN1CCCCC1=O Amb18982125 [0,1,0,1,0,0|2,0,0]=4 3626 B12R1.371 COC(=O)CC1CCCCC1=O Amb8388663 [0,1,0,1,0,0|1,0,1]=4 3627 B12R1.371 COC(C)CC1CCCCC1=O Amb27409479 [0,1,0,1,0,0|1,0,0]=3 3628 B12R1.371 COC(C)CC1CCCNC1=O Amb27669787 [0,1,0,1,0,0|2,0,0]=4 3629 B12R1.371 COC(C)CC1CNCCC1=O Amb27493257 [0,1,0,1,0,0|2,0,0]=4 3630 B12R1.371 COC(C)CC1COCCC1=O Amb27173409 [0,1,0,1,0,0|2,0,0]=4 3631 B12R1.371 N#CC(Cl)CC1CCCCC1=O Amb27657565 [0,1,0,1,0,0|1,0,1]=4 3632 B12R1.371 NCC(O)CN1CCCCC1=O Amb33483402 [0,1,0,1,0,0|2,0,0]=4 3633 B12R1.371 NCC(O)CN1CCCCC1=O Amb6751422 [0,1,0,1,0,0|2,0,0]=4 3634 B12R1.371 NC[C@@H](O)CN1CCCCC1=O Amb27471556 [0,1,0,1,0,0|2,0,0]=4 3635 B12R1.371 O=C(CO)CC1CCCCC1=O Amb27177763 [0,1,0,1,0,0|1,0,1]=4 3636 B12R1.371 O=C1CCCCC1CC(O)CO Amb27177778 [0,1,0,1,0,0|1,0,0]=3 3637 B12R1.371 O=C1CCCCN1CC(O)CCl Amb28341888 [0,1,0,1,0,0|2,0,0]=4 3638 B12R1.371 O=C1CCNCC1CC(O)CF Amb24551630 [0,1,0,1,0,0|2,0,0]=4 3639 B12R1.371 O=C1CCNCC1CC(O)CO Amb27172829 [0,1,0,1,0,0|2,0,0]=4 3640 B12R1.371 O=C1NCCCC1CC(O)CF Amb27437796 [0,1,0,1,0,0|2,0,0]=4 3641 B12R1.371 O=C1NCCCC1CC(O)CO Amb24495671 [0,1,0,1,0,0|2,0,0]=4 3642 B12R1.382 C=CC1CCCC(NCCC)C1 Amb33189025 [0,1,0,1,0,0|2,0,0]=4 3643 B12R1.407 COC1CCCCCCC(=O)N1 Amb28184682 [0,1,0,1,0,0|1,0,0]=3 3644 B12R1.407 C[C@@H]1CCCCCC[C@@H](CO)O1 Amb27472772 [0,1,0,1,0,0|0,0,2]=4 3645 B12R1.407 C[C@@H]1CCCCCC[C@H](C=O)O1 Amb27799682 [0,1,0,1,0,0|0,0,0]=2 3646 B12R1.477 NC(CO)CCCC1CCCC1 Amb33374566 [0,1,0,1,0,0|0,0,2]=4 3647 B12R1.477 NCC(O)CCCC1CCCC1 Amb33380251 [0,1,0,1,0,0|1,0,1]=4 3648 B12R1.527 C#CCCCC1CCC(Br)C1C Amb27859937 [0,1,0,1,0,0|1,0,1]=4 3649 B12R1.527 C#CCCCC1CCC(Cl)C1C Amb27470487 [0,1,0,1,0,0|1,0,1]=4 3650 B12R1.527 C\C=C\CCC1CCC(C)C1=O Amb24512594 [0,1,0,1,0,0|0,0,2]=4 3651 B12R1.680 CC1(C=O)CCOCCOCC1 Amb27841969 [0,1,0,1,0,0|2,0,0]=4 3652 B12R1.1026 CN1CCCCCCC(N)C1=O Amb27238850 [0,1,0,1,0,0|1,0,0]=3 3653 B12R1.1026 O=C1C(O)CCCCCCC1O Amb28199853 [0,1,0,1,0,0|1,0,0]=3 3654 B12R1.1442 CCCN1CCCNC(C)C1=O Amb27261512 [0,1,0,1,0,0|2,0,0]=4 3655 B12R1.1442 CCCN1CCNCC(C)C1=O Amb26867327 [0,1,0,1,0,0|2,0,0]=4 3656 B12R1.1442 CCOC1CCCCC(=O)C1=O Amb27177912 [0,1,0,1,0,0|1,0,1]=4 3657 B12R1.1442 COC[C@@H]1CCCC[C@@H](C)C1=O Amb27802592 [0,1,0,1,0,0|1,0,0]=3 3658 B12R1.1442 NC1CCCCN(CCO)C1=O Amb28347169 [0,1,0,1,0,0|2,0,0]=4 3659 B12R1.1659 C=C(C=O)C1CCCCCCC1 Amb27841851 [0,1,0,1,0,0|0,0,1]=3 3660 B12R1.1659 CC(C=O)N1CCCCCCC1 Amb30037076 [0,1,0,1,0,0|1,0,0]=3 3661 B12R1.1659 CC(CN)C1CCCCCCC1 Amb27798919 [0,1,0,1,0,0|1,0,1]=4 3662 B12R1.1659 CC(NN)C1CCCCCCC1 Amb27840837 [0,1,0,1,0,0|2,0,0]=4 3663 B12R1.1659 CCC(O)C1CCCCCCC1 Amb27652099 [0,1,0,1,0,0|1,0,1]=4 3664 B12R1.1659 CCN(C)C1C=CCCCCC1 Amb27428560 [0,1,0,1,0,0|2,0,0]=4 3665 B12R1.1659 CC[C@@H](O)[C@@H]1CC=CCCCC1 Amb27863820 [0,1,0,1,0,0|1,0,1]=4 3666 B12R1.1659 CC[C@H](N)C1CCCCCCC1 Amb27624321 [0,1,0,1,0,0|1,0,1]=4 3667 B12R1.1659 CC[C@H](O)C1CCCCCCC1 Amb28366505 [0,1,0,1,0,0|1,0,1]=4 3668 B12R1.1659 NCC(O)C1CCCCCCC1 Amb28458412 [0,1,0,1,0,0|1,0,1]=4 3669 B12R1.1659 O=CC(O)C1=CCCCCCC1 Amb28319768 [0,1,0,1,0,0|0,0,2]=4 3670 B12R1.1748 C=CC(=O)CC1CCCCCC1 Amb28288977 [0,1,0,1,0,0|1,0,1]=4 3671 B12R1.1748 C=CC(N)CC1CCCCCC1 Amb27587488 [0,1,0,1,0,0|1,0,0]=3 3672 B12R1.1748 C=CC(O)CC1CCCCCC1 Amb27661457 [0,1,0,1,0,0|1,0,0]=3 3673 B12R1.1748 C=CC(O)CN1CCCCCC1 Amb27778170 [0,1,0,1,0,0|2,0,0]=4 3674 B12R1.1748 CC(CBr)CC1CCCCCC1 Amb27255712 [0,1,0,1,0,0|1,0,1]=4 3675 B12R1.1748 CC(CCl)CC1CCCCCC1 Amb28122575 [0,1,0,1,0,0|1,0,1]=4 3676 B12R1.1748 CC(CN)CC1CCCCCC1 Amb24645516 [0,1,0,1,0,0|1,0,1]=4 3677 B12R1.1748 CC(CO)CC1CCCCCC1 Amb25323159 [0,1,0,1,0,0|0,0,2]=4 3678 B12R1.1748 CCC(C)CC1CCCCNC1 Amb28457729 [0,1,0,1,0,0|2,0,0]=4 3679 B12R1.1748 C[C@@H](CN)CC1CCCCCC1 Amb33728853 [0,1,0,1,0,0|1,0,1]=4 3680 B12R1.1748 C[C@@H](CO)CC1CCCCCC1 Amb33738941 [0,1,0,1,0,0|0,0,2]=4 3681 B12R1.1748 C[C@H](CN)CC1CCCCCC1 Amb33748013 [0,1,0,1,0,0|1,0,1]=4 3682 B12R1.1748 C[C@H](CO)CC1CCCCCC1 Amb33748159 [0,1,0,1,0,0|0,0,2]=4 3683 B12R1.1748 N#CC(Br)CC1CCCCCC1 Amb27440547 [0,1,0,1,0,0|1,0,1]=4 3684 B12R1.1748 N#CC(N)CC1CCCCCC1 Amb28384825 [0,1,0,1,0,0|1,0,1]=4 3685 B12R1.1748 N#CC(O)CC1CCCCCC1 Amb27984002 [0,1,0,1,0,0|1,0,1]=4 3686 B12R1.1748 NC(CO)CC1CCCCCC1 Amb27847857 [0,1,0,1,0,0|0,0,2]=4 3687 B12R1.1748 NCC(N)CC1CCCCCC1 Amb27847862 [0,1,0,1,0,0|1,0,1]=4 3688 B12R1.1748 NCC(O)CC1CCCCCC1 Amb26570451 [0,1,0,1,0,0|1,0,1]=4 3689 B12R1.1877 C#CC1(O)CCCCCC1CC Amb35721139 [0,1,0,1,0,0|1,0,1]=4 3690 B12R1.1877 C=CC1(O)CCCCCC1CC Amb35721140 [0,1,0,1,0,0|1,0,0]=3 3691 B12R1.1877 CCC1CCCCCC1(Br)C#N Amb35725717 [0,1,0,1,0,0|1,0,1]=4 3692 B12R1.1877 CCC1CCCCCC1(Cl)C#N Amb35725716 [0,1,0,1,0,0|1,0,1]=4 3693 B12R1.1877 CCC1CCCCCC1(N)C#N Amb35733872 [0,1,0,1,0,0|1,0,1]=4 3694 B12R1.1877 CCC1CCCCCC1(N)CN Amb29864912 [0,1,0,1,0,0|1,0,1]=4 3695 B12R1.1877 CCC1CCCCCC1(N)CO Amb35733863 [0,1,0,1,0,0|0,0,2]=4 3696 B12R1.1877 CCC1CCCCCC1(O)C#N Amb35725687 [0,1,0,1,0,0|1,0,1]=4 3697 B12R1.1877 CCC1CCCCCC1(O)CC Amb35721142 [0,1,0,1,0,0|1,0,1]=4 3698 B12R1.1877 CCC1CCCCCC1(O)CN Amb29865017 [0,1,0,1,0,0|1,0,1]=4 3699 B12R1.1877 CCC1CCCCCC1(O)CO Amb35659959 [0,1,0,1,0,0|0,0,2]=4 3700 B12R1.1882 CCC1CCCCCC(C=O)O1 Amb27175898 [0,1,0,1,0,0|0,0,0]=2 3701 B12R1.1882 CCC1CCCCCC(CO)O1 Amb28189493 [0,1,0,1,0,0|0,0,2]=4 3702 B12R1.1882 CC[C@@H]1CCCCC[C@@H](C=O)O1 Amb27799655 [0,1,0,1,0,0|0,0,0]=2 3703 B12R1.1882 CC[C@@H]1CCCCC[C@@H](CO)O1 Amb28321537 [0,1,0,1,0,0|0,0,2]=4 3704 B12R1.30 C=CCNC(C)C1CCCCC1 Amb9621482 [0,1,0,1,0,0|2,0,0]=4 3705 B12R1.30 CC(CCCBr)C1CCCCC1 Amb32688363 [0,1,0,1,0,0|1,0,1]=4 3706 B12R1.30 CC(CCCCl)C1CCCCC1 Amb32688362 [0,1,0,1,0,0|1,0,1]=4 3707 B12R1.30 CC(CCCN)C1CCCCC1 Amb17570138 [0,1,0,1,0,0|1,0,1]=4 3708 B12R1.30 CC(CCCO)C1CCCCC1 Amb32944828 [0,1,0,1,0,0|0,0,2]=4 3709 B12R1.30 CC(CN=C=O)C1CCCCC1 Amb28071049 [0,1,0,1,0,0|1,0,1]=4 3710 B12R1.30 CCCCC(O)C1CCCCC1 Amb4014493 [0,1,0,1,0,0|1,0,1]=4 3711 B12R1.30 C\C=C\CC(N)C1CCCCC1 Amb35592854 [0,1,0,1,0,0|1,0,1]=4 3712 B12R1.30 C\C=C\C[C@@H](O)C1CCCCC1 Amb27665269 [0,1,0,1,0,0|1,0,1]=4 3713 B12R1.30 NC(C\C=C\Cl)C1CCCCC1 Amb30029189 [0,1,0,1,0,0|1,0,1]=4 3714 B12R1.30 NCCCC(O)C1CCCCC1 Amb18198444 [0,1,0,1,0,0|1,0,1]=4 3715 B12R1.30 O=C=NCC(F)C1CCCCC1 Amb27186756 [0,1,0,1,0,0|1,0,1]=4 3716 B12R1.30 O=CCNC(=O)C1CCCCC1 Amb17102060 [0,1,0,1,0,0|1,0,1]=4 3717 B12R1.30 O=C\C=C\C(O)C1CCCCC1 Amb18647046 [0,1,0,1,0,0|0,0,2]=4 3718 B12R1.30 [C-]#[N+]CCC(F)C1CCCCC1 Amb27199813 [0,1,0,1,0,0|2,0,0]=4 3719 B12R1.53 CC(CCC=O)CC1OCCO1 Amb27827849 [0,1,0,1,0,0|2,0,0]=4 3720 B12R1.112 CCCC1CCC(Br)CC1C#N Amb32866131 [0,1,0,1,0,0|1,0,1]=4 3721 B12R1.112 CCCC1CCC(Cl)CC1C#N Amb32865909 [0,1,0,1,0,0|1,0,1]=4 3722 B12R1.112 CCCC1CCC(N)CC1CC Amb32866474 [0,1,0,1,0,0|1,0,1]=4 3723 B12R1.112 CCCC1CCC(O)CC1NC Amb32867337 [0,1,0,1,0,0|2,0,0]=4 3724 B12R1.321 C#CCCC1CCCCC(Cl)C1 Amb27780111 [0,1,0,1,0,0|1,0,1]=4 3725 B12R1.321 C=CCCC1CCCCC(=O)C1 Amb27951458 [0,1,0,1,0,0|0,0,2]=4 3726 B12R1.321 C=CCCC1CCCCC(O)C1 Amb28399953 [0,1,0,1,0,0|1,0,0]=3 3727 B12R1.321 C=CCCN1CCCCC(C)C1 Amb27665020 [0,1,0,1,0,0|2,0,0]=4 3728 B12R1.321 C=CCCN1CCCCC(F)C1 Amb27479148 [0,1,0,1,0,0|2,0,0]=4 3729 B12R1.321 CCCCC1CC(=O)NCCN1 Amb27950409 [0,1,0,1,0,0|2,0,0]=4 3730 B12R1.321 CCCCC1CCCCC(=O)N1 Amb4011804 [0,1,0,1,0,0|0,0,0]=2 3731 B12R1.321 CCCCC1CCCCC(=O)O1 Amb22230135 [0,1,0,1,0,0|0,0,0]=2 3732 B12R1.321 CCCCC1CCCCC(Br)C1 Amb27599861 [0,1,0,1,0,0|1,0,1]=4 3733 B12R1.321 CCCCC1CCCCC(Cl)C1 Amb27428526 [0,1,0,1,0,0|1,0,1]=4 3734 B12R1.321 CCCCC1CSCCC(=N)N1 Amb27233027 [0,1,0,1,0,0|2,0,0]=4 3735 B12R1.321 CCCCN1CCCNC(=O)C1 Amb25938139 [0,1,0,1,0,0|2,0,0]=4 3736 B12R1.321 CCOCC1=CC(=O)CCCC1 Amb27840683 [0,1,0,1,0,0|1,0,1]=4 3737 B12R1.321 CC\C=C\C1CCCCC(=O)N1 Amb27248259 [0,1,0,1,0,0|0,0,2]=4 3738 B12R1.321 CN1CCCCC(CCC=O)C1 Amb27965736 [0,1,0,1,0,0|1,0,0]=3 3739 B12R1.321 CSCCC1CCCCC(O)C1 Amb27621857 [0,1,0,1,0,0|2,0,0]=4 3740 B12R1.321 N#CCCC1CCCCC(=O)C1 Amb28202067 [0,1,0,1,0,0|1,0,1]=4 3741 B12R1.321 NCCCC1CCCCC(=O)N1 Amb18825523 [0,1,0,1,0,0|1,0,0]=3 3742 B12R1.321 O=C1CCCCC(CCCCl)O1 Amb27974145 [0,1,0,1,0,0|1,0,0]=3 3743 B12R1.321 O=C1CCCCC(CCCO)N1 Amb18825414 [0,1,0,1,0,0|1,0,0]=3 3744 B12R1.321 O=C1CCCCC(CCCO)O1 Amb27206114 [0,1,0,1,0,0|1,0,0]=3 3745 B12R1.374 C#CCCC1CC(Br)CCC1C Amb32866002 [0,1,0,1,0,0|1,0,1]=4 3746 B12R1.374 C#CCCC1CC(Cl)CCC1C Amb32865780 [0,1,0,1,0,0|1,0,1]=4 3747 B12R1.374 C#CCCC1CC(N)CCC1C Amb32866248 [0,1,0,1,0,0|1,0,1]=4 3748 B12R1.374 C=CCCC1CC(=O)CCC1C Amb32865286 [0,1,0,1,0,0|1,0,1]=4 3749 B12R1.374 C=CCCC1CC(N)CCC1C Amb32866266 [0,1,0,1,0,0|1,0,0]=3 3750 B12R1.374 C=CCCN1CC(C)CCC1C Amb27485546 [0,1,0,1,0,0|2,0,0]=4 3751 B12R1.374 C=CCCN1CC(N)CCC1C Amb35643288 [0,1,0,1,0,0|2,0,0]=4 3752 B12R1.374 C=CCCN1CC(O)CCC1C Amb27437718 [0,1,0,1,0,0|2,0,0]=4 3753 B12R1.374 C=CCCN1C[C@H](O)CC[C@H]1C Amb25262429 [0,1,0,1,0,0|2,0,0]=4 3754 B12R1.374 CC#CCC1CC(C)CCC1=O Amb18798358 [0,1,0,1,0,0|0,0,2]=4 3755 B12R1.374 CC1CCC(=O)C(CCCF)C1 Amb28315380 [0,1,0,1,0,0|1,0,0]=3 3756 B12R1.374 CC1CCC(=O)CC1CCC=O Amb27751281 [0,1,0,1,0,0|0,0,1]=3 3757 B12R1.374 CC1CCC(O)CN1CCC=O Amb28195672 [0,1,0,1,0,0|1,0,0]=3 3758 B12R1.374 CCCCC1=CC(O)CCC1=O Amb27164663 [0,1,0,1,0,0|0,0,2]=4 3759 B12R1.374 CCCCC1CC(C)CCC1Cl Amb27969882 [0,1,0,1,0,0|1,0,1]=4 3760 B12R1.374 CCCCC1CC(C)CCC1N Amb18801602 [0,1,0,1,0,0|1,0,1]=4 3761 B12R1.374 CCCCC1CC(N)CCC1C Amb32866224 [0,1,0,1,0,0|1,0,1]=4 3762 B12R1.374 CCCCC1CN(C)CCC1=O Amb27226956 [0,1,0,1,0,0|1,0,0]=3 3763 B12R1.374 CCCCN1CC(=O)CCC1=O Amb25997716 [0,1,0,1,0,0|1,0,1]=4 3764 B12R1.374 CCCCN1CC(C)NCC1=O Amb28254644 [0,1,0,1,0,0|2,0,0]=4 3765 B12R1.374 CCCCN1CC(N)CCC1=O Amb26640890 [0,1,0,1,0,0|1,0,0]=3 3766 B12R1.374 CCCCN1CC(N)CNC1=O Amb25088551 [0,1,0,1,0,0|2,0,0]=4 3767 B12R1.374 CCCCN1CC(O)CNC1=O Amb26489055 [0,1,0,1,0,0|2,0,0]=4 3768 B12R1.374 COCCN1CC(N)CCC1=O Amb24702737 [0,1,0,1,0,0|2,0,0]=4 3769 B12R1.374 C[C@@H]1CC[C@@H](O)CN1CCC=O Amb30011469 [0,1,0,1,0,0|1,0,0]=3 3770 B12R1.374 C\C=C\CC1CC(C)CCC1=O Amb27881693 [0,1,0,1,0,0|0,0,2]=4 3771 B12R1.460 C#CCCC(N)C1CCCC1C Amb28289188 [0,1,0,1,0,0|1,0,1]=4 3772 B12R1.460 CCCC\C(C)=C1/CCCC1=O Amb28202040 [0,1,0,1,0,0|0,0,2]=4 3773 B12R1.460 CCCC\C(N)=C1/CCCC1=O Amb27432668 [0,1,0,1,0,0|0,0,2]=4 3774 B12R1.460 COCCC(=O)C1CCCC1=O Amb18801757 [0,1,0,1,0,0|1,0,1]=4 3775 B12R1.567 CCC#CCC1C(=O)CCC1C Amb27861242 [0,1,0,1,0,0|0,0,2]=4 3776 B12R1.567 CCC#CC[C@@H]1C(=O)CC[C@@H]1C Amb27253599 [0,1,0,1,0,0|0,0,2]=4 3777 B12R1.567 CCCCCC1=C(C)CCC1=O Amb4494843 [0,1,0,1,0,0|0,0,2]=4 3778 B12R1.567 CCCCCC1C(=O)CCC1=O Amb17594210 [0,1,0,1,0,0|0,0,1]=3 3779 B12R1.1007 CC1CCCCC(=O)CCCC1 Amb27177486 [0,1,0,1,0,0|0,0,0]=2 3780 B12R1.1007 CN1CCCCC(O)CCCC1 Amb27970833 [0,1,0,1,0,0|2,0,0]=4 3781 B12R1.1007 NC1CCCCC(N)CCCC1 Amb21948265 [0,1,0,1,0,0|1,0,1]=4 3782 B12R1.1007 N[C@H]1CCCC[C@@H](N)CCCC1 Amb17778672 [0,1,0,1,0,0|1,0,1]=4 3783 B12R1.1007 N[C@H]1CCCC[C@@H](N)CCCC1 Amb27425345 [0,1,0,1,0,0|1,0,1]=4 3784 B12R1.1007 O=C1CC=CCC(Cl)CCCC1 Amb27875110 [0,1,0,1,0,0|0,0,2]=4 3785 B12R1.1007 O=C1CCCCC(=O)OCCC1 Amb17594258 [0,1,0,1,0,0|1,0,1]=4 3786 B12R1.1007 O=C1CCCCC(O)CCCC1 Amb4020519 [0,1,0,1,0,0|0,0,0]=2 3787 B12R1.1007 O=C1CCCCC(O)CCCO1 Amb27443581 [0,1,0,1,0,0|1,0,0]=3 3788 B12R1.1007 O[C@H]1CCCC[C@@H](O)CCCC1 Amb28322085 [0,1,0,1,0,0|0,0,2]=4 3789 B12R1.1112 C=CCC1C(=O)CCCC1CC Amb27227076 [0,1,0,1,0,0|1,0,1]=4 3790 B12R1.1112 CC1CCCN(C=O)C1CCO Amb35712885 [0,1,0,1,0,0|2,0,0]=4 3791 B12R1.1120 CCCN1C(=O)CCNCC1C Amb24704353 [0,1,0,1,0,0|2,0,0]=4 3792 B12R1.1120 CCCN1C(=O)CNCCC1C Amb27632751 [0,1,0,1,0,0|2,0,0]=4 3793 B12R1.1439 C\C=C\C1C(C)CCC1CC=O Amb27176085 [0,1,0,1,0,0|0,0,2]=4 3794 B12R1.1452 CCCN1CCC(C)NCC1=O Amb25127707 [0,1,0,1,0,0|2,0,0]=4 3795 B12R1.1778 C#CCCC1(N)CCCCC1C Amb35658027 [0,1,0,1,0,0|1,0,1]=4 3796 B12R1.1778 C=C1CCCC[C@@]1(C)CCCO Amb27829955 [0,1,0,1,0,0|2,0,0]=4 3797 B12R1.1778 C=CCCC1(N)CCCCC1C Amb35615133 [0,1,0,1,0,0|1,0,0]=3 3798 B12R1.1778 C=CCCC1(O)CCCCC1=O Amb27177564 [0,1,0,1,0,0|0,0,2]=4 3799 B12R1.1778 C=CCCC1(O)CCCSC1C Amb27858812 [0,1,0,1,0,0|2,0,0]=4 3800 B12R1.1778 C=CCCC1(O)CCOCC1C Amb27659269 [0,1,0,1,0,0|2,0,0]=4 3801 B12R1.1778 C=CCNC1(C)CCCCC1C Amb27477204 [0,1,0,1,0,0|2,0,0]=4 3802 B12R1.1778 CC1(CCC=O)CCCCC1O Amb27268397 [0,1,0,1,0,0|1,0,0]=3 3803 B12R1.1778 CC1CCCCC1(N)CCCO Amb35626967 [0,1,0,1,0,0|0,0,2]=4 3804 B12R1.1778 CC1CCCCC1(N)C\C=C\Cl Amb35657883 [0,1,0,1,0,0|1,0,1]=4 3805 B12R1.1778 CC1CCCCC1(O)CCC=O Amb28127912 [0,1,0,1,0,0|0,0,0]=2 3806 B12R1.1778 CC1COCCC1(O)CCC=O Amb27256842 [0,1,0,1,0,0|1,0,0]=3 3807 B12R1.1778 CCCCC1(C)CCCCC1=O Amb17594223 [0,1,0,1,0,0|0,0,0]=2 3808 B12R1.1778 CCCCC1(C)CCCNC1=O Amb33070948 [0,1,0,1,0,0|1,0,0]=3 3809 B12R1.1778 CCCCC1(C)NCCNC1=O Amb27455235 [0,1,0,1,0,0|2,0,0]=4 3810 B12R1.1778 CCCCC1(F)CCCCC1=O Amb27802600 [0,1,0,1,0,0|0,0,0]=2 3811 B12R1.1778 CCCCC1(O)CCCCC1Cl Amb27646324 [0,1,0,1,0,0|1,0,1]=4 3812 B12R1.1778 CCCCC1(O)CCCCC1O Amb27662438 [0,1,0,1,0,0|0,0,2]=4 3813 B12R1.1778 CCCC[C@@]1(O)CCCC[C@@H]1O Amb28455586 [0,1,0,1,0,0|0,0,2]=4 3814 B12R1.1778 CCCC[C@]1(N)CCCC[C@@H]1C Amb27204820 [0,1,0,1,0,0|1,0,1]=4 3815 B12R1.1778 CCCC[C@]1(N)CCCC[C@H]1C Amb27640591 [0,1,0,1,0,0|1,0,1]=4 3816 B12R1.1778 CCCC[C@]1(O)CCCC[C@@H]1N Amb27878677 [0,1,0,1,0,0|1,0,1]=4 3817 B12R1.1778 CCCC[C@]1(O)CCCC[C@H]1O Amb27432150 [0,1,0,1,0,0|0,0,2]=4 3818 B12R1.1778 C[C@@H]1CCCC[C@@]1(O)CCCO Amb27448875 [0,1,0,1,0,0|0,0,2]=4 3819 B12R1.1778 C[C@H]1CCCC[C@]1(O)CCCO Amb27803889 [0,1,0,1,0,0|0,0,2]=4 3820 B12R1.1778 C\C=C\CC1(C)CCCCC1=O Amb27954167 [0,1,0,1,0,0|0,0,2]=4 3821 B12R1.1778 C\C=C\CC1(N)CCCCC1C Amb35643042 [0,1,0,1,0,0|1,0,1]=4 3822 B12R1.1778 C\C=C\C[C@@]1(C)CCCCC1=O Amb28200005 [0,1,0,1,0,0|0,0,2]=4 3823 B12R1.1778 N#CCCC1(F)CCCCC1=O Amb24432239 [0,1,0,1,0,0|1,0,1]=4 3824 B12R1.1785 C#CCCC1(N)CCCCCC1 Amb35658029 [0,1,0,1,0,0|1,0,1]=4 3825 B12R1.1785 C=CCCC1(N)CCCCCC1 Amb35615123 [0,1,0,1,0,0|1,0,0]=3 3826 B12R1.1785 C=CCCC1(O)CCCOCC1 Amb27484162 [0,1,0,1,0,0|2,0,0]=4 3827 B12R1.1785 C=CCCC1(O)CCCSCC1 Amb29860600 [0,1,0,1,0,0|2,0,0]=4 3828 B12R1.1785 C=CCNC1(C)CCCCCC1 Amb28365829 [0,1,0,1,0,0|2,0,0]=4 3829 B12R1.1785 CC1(CCCN)CCCCCC1 Amb27491355 [0,1,0,1,0,0|1,0,1]=4 3830 B12R1.1785 CCCCC1(N)CCCCCC1 Amb18801631 [0,1,0,1,0,0|1,0,1]=4 3831 B12R1.1785 CCCCC1(O)CCCCCC1 Amb10606493 [0,1,0,1,0,0|1,0,1]=4 3832 B12R1.1785 C\C=C\CC1(N)CCCCCC1 Amb35643033 [0,1,0,1,0,0|1,0,1]=4 3833 B12R1.1785 NC1(CCCO)CCCCCC1 Amb30030799 [0,1,0,1,0,0|0,0,2]=4 3834 B12R1.1785 NC1(C\C=C\Cl)CCCCCC1 Amb35657878 [0,1,0,1,0,0|1,0,1]=4 3835 B12R1.1785 O=CCCC1(O)COCCOC1 Amb28127875 [0,1,0,1,0,0|2,0,0]=4 3836 B12R1.1785 O=CNCC1(O)CCCCCC1 Amb27616935 [0,1,0,1,0,0|1,0,0]=3 3837 B12R1.1787 C#CCCC1(O)CCCC1CC Amb28313327 [0,1,0,1,0,0|1,0,1]=4 3838 B12R1.1890 CCC1CN(C)CCCN1C=O Amb27972268 [0,1,0,1,0,0|2,0,0]=4 3839 B12R1.1929 COC1CC(=O)CCCCC1=O Amb28461166 [0,1,0,1,0,0|1,0,1]=4 3840 B12R1.268 C#CCC1CC(Br)CCC1CC Amb32866108 [0,1,0,1,0,0|1,0,1]=4 3841 B12R1.268 C#CCC1CC(Cl)CCC1CC Amb32865891 [0,1,0,1,0,0|1,0,1]=4 3842 B12R1.268 C#CCC1CC(N)CCC1CC Amb32866406 [0,1,0,1,0,0|1,0,1]=4 3843 B12R1.268 C=CCC1CC(=O)CCC1CC Amb32865454 [0,1,0,1,0,0|1,0,1]=4 3844 B12R1.268 C=CCC1CC(N)CCC1CC Amb32866376 [0,1,0,1,0,0|1,0,0]=3 3845 B12R1.268 CCC1CCC(Br)CC1COC Amb32866095 [0,1,0,1,0,0|2,0,0]=4 3846 B12R1.268 CCC1CCC(Cl)CC1COC Amb32865875 [0,1,0,1,0,0|2,0,0]=4 3847 B12R1.268 CCC1CCC(N)CC1COC Amb32866388 [0,1,0,1,0,0|2,0,0]=4 3848 B12R1.268 CCCC1CC(C)CCC1CN Amb28245719 [0,1,0,1,0,0|1,0,1]=4 3849 B12R1.268 CCCC1CC(N)CCC1CC Amb32866380 [0,1,0,1,0,0|1,0,1]=4 3850 B12R1.1098 C=CCN1CC(C)CCCC1C Amb28070282 [0,1,0,1,0,0|2,0,0]=4 3851 B12R1.1098 C=CC[C@@H]1CC(=O)CCC[C@H]1C Amb28198595 [0,1,0,1,0,0|1,0,1]=4 3852 B12R1.1098 CCCN1CC(C)CNCC1=O Amb26883734 [0,1,0,1,0,0|2,0,0]=4 3853 B12R1.1098 CCCN1CC(C)NCCC1=O Amb27808586 [0,1,0,1,0,0|2,0,0]=4 3854 B12R1.1631 C=CCCC1C(O)CCCC1O Amb27972471 [0,1,0,1,0,0|2,0,0]=4 3855 B12R1.1631 C=CCCN1C(C)CCCC1C Amb27756998 [0,1,0,1,0,0|2,0,0]=4 3856 B12R1.1631 C=CCCN1[C@H](C)CCC[C@H]1C Amb27188238 [0,1,0,1,0,0|2,0,0]=4 3857 B12R1.1631 C=CCC[C@H]1C(=O)CCC[C@H]1C Amb28052478 [0,1,0,1,0,0|0,0,2]=4 3858 B12R1.1631 CCCCC1C(=O)C=CCC1C Amb27177503 [0,1,0,1,0,0|0,0,2]=4 3859 B12R1.1631 CCCCC1C(=O)C=CC[C@@H]1C Amb28322033 [0,1,0,1,0,0|0,0,2]=4 3860 B12R1.1631 CCCCC1C(=O)C=CC[C@H]1C Amb27175976 [0,1,0,1,0,0|0,0,2]=4 3861 B12R1.1631 CCCCC1C(=O)CCCC1=O Amb26413895 [0,1,0,1,0,0|0,0,1]=3 3862 B12R1.1631 CCCCC1C(=O)CCC[C@@H]1C Amb27616853 [0,1,0,1,0,0|0,0,0]=2 3863 B12R1.1631 CCCCN1C(=O)CCCC1=O Amb27178390 [0,1,0,1,0,0|1,0,1]=4 3864 B12R1.1631 CCCCN1C(=O)CCCC1O Amb27588897 [0,1,0,1,0,0|1,0,0]=3 3865 B12R1.1631 CCCCN1C(=O)CNCC1C Amb25064610 [0,1,0,1,0,0|2,0,0]=4 3866 B12R1.1631 CCCC[C@@H]1C(=O)CCC[C@@H]1C Amb27844215 [0,1,0,1,0,0|0,0,0]=2 3867 B12R1.1900 CC1=CCCC(C)C(C=O)CC1 Amb28201056 [0,1,0,1,0,0|0,0,2]=4 3868 B12R1.1900 CC1CCCC(C)C(C=O)CC1 Amb27614689 [0,1,0,1,0,0|0,0,0]=2 3869 B12R1.1997 C#CCCCC1(N)CCCCC1 Amb35686414 [0,1,0,1,0,0|1,0,1]=4 3870 B12R1.1997 CC1(CCCC=O)CCCCC1 Amb33417931 [0,1,0,1,0,0|0,0,0]=2 3871 B12R1.1997 CC1(CCCC=O)CCOCC1 Amb33415591 [0,1,0,1,0,0|1,0,0]=3 3872 B12R1.1997 CC1(CCCCN)CCCCC1 Amb33417935 [0,1,0,1,0,0|1,0,1]=4 3873 B12R1.1997 CC1(CCN=C=O)CCCCC1 Amb33320636 [0,1,0,1,0,0|1,0,1]=4 3874 B12R1.1997 CCCCCC1(O)CCCNC1 Amb33360992 [0,1,0,1,0,0|2,0,0]=4 3875 B12R1.1997 O=CNCCC1(O)CCCCC1 Amb35704714 [0,1,0,1,0,0|1,0,0]=3 3876 B12R1.3204 C#CCCCC1(N)CCCC1C Amb35657750 [0,1,0,1,0,0|1,0,1]=4 3877 B12R1.3204 C#CCCCC1(O)CCCC1=O Amb27176128 [0,1,0,1,0,0|0,0,2]=4 3878 B12R1.3204 C#CCCCC1(O)CCCC1C Amb27654699 [0,1,0,1,0,0|1,0,1]=4 3879 B12R1.75 C=C(C)CC1CCCCC1CN Amb27468140 [0,1,0,1,0,0|2,0,0]=4 3880 B12R1.75 CC(=O)CN1CCCCC1CO Amb18806940 [0,1,0,1,0,0|2,0,0]=4 3881 B12R1.75 CC(=O)C[C@H]1CCCC[C@H]1C=O Amb28429561 [0,1,0,1,0,0|0,0,1]=3 3882 B12R1.75 CC(=O)NC1CCCCC1C=O Amb28120088 [0,1,0,1,0,0|1,0,1]=4 3883 B12R1.75 CC(=O)NC1CCCCC1CN Amb27257787 [0,1,0,1,0,0|2,0,0]=4 3884 B12R1.75 CC(=O)NC1CCCCC1CO Amb27868462 [0,1,0,1,0,0|2,0,0]=4 3885 B12R1.75 CC(=O)N[C@@H]1CCCC[C@H]1C=O Amb27776856 [0,1,0,1,0,0|1,0,1]=4 3886 B12R1.75 CC(=O)N[C@H]1CCCC[C@H]1CO Amb28428478 [0,1,0,1,0,0|2,0,0]=4 3887 B12R1.75 CC(=O)OC1CCCCC1C=O Amb18647323 [0,1,0,1,0,0|1,0,1]=4 3888 B12R1.75 CC(=O)O[C@H]1CCCC[C@@H]1CO Amb27420620 [0,1,0,1,0,0|2,0,0]=4 3889 B12R1.75 CC(C)CC1CCCCC1CN Amb28046613 [0,1,0,1,0,0|1,0,1]=4 3890 B12R1.75 CCC1CCCCC1CC(=O)O Amb25152261 [0,1,0,1,0,0|0,0,0]=2 3891 B12R1.75 CCC1CCCCC1CC(C)=O Amb27495385 [0,1,0,1,0,0|0,0,0]=2 3892 B12R1.75 CCC1CCCCC1NC(=O)Cl Amb35625776 [0,1,0,1,0,0|1,0,0]=3 3893 B12R1.75 CCC1CCCCC1NC(N)=S Amb19058801 [0,1,0,1,0,0|1,1,0]=4 3894 B12R1.75 CCC1CCCCC1OC(=O)Cl Amb27181224 [0,1,0,1,0,0|1,0,0]=3 3895 B12R1.75 CCC1CCCCC1OC(C)=O Amb27766398 [0,1,0,1,0,0|1,0,0]=3 3896 B12R1.75 CCC1CCCCN1CC(=O)Cl Amb17143064 [0,1,0,1,0,0|1,0,0]=3 3897 B12R1.75 CCC1CCCCN1CC(=O)O Amb5380767 [0,1,0,1,0,0|1,0,0]=3 3898 B12R1.75 CCC1CCCCN1CC(N)=O Amb17142913 [0,1,0,1,0,0|1,0,0]=3 3899 B12R1.75 CCC1CCCCN1CC(N)=S Amb8894001 [0,1,0,1,0,0|1,1,0]=4 3900 B12R1.75 CCC1CCCCN1C[N+](=O)[O-] Amb28138233 [0,1,0,1,0,0|2,0,0]=4 3901 B12R1.75 CCC1CCCC\C1=C\C(=O)O Amb33468654 [0,1,0,1,0,0|0,0,2]=4 3902 B12R1.75 CCC1CCNCC1NC(C)=O Amb32677496 [0,1,0,1,0,0|2,0,0]=4 3903 B12R1.75 CCC1COCCN1CC(N)=O Amb18802914 [0,1,0,1,0,0|2,0,0]=4 3904 B12R1.75 CCN1CCOCC1CC(=O)O Amb27814474 [0,1,0,1,0,0|2,0,0]=4 3905 B12R1.75 CCN1CCOCC1CC(=O)O Amb33330660 [0,1,0,1,0,0|2,0,0]=4 3906 B12R1.75 CCN1CCSCC1CC(=O)O Amb27952352 [0,1,0,1,0,0|2,0,0]=4 3907 B12R1.75 CC[C@@H]1NCCC[C@H]1CC(=O)O Amb18198537 [0,1,0,1,0,0|1,0,0]=3 3908 B12R1.75 CC[C@H]1CNCC[C@H]1CC(=O)Cl Amb28291338 [0,1,0,1,0,0|1,0,0]=3 3909 B12R1.75 CC[C@H]1NCCC[C@@H]1CC(=O)O Amb27654051 [0,1,0,1,0,0|1,0,0]=3 3910 B12R1.75 CN(C)CC1CCCCN1C=O Amb35682774 [0,1,0,1,0,0|2,0,0]=4 3911 B12R1.75 CNC1CCCCC1CC(C)C Amb18789147 [0,1,0,1,0,0|2,0,0]=4 3912 B12R1.75 COC1CCCCC1CC(C)N Amb27488134 [0,1,0,1,0,0|2,0,0]=4 3913 B12R1.75 COC1CCCCC1NC(N)=O Amb27211770 [0,1,0,1,0,0|2,0,0]=4 3914 B12R1.75 COC1CCCNC1CC(C)=O Amb18647523 [0,1,0,1,0,0|2,0,0]=4 3915 B12R1.75 COC1CCOCC1CC(=O)O Amb18197607 [0,1,0,1,0,0|2,0,0]=4 3916 B12R1.75 COC1CCSCC1CC(=O)O Amb18190928 [0,1,0,1,0,0|2,0,0]=4 3917 B12R1.75 COC1COCCC1CC(=O)O Amb18197629 [0,1,0,1,0,0|2,0,0]=4 3918 B12R1.75 COC1CSCCC1CC(=O)O Amb18189240 [0,1,0,1,0,0|2,0,0]=4 3919 B12R1.75 COC1OCCCC1CC(=O)O Amb18197635 [0,1,0,1,0,0|2,0,0]=4 3920 B12R1.75 CO[C@@H]1CCCC[C@@H]1NC(C)=O Amb28074111 [0,1,0,1,0,0|2,0,0]=4 3921 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)=O Amb27956180 [0,1,0,1,0,0|2,0,0]=4 3922 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(N)=O Amb28349618 [0,1,0,1,0,0|2,0,0]=4 3923 B12R1.75 CSC1CCCCC1NC(=O)Cl Amb35633414 [0,1,0,1,0,0|2,0,0]=4 3924 B12R1.75 CSC1CCCCC1NC(C)=O Amb28067814 [0,1,0,1,0,0|2,0,0]=4 3925 B12R1.75 C\C=C1/CCCCC1CC(C)O Amb27212804 [0,1,0,1,0,0|1,0,1]=4 3926 B12R1.75 N#CC1CCCCC1CC(=O)O Amb18827227 [0,1,0,1,0,0|1,0,1]=4 3927 B12R1.75 NC(=O)N[C@@H]1CCCC[C@H]1CO Amb27163786 [0,1,0,1,0,0|2,0,0]=4 3928 B12R1.75 NCC1CCCCC1CC(=O)O Amb10843836 [0,1,0,1,0,0|1,0,0]=3 3929 B12R1.75 NCC1CCCCC1NC(N)=O Amb27208284 [0,1,0,1,0,0|2,0,0]=4 3930 B12R1.75 NCC1CCCCC1OC(N)=O Amb28195875 [0,1,0,1,0,0|2,0,0]=4 3931 B12R1.75 NCC1CCCCN1CC(=O)O Amb18982971 [0,1,0,1,0,0|2,0,0]=4 3932 B12R1.75 NCC1CCCCN1CC(N)=O Amb6673910 [0,1,0,1,0,0|2,0,0]=4 3933 B12R1.75 NNC1CCCCC1CC(=O)O Amb27960868 [0,1,0,1,0,0|2,0,0]=4 3934 B12R1.75 NN[C@H]1CCCC[C@H]1CC(=O)O Amb27789570 [0,1,0,1,0,0|2,0,0]=4 3935 B12R1.75 O=C(O)CC1CCCCC1CO Amb27392264 [0,1,0,1,0,0|1,0,0]=3 3936 B12R1.75 O=C(O)CN1CCCCC1CO Amb18294605 [0,1,0,1,0,0|2,0,0]=4 3937 B12R1.81 CC(=O)NCC1CCCC1CBr Amb27178312 [0,1,0,1,0,0|2,0,0]=4 3938 B12R1.81 CCC1OCCC1CNC(=O)Cl Amb35633570 [0,1,0,1,0,0|2,0,0]=4 3939 B12R1.81 CCN1CCCC1CNC(=O)Cl Amb35614612 [0,1,0,1,0,0|2,0,0]=4 3940 B12R1.81 CCN1CCCC1CNC(N)=O Amb9708648 [0,1,0,1,0,0|2,0,0]=4 3941 B12R1.81 COC1CCCC1NCC(=O)O Amb18807777 [0,1,0,1,0,0|2,0,0]=4 3942 B12R1.81 COC1CCCC1NCC(N)=O Amb18807414 [0,1,0,1,0,0|2,0,0]=4 3943 B12R1.81 NC[C@@H]1CCCN1CCC(=O)O Amb33218395 [0,1,0,1,0,0|2,0,0]=4 3944 B12R1.81 NC[C@H]1CCCN1CCC(=O)O Amb33218388 [0,1,0,1,0,0|2,0,0]=4 3945 B12R1.125 C=C(C)CCC1CCCCC1=O Amb28381254 [0,1,0,1,0,0|0,0,1]=3 3946 B12R1.125 C=C(C)CCC1CCCCC1N Amb27979472 [0,1,0,1,0,0|2,0,0]=4 3947 B12R1.125 C=C(C)CCC1CCCCC1O Amb28062579 [0,1,0,1,0,0|2,0,0]=4 3948 B12R1.125 C=C(C)CC[C@@H]1CCCC[C@H]1O Amb32950339 [0,1,0,1,0,0|2,0,0]=4 3949 B12R1.125 C=C(C)CNC1CCCCC1C Amb17309025 [0,1,0,1,0,0|2,0,0]=4 3950 B12R1.125 C=C1CCCCC1CCC(C)=O Amb27861159 [0,1,0,1,0,0|0,0,2]=4 3951 B12R1.125 C=C1CCCCC1CCC(N)=O Amb28054855 [0,1,0,1,0,0|0,0,2]=4 3952 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [0,1,0,1,0,0|1,0,0]=3 3953 B12R1.125 CC(=O)CCC1CCCNC1=O Amb18826001 [0,1,0,1,0,0|1,0,1]=4 3954 B12R1.125 CC(=O)CCC1OCCCC1O Amb28322044 [0,1,0,1,0,0|2,0,0]=4 3955 B12R1.125 CC(=O)CCN1CCCCC1C Amb7755660 [0,1,0,1,0,0|1,0,0]=3 3956 B12R1.125 CC(=O)CC[C@@H]1CCCCC1=O Amb28202304 [0,1,0,1,0,0|0,0,1]=3 3957 B12R1.125 CC(=O)NCC1CCCCC1N Amb27190710 [0,1,0,1,0,0|2,0,0]=4 3958 B12R1.125 CC(=O)NCC1CCCCC1O Amb27760777 [0,1,0,1,0,0|2,0,0]=4 3959 B12R1.125 CC(=O)NCC1CCCCN1C Amb28201206 [0,1,0,1,0,0|2,0,0]=4 3960 B12R1.125 CC(=O)NCC1CCNCC1C Amb26626243 [0,1,0,1,0,0|2,0,0]=4 3961 B12R1.125 CC(=O)NC[C@H]1CCCC[C@@H]1O Amb27790347 [0,1,0,1,0,0|2,0,0]=4 3962 B12R1.125 CC(=O)NC[C@H]1CCCC[C@H]1O Amb27208254 [0,1,0,1,0,0|2,0,0]=4 3963 B12R1.125 CC(C)=CC[C@@H]1CCCCC1=O Amb27177567 [0,1,0,1,0,0|0,0,2]=4 3964 B12R1.125 CC(C)CCC1CCCCC1=O Amb18788897 [0,1,0,1,0,0|0,0,0]=2 3965 B12R1.125 CC(C)CCC1CCCCC1N Amb18789156 [0,1,0,1,0,0|1,0,1]=4 3966 B12R1.125 CC(C)CCC1CCCCC1O Amb534147 [0,1,0,1,0,0|0,0,2]=4 3967 B12R1.125 CC(C)CCC1CCCCN1C Amb27979230 [0,1,0,1,0,0|2,0,0]=4 3968 B12R1.125 CC(C)CCC1CNCCC1=O Amb18825864 [0,1,0,1,0,0|1,0,0]=3 3969 B12R1.125 CC(C)CC[C@@H]1CCCC[C@H]1O Amb33213636 [0,1,0,1,0,0|0,0,2]=4 3970 B12R1.125 CC(C)CNC1CCCNC1=O Amb18295099 [0,1,0,1,0,0|2,0,0]=4 3971 B12R1.125 CC(C)C\C=C1/CCCCC1=O Amb21922314 [0,1,0,1,0,0|0,0,2]=4 3972 B12R1.125 CC(C)C\C=C1\CCCCC1=O Amb3361279 [0,1,0,1,0,0|0,0,2]=4 3973 B12R1.125 CC(C)NCC1CCCCC1=O Amb27624461 [0,1,0,1,0,0|1,0,0]=3 3974 B12R1.125 CC(C)OCC1CCCCC1=O Amb27648541 [0,1,0,1,0,0|1,0,0]=3 3975 B12R1.125 CC(N)CCC1CCCCC1F Amb27813403 [0,1,0,1,0,0|1,0,1]=4 3976 B12R1.125 CC(N)CCC1CCCCN1C Amb33323192 [0,1,0,1,0,0|2,0,0]=4 3977 B12R1.125 CC(O)CCC1CCCCC1C Amb27874287 [0,1,0,1,0,0|0,0,2]=4 3978 B12R1.125 CC(O)CCC1CCCCN1C Amb33323191 [0,1,0,1,0,0|2,0,0]=4 3979 B12R1.125 CC(O)CCC1CCCNC1=O Amb27628873 [0,1,0,1,0,0|1,0,0]=3 3980 B12R1.125 CC(O)CCC1CNCCC1=O Amb27787980 [0,1,0,1,0,0|1,0,0]=3 3981 B12R1.125 CC(O)CCC1COCCC1=O Amb28197074 [0,1,0,1,0,0|1,0,0]=3 3982 B12R1.125 CC(O)CCN1CCCCC1=O Amb18806915 [0,1,0,1,0,0|1,0,0]=3 3983 B12R1.125 CC(O)CCN1CCCNC1=O Amb27842081 [0,1,0,1,0,0|2,0,0]=4 3984 B12R1.125 CC(O)CCN1CCOCC1=O Amb27616837 [0,1,0,1,0,0|2,0,0]=4 3985 B12R1.125 CC1CCCCC1CNC(=O)Cl Amb35625849 [0,1,0,1,0,0|1,0,0]=3 3986 B12R1.125 CC1CCCCC1OCC(=O)O Amb9726703 [0,1,0,1,0,0|1,0,0]=3 3987 B12R1.125 CC1CCCCC1OCC(N)=O Amb18802286 [0,1,0,1,0,0|1,0,0]=3 3988 B12R1.125 CC1CCCCN1CCC(=N)N Amb6275610 [0,1,0,1,0,0|2,0,0]=4 3989 B12R1.125 CC1CCCCN1CCC(=O)Cl Amb17143073 [0,1,0,1,0,0|1,0,0]=3 3990 B12R1.125 CC1CCCCN1CCC(=O)O Amb21953915 [0,1,0,1,0,0|1,0,0]=3 3991 B12R1.125 CC1CCCCN1CCC(=O)O Amb2693037 [0,1,0,1,0,0|1,0,0]=3 3992 B12R1.125 CC1CCCCN1CCC(N)=O Amb17142919 [0,1,0,1,0,0|1,0,0]=3 3993 B12R1.125 CC1CCCCN1CCC(N)=S Amb6279739 [0,1,0,1,0,0|1,1,0]=4 3994 B12R1.125 CC1CCCC\C1=N/CC(=O)O Amb27400353 [0,1,0,1,0,0|1,0,1]=4 3995 B12R1.125 CC1CCCNC1CCS(C)=O Amb35677548 [0,1,0,1,0,0|2,0,0]=4 3996 B12R1.125 CC1CCNCC1CNC(N)=O Amb27175423 [0,1,0,1,0,0|2,0,0]=4 3997 B12R1.125 CC1CNCCC1CCC(=O)O Amb27858642 [0,1,0,1,0,0|1,0,0]=3 3998 B12R1.125 CC1CNCCC1NCC(=O)O Amb27597159 [0,1,0,1,0,0|2,0,0]=4 3999 B12R1.125 CC1SCCCC1OCC(=O)O Amb25117392 [0,1,0,1,0,0|2,0,0]=4 4000 B12R1.125 CN1CCCCC1CCC(=O)O Amb10607785 [0,1,0,1,0,0|1,0,0]=3 4001 B12R1.125 CN1CCCCC1CCC(=O)O Amb13949149 [0,1,0,1,0,0|1,0,0]=3 4002 B12R1.125 CN1CCCCC1CCC(=O)O Amb28555723 [0,1,0,1,0,0|1,0,0]=3 4003 B12R1.125 CN1CCCCC1CC[N+](=O)[O-] Amb33322709 [0,1,0,1,0,0|2,0,0]=4 4004 B12R1.125 CN1CCCCC1CNC(=O)Cl Amb35625872 [0,1,0,1,0,0|2,0,0]=4 4005 B12R1.125 CN1CCCCC1COC(=O)Cl Amb33297321 [0,1,0,1,0,0|2,0,0]=4 4006 B12R1.125 CS(=O)CCC1CCCCC1=O Amb28142474 [0,1,0,1,0,0|1,0,0]=3 4007 B12R1.125 CS(=O)CCC1CCCCC1N Amb27855611 [0,1,0,1,0,0|2,0,0]=4 4008 B12R1.125 CS(=O)CCC1CCCCC1O Amb27628181 [0,1,0,1,0,0|2,0,0]=4 4009 B12R1.125 CS(=O)CCC1COCCC1=O Amb27855640 [0,1,0,1,0,0|2,0,0]=4 4010 B12R1.125 C[C@@H](N)CCC1CCCCN1C Amb33322731 [0,1,0,1,0,0|2,0,0]=4 4011 B12R1.125 C[C@@H](O)CCC1CCCCN1C Amb33322732 [0,1,0,1,0,0|2,0,0]=4 4012 B12R1.125 C[C@@H]1COCCN1CCC(=O)O Amb27863121 [0,1,0,1,0,0|2,0,0]=4 4013 B12R1.125 C[C@@H]1COCCN1CCC(N)=O Amb27806762 [0,1,0,1,0,0|2,0,0]=4 4014 B12R1.125 C[C@H](N)CCC1CCCCN1C Amb33322729 [0,1,0,1,0,0|2,0,0]=4 4015 B12R1.125 C[C@H](O)CCC1CCCCN1C Amb33223884 [0,1,0,1,0,0|2,0,0]=4 4016 B12R1.125 C[C@H]1CNCCN1CCC(=O)O Amb27217264 [0,1,0,1,0,0|2,0,0]=4 4017 B12R1.125 NC(=O)CN[C@@H]1CCCC[C@H]1O Amb26864539 [0,1,0,1,0,0|2,0,0]=4 4018 B12R1.125 NC1CCCCC1CCC(=O)O Amb28872362 [0,1,0,1,0,0|1,0,0]=3 4019 B12R1.125 NC1CCCCC1CCC(=O)O Amb6739962 [0,1,0,1,0,0|1,0,0]=3 4020 B12R1.125 NC1CCCCC1OCC(=O)O Amb24488516 [0,1,0,1,0,0|2,0,0]=4 4021 B12R1.125 O=C(O)CCC1CCCCC1=O Amb2721886 [0,1,0,1,0,0|1,0,1]=4 4022 B12R1.125 O=C(O)CCC1CCCCC1F Amb27636457 [0,1,0,1,0,0|1,0,0]=3 4023 B12R1.125 O=C(O)CCC1CCCCC1O Amb27426758 [0,1,0,1,0,0|1,0,0]=3 4024 B12R1.125 O=C(O)CCC1CCNCC1F Amb27247564 [0,1,0,1,0,0|2,0,0]=4 4025 B12R1.125 O=C(O)CC[C@@H]1CCCC[C@@H]1O Amb27210572 [0,1,0,1,0,0|1,0,0]=3 4026 B12R1.125 O=C(O)CC[C@H]1CCCC[C@H]1O Amb27444151 [0,1,0,1,0,0|1,0,0]=3 4027 B12R1.125 O=C(O)CC[C@H]1NCCC[C@@H]1O Amb28244797 [0,1,0,1,0,0|2,0,0]=4 4028 B12R1.125 O=C(O)CSC1CCCCC1O Amb10808762 [0,1,0,1,0,0|2,0,0]=4 4029 B12R1.130 CC(=O)CCCC1CCCN1C Amb33320329 [0,1,0,1,0,0|1,0,0]=3 4030 B12R1.130 CC(=O)NCCC1CCCC1=O Amb27793453 [0,1,0,1,0,0|1,0,1]=4 4031 B12R1.130 CC(=O)NCCC1CCCN1C Amb35682238 [0,1,0,1,0,0|2,0,0]=4 4032 B12R1.130 CC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696178 [0,1,0,1,0,0|2,0,0]=4 4033 B12R1.130 CC(C)=CCCC1CCCC1=O Amb30023716 [0,1,0,1,0,0|0,0,2]=4 4034 B12R1.130 CC(C)CCCC1CCCC1O Amb32945000 [0,1,0,1,0,0|0,0,2]=4 4035 B12R1.130 CC(C)CCC[C@@H]1CCC[C@H]1O Amb32944687 [0,1,0,1,0,0|0,0,2]=4 4036 B12R1.130 CC(N)CCCC1CCCN1C Amb33320730 [0,1,0,1,0,0|2,0,0]=4 4037 B12R1.130 CC(O)CCCC1CCCN1C Amb33320729 [0,1,0,1,0,0|2,0,0]=4 4038 B12R1.130 CC(O)\C=C/CC1CCCC1=O Amb28202018 [0,1,0,1,0,0|0,0,2]=4 4039 B12R1.130 CC(O)\C=C\CC1CCCC1=O Amb28052243 [0,1,0,1,0,0|0,0,2]=4 4040 B12R1.130 CC1OCCC1CCCC(=O)O Amb33429902 [0,1,0,1,0,0|1,0,0]=3 4041 B12R1.130 CN(C)CCCN1CCCC1=O Amb24080513 [0,1,0,1,0,0|2,0,0]=4 4042 B12R1.130 CN1CCCC1CCCC(=O)O Amb33322235 [0,1,0,1,0,0|1,0,0]=3 4043 B12R1.130 CN1CCCC1CCC[N+](=O)[O-] Amb33320770 [0,1,0,1,0,0|2,0,0]=4 4044 B12R1.130 CN1CCCC1CCNC(=O)Cl Amb35625606 [0,1,0,1,0,0|2,0,0]=4 4045 B12R1.130 CN1CCCC1CCNC(N)=O Amb35691980 [0,1,0,1,0,0|2,0,0]=4 4046 B12R1.130 CN1CCCC1COCC(=O)O Amb21861056 [0,1,0,1,0,0|2,0,0]=4 4047 B12R1.130 CN1CCCC1COCC(=O)O Amb32409791 [0,1,0,1,0,0|2,0,0]=4 4048 B12R1.130 CN1CCC[C@H]1COCC(=O)O Amb22224778 [0,1,0,1,0,0|2,0,0]=4 4049 B12R1.130 C[C@@H](N)CCCC1CCCN1C Amb33320725 [0,1,0,1,0,0|2,0,0]=4 4050 B12R1.130 C[C@@H](O)CCCC1CCCN1C Amb33320726 [0,1,0,1,0,0|2,0,0]=4 4051 B12R1.130 C[C@H](N)CCCC1CCCN1C Amb33320724 [0,1,0,1,0,0|2,0,0]=4 4052 B12R1.130 C[C@H](O)CCCC1CCCN1C Amb33320727 [0,1,0,1,0,0|2,0,0]=4 4053 B12R1.210 C=C(C)CC1CCCCCC1=O Amb18798683 [0,1,0,1,0,0|0,0,1]=3 4054 B12R1.210 C=C(C)CC1CCCCCC1O Amb18805991 [0,1,0,1,0,0|2,0,0]=4 4055 B12R1.210 C=C(C)CC1CCCCNC1=O Amb27808138 [0,1,0,1,0,0|1,0,1]=4 4056 B12R1.210 C=C(C)C[C@@H]1CCCCC[C@H]1O Amb32950057 [0,1,0,1,0,0|2,0,0]=4 4057 B12R1.210 C=C(Cl)CC1CCCCCC1O Amb33213689 [0,1,0,1,0,0|2,0,0]=4 4058 B12R1.210 C=C(Cl)C[C@@H]1CCCCC[C@H]1O Amb32945011 [0,1,0,1,0,0|2,0,0]=4 4059 B12R1.210 CC(=O)CC1CCCCCC1Cl Amb28047319 [0,1,0,1,0,0|1,0,0]=3 4060 B12R1.210 CC(=O)CC1CCCCCN1C Amb27458157 [0,1,0,1,0,0|1,0,0]=3 4061 B12R1.210 CC(=O)C[C@H]1CCCC=C[C@H]1C Amb27781987 [0,1,0,1,0,0|0,0,2]=4 4062 B12R1.210 CC(=O)C[C@H]1CCCCC[C@@H]1Cl Amb27844358 [0,1,0,1,0,0|1,0,0]=3 4063 B12R1.210 CC(=O)NC1CCCCCC1Br Amb28370391 [0,1,0,1,0,0|2,0,0]=4 4064 B12R1.210 CC(=O)NC1CCCCCC1C Amb27489458 [0,1,0,1,0,0|1,0,0]=3 4065 B12R1.210 CC(=O)NC1CCCCCC1N Amb27266098 [0,1,0,1,0,0|2,0,0]=4 4066 B12R1.210 CC(=O)O[C@@H]1CCCCCC1=O Amb27177916 [0,1,0,1,0,0|1,0,1]=4 4067 B12R1.210 CC(=O)\C=C1/CCCCCC1C Amb35734060 [0,1,0,1,0,0|0,0,2]=4 4068 B12R1.210 CC(C)CC1CCCCCC1Br Amb27440763 [0,1,0,1,0,0|1,0,1]=4 4069 B12R1.210 CC(C)CC1CCCCCC1Cl Amb27782327 [0,1,0,1,0,0|1,0,1]=4 4070 B12R1.210 CC(C)CC1CCCCCC1O Amb18806715 [0,1,0,1,0,0|0,0,2]=4 4071 B12R1.210 CC(C)CC1CCCCNC1=O Amb28347995 [0,1,0,1,0,0|1,0,0]=3 4072 B12R1.210 CC(C)CC1NCCCNC1=O Amb25299175 [0,1,0,1,0,0|2,0,0]=4 4073 B12R1.210 CC(C)CN1CCCNCC1=O Amb27389169 [0,1,0,1,0,0|2,0,0]=4 4074 B12R1.210 CC(C)CN1CCNCCC1=O Amb28318426 [0,1,0,1,0,0|2,0,0]=4 4075 B12R1.210 CC(C)C[C@@H]1CCCCC[C@H]1O Amb32944965 [0,1,0,1,0,0|0,0,2]=4 4076 B12R1.210 CC(C)C[C@@H]1NCCCNC1=O Amb32719925 [0,1,0,1,0,0|2,0,0]=4 4077 B12R1.210 CC(C)C[C@H]1NCCCNC1=O Amb32719927 [0,1,0,1,0,0|2,0,0]=4 4078 B12R1.210 CC(C)SC1CCCCNC1=O Amb27802200 [0,1,0,1,0,0|2,0,0]=4 4079 B12R1.210 CC(N)CN1CCOCCC1=O Amb28429134 [0,1,0,1,0,0|2,0,0]=4 4080 B12R1.210 CC(O)CC1CCCCCN1C Amb27213956 [0,1,0,1,0,0|2,0,0]=4 4081 B12R1.210 CC(O)CC1CCCCNC1=O Amb25710975 [0,1,0,1,0,0|1,0,0]=3 4082 B12R1.210 CC(O)CN1CCNCCC1=O Amb35641614 [0,1,0,1,0,0|2,0,0]=4 4083 B12R1.210 CC(O)CN1CCOCCC1=O Amb28207521 [0,1,0,1,0,0|2,0,0]=4 4084 B12R1.210 CC1=C(CC(=O)O)CCCCC1 Amb27614696 [0,1,0,1,0,0|0,0,2]=4 4085 B12R1.210 CC1CCCCCC1CC(=O)O Amb29865063 [0,1,0,1,0,0|0,0,0]=2 4086 B12R1.210 CC1CCCCCC1NC(=O)Cl Amb35633242 [0,1,0,1,0,0|1,0,0]=3 4087 B12R1.210 CC1CCCCCN1CC(N)=S Amb27433559 [0,1,0,1,0,0|1,1,0]=4 4088 B12R1.210 CC1CCCCC\C1=C/C(=O)O Amb35721698 [0,1,0,1,0,0|0,0,2]=4 4089 B12R1.210 CC1CCOCCN1CC(N)=O Amb27649926 [0,1,0,1,0,0|2,0,0]=4 4090 B12R1.210 CC1COCCCN1CC(=O)O Amb27968934 [0,1,0,1,0,0|2,0,0]=4 4091 B12R1.210 CC1COCCCN1CC(N)=O Amb28382015 [0,1,0,1,0,0|2,0,0]=4 4092 B12R1.210 CC1NCCCCC1CC(=O)O Amb27792876 [0,1,0,1,0,0|1,0,0]=3 4093 B12R1.210 CN(C)CC1CCCCCC1=O Amb18801469 [0,1,0,1,0,0|1,0,0]=3 4094 B12R1.210 CN1CCCCCC1CC(=O)O Amb28250660 [0,1,0,1,0,0|1,0,0]=3 4095 B12R1.210 CS(=O)CC1CCCCCC1O Amb27978240 [0,1,0,1,0,0|2,0,0]=4 4096 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(=O)O Amb18198536 [0,1,0,1,0,0|1,0,0]=3 4097 B12R1.210 C[C@H](N)CN1CCCCCC1=O Amb28318260 [0,1,0,1,0,0|1,0,0]=3 4098 B12R1.210 C[C@H](O)CN1CCCCCC1=O Amb27457089 [0,1,0,1,0,0|1,0,0]=3 4099 B12R1.210 C[C@H]1NCCCC[C@@H]1CC(=O)O Amb27420235 [0,1,0,1,0,0|1,0,0]=3 4100 B12R1.210 NC(=O)NC1CCCCCC1N Amb27249850 [0,1,0,1,0,0|2,0,0]=4 4101 B12R1.210 NC(=O)NC1CCCCCC1O Amb27770817 [0,1,0,1,0,0|2,0,0]=4 4102 B12R1.210 NC1CCCCCC1CC(=O)O Amb27178104 [0,1,0,1,0,0|1,0,0]=3 4103 B12R1.210 N[C@@H]1CCCCC[C@@H]1CC(=O)O Amb27816143 [0,1,0,1,0,0|1,0,0]=3 4104 B12R1.210 O=C(O)CC1CCCCCC1=O Amb18825694 [0,1,0,1,0,0|1,0,1]=4 4105 B12R1.210 O=C(O)CC1CCCCCC1O Amb18198284 [0,1,0,1,0,0|1,0,0]=3 4106 B12R1.210 O=C(O)CC1CCOCCC1F Amb27620258 [0,1,0,1,0,0|2,0,0]=4 4107 B12R1.210 O=C(O)CC1CCSCCC1F Amb28133029 [0,1,0,1,0,0|2,0,0]=4 4108 B12R1.210 O=C1CCCCCC1CC(F)F Amb28041349 [0,1,0,1,0,0|1,0,0]=3 4109 B12R1.212 C=C(C)C1CCCCCCC1=O Amb28243905 [0,1,0,1,0,0|0,0,1]=3 4110 B12R1.212 CC(=O)C1CCCCCCC1N Amb33447098 [0,1,0,1,0,0|1,0,0]=3 4111 B12R1.212 CC(C)=C1CCCCCCC1=O Amb27256366 [0,1,0,1,0,0|0,0,2]=4 4112 B12R1.212 CC(O)C1=C(Cl)CCCCCC1 Amb28435826 [0,1,0,1,0,0|1,0,1]=4 4113 B12R1.212 C\C(N)=C1/CCCCCCC1=O Amb22363602 [0,1,0,1,0,0|0,0,2]=4 4114 B12R1.212 C\C(O)=C1/CCCCCCC1=O Amb27175968 [0,1,0,1,0,0|0,0,2]=4 4115 B12R1.212 NC(=O)C1CCCCCCC1N Amb28292092 [0,1,0,1,0,0|1,0,0]=3 4116 B12R1.212 NC(=O)C1CCCCCCC1O Amb27178181 [0,1,0,1,0,0|1,0,0]=3 4117 B12R1.212 NC(=O)[C@@H]1CCCCCC[C@@H]1O Amb27974099 [0,1,0,1,0,0|1,0,0]=3 4118 B12R1.212 NC(=O)[C@H]1CCCCCC[C@@H]1O Amb28323009 [0,1,0,1,0,0|1,0,0]=3 4119 B12R1.212 NC1CCCCCCC1C(=O)O Amb20667806 [0,1,0,1,0,0|1,0,0]=3 4120 B12R1.212 NC1CCCCCCC1C(=O)O Amb22059713 [0,1,0,1,0,0|1,0,0]=3 4121 B12R1.212 NS(=O)C1CCCCCCC1F Amb32720767 [0,1,0,1,0,0|2,0,0]=4 4122 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1993853 [0,1,0,1,0,0|1,0,0]=3 4123 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1994005 [0,1,0,1,0,0|1,0,0]=3 4124 B12R1.212 N[C@H]1CCCCCC[C@H]1C(=O)O Amb1993854 [0,1,0,1,0,0|1,0,0]=3 4125 B12R1.212 O=C1CCCCCCC1[N+](=O)[O-] Amb28410728 [0,1,0,1,0,0|2,0,0]=4 4126 B12R1.212 O=S(Cl)C1CCCCCCC1F Amb32720766 [0,1,0,1,0,0|2,0,0]=4 4127 B12R1.212 O=S([O-])C1CCCCCCC1F Amb32755059 [0,1,0,1,0,0|2,0,0]=4 4128 B12R1.252 CC(=O)CCC=C1CCCCC1 Amb2610904 [0,1,0,1,0,0|0,0,2]=4 4129 B12R1.252 CC(=O)CCCC1CCCCC1 Amb33359306 [0,1,0,1,0,0|0,0,0]=2 4130 B12R1.252 CC(=O)CCNC1CCCCC1 Amb18647221 [0,1,0,1,0,0|1,0,0]=3 4131 B12R1.252 CC(=O)NCCC1CCCCN1 Amb9725754 [0,1,0,1,0,0|2,0,0]=4 4132 B12R1.252 CC(=O)NCCC1CCCNC1 Amb18982294 [0,1,0,1,0,0|2,0,0]=4 4133 B12R1.252 CC(=O)NCCC1CCCNC1 Amb21960598 [0,1,0,1,0,0|2,0,0]=4 4134 B12R1.252 CC(=O)NCCC1CCNCC1 Amb1080251 [0,1,0,1,0,0|2,0,0]=4 4135 B12R1.252 CC(=O)NCNC1CCCCC1 Amb27770101 [0,1,0,1,0,0|2,0,0]=4 4136 B12R1.252 CC(=O)\C=C\CC1CCCCC1 Amb32953373 [0,1,0,1,0,0|0,0,2]=4 4137 B12R1.252 CC(C)=CCCC1CCCCC1 Amb35582921 [0,1,0,1,0,0|1,0,1]=4 4138 B12R1.252 CC(C)CCCC1CCCCN1 Amb28991196 [0,1,0,1,0,0|1,0,1]=4 4139 B12R1.252 CC(C)CCCC1CCCCN1 Amb5718406 [0,1,0,1,0,0|1,0,1]=4 4140 B12R1.252 CC(C)CCCC1CCCNC1 Amb22642856 [0,1,0,1,0,0|2,0,0]=4 4141 B12R1.252 CC(C)CCCC1CCCNC1 Amb35745624 [0,1,0,1,0,0|2,0,0]=4 4142 B12R1.252 CC(N)CCCC1CCCCC1 Amb33079349 [0,1,0,1,0,0|1,0,1]=4 4143 B12R1.252 CC(O)CCCC1CCCCC1 Amb33449617 [0,1,0,1,0,0|0,0,2]=4 4144 B12R1.252 C[C@@H](N)CCCC1CCCCC1 Amb33422428 [0,1,0,1,0,0|1,0,1]=4 4145 B12R1.252 C[C@@H](O)CCCC1CCCCC1 Amb33422430 [0,1,0,1,0,0|0,0,2]=4 4146 B12R1.252 C[C@H](N)CCCC1CCCCC1 Amb33422427 [0,1,0,1,0,0|1,0,1]=4 4147 B12R1.252 C[C@H](O)CCCC1CCCCC1 Amb33422431 [0,1,0,1,0,0|0,0,2]=4 4148 B12R1.252 N=C(N)CCCN1CCCCC1 Amb13951455 [0,1,0,1,0,0|2,0,0]=4 4149 B12R1.252 N=C(N)CCOC1CCCCC1 Amb10610331 [0,1,0,1,0,0|2,0,0]=4 4150 B12R1.252 NC(=O)CCCN1CCCCC1 Amb17142921 [0,1,0,1,0,0|1,0,0]=3 4151 B12R1.252 NC(=O)CCNC1CCCCC1 Amb8437701 [0,1,0,1,0,0|1,0,0]=3 4152 B12R1.252 NC(=O)CNCC1CCCCC1 Amb1113547 [0,1,0,1,0,0|1,0,0]=3 4153 B12R1.252 NC(=O)COCC1CCNCC1 Amb17083678 [0,1,0,1,0,0|2,0,0]=4 4154 B12R1.252 NC(=O)NOCC1CCCCC1 Amb28193569 [0,1,0,1,0,0|2,0,0]=4 4155 B12R1.252 NC(=S)CCOC1CCCCC1 Amb6262051 [0,1,0,1,0,0|1,1,0]=4 4156 B12R1.252 NC(=S)NCCC1CCCCC1 Amb19058785 [0,1,0,1,0,0|1,1,0]=4 4157 B12R1.252 NS(=O)CCCC1CCOCC1 Amb32720878 [0,1,0,1,0,0|2,0,0]=4 4158 B12R1.252 O=C(Cl)NCCC1CCCCC1 Amb35625747 [0,1,0,1,0,0|1,0,0]=3 4159 B12R1.252 O=C(Cl)NCCC1CCCCO1 Amb35633405 [0,1,0,1,0,0|2,0,0]=4 4160 B12R1.252 O=C(Cl)NCCC1CCOCC1 Amb35625737 [0,1,0,1,0,0|2,0,0]=4 4161 B12R1.252 O=C(Cl)OCCC1CCCCC1 Amb33297326 [0,1,0,1,0,0|1,0,0]=3 4162 B12R1.252 O=C(Cl)OCCC1CCCCO1 Amb33297112 [0,1,0,1,0,0|2,0,0]=4 4163 B12R1.252 O=C(O)C#CCC1CCCCC1 Amb27170004 [0,1,0,1,0,0|0,0,2]=4 4164 B12R1.252 O=C(O)CC#CC1CCCCC1 Amb26861627 [0,1,0,1,0,0|0,0,2]=4 4165 B12R1.252 O=C(O)CCCC1CC=CCC1 Amb33358970 [0,1,0,1,0,0|0,0,2]=4 4166 B12R1.252 O=C(O)CCCC1CCCCC1 Amb4007236 [0,1,0,1,0,0|0,0,0]=2 4167 B12R1.252 O=C(O)CCCC1CCCCN1 Amb1101084 [0,1,0,1,0,0|1,0,0]=3 4168 B12R1.252 O=C(O)CCCC1CCCCN1 Amb22284114 [0,1,0,1,0,0|1,0,0]=3 4169 B12R1.252 O=C(O)CCCC1CCCCO1 Amb33377395 [0,1,0,1,0,0|1,0,0]=3 4170 B12R1.252 O=C(O)CCCC1CCCOC1 Amb33358265 [0,1,0,1,0,0|1,0,0]=3 4171 B12R1.252 O=C(O)CCCC1CCCSC1 Amb33079061 [0,1,0,1,0,0|1,0,0]=3 4172 B12R1.252 O=C(O)CCCC1CCNCC1 Amb1101085 [0,1,0,1,0,0|1,0,0]=3 4173 B12R1.252 O=C(O)CCCC1CCNCC1 Amb2720095 [0,1,0,1,0,0|1,0,0]=3 4174 B12R1.252 O=C(O)CCCC1CCOCC1 Amb28555790 [0,1,0,1,0,0|1,0,0]=3 4175 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5718374 [0,1,0,1,0,0|1,0,0]=3 4176 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5762298 [0,1,0,1,0,0|1,0,0]=3 4177 B12R1.252 O=C(O)CCCN1CCNCC1 Amb17479003 [0,1,0,1,0,0|2,0,0]=4 4178 B12R1.252 O=C(O)CCCN1CCOCC1 Amb21954071 [0,1,0,1,0,0|2,0,0]=4 4179 B12R1.252 O=C(O)CCCN1CCOCC1 Amb5846623 [0,1,0,1,0,0|2,0,0]=4 4180 B12R1.252 O=C(O)CCNC1CCCCC1 Amb33484265 [0,1,0,1,0,0|1,0,0]=3 4181 B12R1.252 O=C(O)CCNC1CCCCC1 Amb3940614 [0,1,0,1,0,0|1,0,0]=3 4182 B12R1.252 O=C(O)CCNC1CCNCC1 Amb19008333 [0,1,0,1,0,0|2,0,0]=4 4183 B12R1.252 O=C(O)CCNC1CCNCC1 Amb33552933 [0,1,0,1,0,0|2,0,0]=4 4184 B12R1.252 O=C(O)CCOC1CCCCO1 Amb24120644 [0,1,0,1,0,0|2,0,0]=4 4185 B12R1.252 O=C(O)CCOC1CCOCC1 Amb18790274 [0,1,0,1,0,0|2,0,0]=4 4186 B12R1.252 O=C(O)CCSC1CCCCC1 Amb3318888 [0,1,0,1,0,0|1,0,0]=3 4187 B12R1.252 O=C(O)COCC1CCCCC1 Amb19032022 [0,1,0,1,0,0|1,0,0]=3 4188 B12R1.252 O=C(O)COCC1CCCCO1 Amb9716871 [0,1,0,1,0,0|2,0,0]=4 4189 B12R1.252 O=C(O)COCC1CCCNC1 Amb33038178 [0,1,0,1,0,0|2,0,0]=4 4190 B12R1.252 O=C(O)COCC1CCCNC1 Amb33329459 [0,1,0,1,0,0|2,0,0]=4 4191 B12R1.252 O=C(O)COCC1CCNCC1 Amb35751378 [0,1,0,1,0,0|2,0,0]=4 4192 B12R1.252 O=C(O)COCC1CCNCC1 Amb35752582 [0,1,0,1,0,0|2,0,0]=4 4193 B12R1.252 O=C(O)COCC1CCOCC1 Amb18312456 [0,1,0,1,0,0|2,0,0]=4 4194 B12R1.252 O=C(O)CSCC1CCCCO1 Amb9008344 [0,1,0,1,0,0|2,0,0]=4 4195 B12R1.252 O=C(O)C\C=C\C1CCCCC1 Amb26861470 [0,1,0,1,0,0|0,0,2]=4 4196 B12R1.252 O=C(O)\C=C\CC1CCCCC1 Amb26527903 [0,1,0,1,0,0|0,0,2]=4 4197 B12R1.252 O=C([O-])CCCC1CCCCC1 Amb8516780 [0,1,0,1,0,0|0,0,0]=2 4198 B12R1.252 O=S(Cl)CCCC1CCOCC1 Amb32720877 [0,1,0,1,0,0|2,0,0]=4 4199 B12R1.252 O=S([O-])CCCC1CCOCC1 Amb32755565 [0,1,0,1,0,0|2,0,0]=4 4200 B12R1.252 O=[N+]([O-])CCCC1CCCCC1 Amb33422420 [0,1,0,1,0,0|1,0,0]=3 4201 B12R1.255 CC(=O)CCCCC1CCCC1 Amb33448571 [0,1,0,1,0,0|0,0,0]=2 4202 B12R1.255 CC(=O)CCCCN1CCCC1 Amb9659031 [0,1,0,1,0,0|1,0,0]=3 4203 B12R1.255 CC(=O)\C=C\CCC1CCCC1 Amb33379446 [0,1,0,1,0,0|0,0,2]=4 4204 B12R1.255 CC(N)CCCCC1CCCC1 Amb33481739 [0,1,0,1,0,0|1,0,1]=4 4205 B12R1.255 CC(O)CCCCC1CCCC1 Amb33359674 [0,1,0,1,0,0|0,0,2]=4 4206 B12R1.255 C[C@@H](N)CCCCC1CCCC1 Amb33375617 [0,1,0,1,0,0|1,0,1]=4 4207 B12R1.255 C[C@@H](O)CCCCC1CCCC1 Amb33375589 [0,1,0,1,0,0|0,0,2]=4 4208 B12R1.255 C[C@H](N)CCCCC1CCCC1 Amb33375616 [0,1,0,1,0,0|1,0,1]=4 4209 B12R1.255 C[C@H](O)CCCCC1CCCC1 Amb33375619 [0,1,0,1,0,0|0,0,2]=4 4210 B12R1.255 NC(=O)CCCCC1CCSS1 Amb2747279 [0,1,0,1,0,0|2,0,0]=4 4211 B12R1.255 NS(=O)CCOCC1CCCC1 Amb32720585 [0,1,0,1,0,0|2,0,0]=4 4212 B12R1.255 O=C(O)CCCCC1CCCC1 Amb33229242 [0,1,0,1,0,0|0,0,0]=2 4213 B12R1.255 O=C(O)CCCCC1CCOC1 Amb33229236 [0,1,0,1,0,0|1,0,0]=3 4214 B12R1.255 O=C(O)CCCCC1CCSS1 Amb1152511 [0,1,0,1,0,0|2,0,0]=4 4215 B12R1.255 O=C(O)CCCCC1CSSC1 Amb33551319 [0,1,0,1,0,0|2,0,0]=4 4216 B12R1.255 O=C(O)CCCCC1OCCO1 Amb28079380 [0,1,0,1,0,0|2,0,0]=4 4217 B12R1.255 O=C(O)CCCCN1CCCC1 Amb33552798 [0,1,0,1,0,0|1,0,0]=3 4218 B12R1.255 O=C(O)CCCCN1CCCC1 Amb7783148 [0,1,0,1,0,0|1,0,0]=3 4219 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 Amb553489 [0,1,0,1,0,0|2,0,0]=4 4220 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 Amb17616537 [0,1,0,1,0,0|2,0,0]=4 4221 B12R1.255 O=C(O)CCNCC1CCCO1 Amb7755703 [0,1,0,1,0,0|2,0,0]=4 4222 B12R1.255 O=C(O)CCOCC1CCCO1 Amb6274081 [0,1,0,1,0,0|2,0,0]=4 4223 B12R1.255 O=C(O)CCSCC1CCCO1 Amb9723634 [0,1,0,1,0,0|2,0,0]=4 4224 B12R1.255 O=C(O)CNCCN1CCCC1 Amb9325920 [0,1,0,1,0,0|2,0,0]=4 4225 B12R1.255 O=C(O)COCCC1CCCC1 Amb32954482 [0,1,0,1,0,0|1,0,0]=3 4226 B12R1.255 O=C(O)COCCN1CCCC1 Amb33474001 [0,1,0,1,0,0|2,0,0]=4 4227 B12R1.255 O=C(O)CSCCN1CCCC1 Amb13949167 [0,1,0,1,0,0|2,0,0]=4 4228 B12R1.255 O=C(O)CSCCN1CCCC1 Amb6745649 [0,1,0,1,0,0|2,0,0]=4 4229 B12R1.255 O=C(O)\C=C\CCC1CCCC1 Amb33374577 [0,1,0,1,0,0|0,0,2]=4 4230 B12R1.255 O=C([O-])CCCCC1CCSS1 Amb22168392 [0,1,0,1,0,0|2,0,0]=4 4231 B12R1.255 O=S(Cl)CCOCC1CCCC1 Amb32720584 [0,1,0,1,0,0|2,0,0]=4 4232 B12R1.255 O=S([O-])CCOCC1CCCC1 Amb32755438 [0,1,0,1,0,0|2,0,0]=4 4233 B12R1.255 O=[N+]([O-])CCCCC1CCCC1 Amb33380265 [0,1,0,1,0,0|1,0,0]=3 4234 B12R1.255 O=[N+]([O-])CCCCN1CCCC1 Amb33275167 [0,1,0,1,0,0|2,0,0]=4 4235 B12R1.257 NC(=O)CCCCOC1CNC1 Amb32941487 [0,1,0,1,0,0|2,0,0]=4 4236 B12R1.283 C#CCC1CCCCC1C(C)=O Amb25996388 [0,1,0,1,0,0|0,0,2]=4 4237 B12R1.283 C#CC[C@@H]1CCCC[C@H]1C(C)=O Amb25273888 [0,1,0,1,0,0|0,0,2]=4 4238 B12R1.283 C#CC[C@H]1CCCC[C@H]1C(C)=O Amb26554032 [0,1,0,1,0,0|0,0,2]=4 4239 B12R1.283 C=CCC1CCCCC1C(=O)O Amb18646999 [0,1,0,1,0,0|0,0,2]=4 4240 B12R1.283 C=CCN1CCCCC1C(C)O Amb27766320 [0,1,0,1,0,0|2,0,0]=4 4241 B12R1.283 CC(=O)N1CCCCC1CCBr Amb17103917 [0,1,0,1,0,0|2,0,0]=4 4242 B12R1.283 CC(=O)N1CCCCC1CCCl Amb17103644 [0,1,0,1,0,0|2,0,0]=4 4243 B12R1.283 CC(=O)N1CCCCC1CCN Amb17046292 [0,1,0,1,0,0|2,0,0]=4 4244 B12R1.283 CC(=O)N1CCCCC1CCO Amb5797426 [0,1,0,1,0,0|2,0,0]=4 4245 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO Amb25295318 [0,1,0,1,0,0|2,0,0]=4 4246 B12R1.283 CC(=O)N1CCCC[C@H]1CCO Amb25700843 [0,1,0,1,0,0|2,0,0]=4 4247 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC#N Amb26427085 [0,1,0,1,0,0|1,0,1]=4 4248 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC=O Amb27195918 [0,1,0,1,0,0|0,0,1]=3 4249 B12R1.283 CCCC1=C(C(C)=O)CCCC1 Amb27614636 [0,1,0,1,0,0|0,0,2]=4 4250 B12R1.283 CCCC1CCCCC1C(C)=O Amb27762565 [0,1,0,1,0,0|0,0,0]=2 4251 B12R1.283 CCCC1CCCNC1C(=O)O Amb27178215 [0,1,0,1,0,0|1,0,0]=3 4252 B12R1.283 CCCC1CNCCN1C(C)=O Amb28285684 [0,1,0,1,0,0|2,0,0]=4 4253 B12R1.283 CCCC1OCCCC1C(=O)O Amb10609660 [0,1,0,1,0,0|1,0,0]=3 4254 B12R1.283 CCCN1CCCCC1C(=N)N Amb35666161 [0,1,0,1,0,0|2,0,0]=4 4255 B12R1.283 CCCN1CCCCC1C(=O)O Amb1110568 [0,1,0,1,0,0|1,0,0]=3 4256 B12R1.283 CCCN1CCCCC1C(=O)O Amb33552437 [0,1,0,1,0,0|1,0,0]=3 4257 B12R1.283 CCCN1CCCCC1C(N)=O Amb26003555 [0,1,0,1,0,0|1,0,0]=3 4258 B12R1.283 CCCN1CCCCC1C(N)=S Amb27412417 [0,1,0,1,0,0|1,1,0]=4 4259 B12R1.283 CCCN1CCCC[C@H]1C(N)=O Amb28291427 [0,1,0,1,0,0|1,0,0]=3 4260 B12R1.283 CCCN1CCNCC1C(=O)O Amb18825347 [0,1,0,1,0,0|2,0,0]=4 4261 B12R1.283 CCCN1CCOCC1C(N)=O Amb27178873 [0,1,0,1,0,0|2,0,0]=4 4262 B12R1.283 CCNC1CCCCC1S(C)=O Amb28291089 [0,1,0,1,0,0|2,0,0]=4 4263 B12R1.283 CCO[C@@H]1CCCC[C@H]1C(C)=O Amb28248007 [0,1,0,1,0,0|1,0,0]=3 4264 B12R1.283 CN(C)[C@@H]1CCCC[C@H]1NC=O Amb27814166 [0,1,0,1,0,0|2,0,0]=4 4265 B12R1.283 CN(C)[C@H]1CCCC[C@H]1NC=O Amb27194325 [0,1,0,1,0,0|2,0,0]=4 4266 B12R1.283 COCC1CCCCN1C(=O)Cl Amb32863950 [0,1,0,1,0,0|2,0,0]=4 4267 B12R1.283 COCC1NCCCC1C(N)=O Amb27458399 [0,1,0,1,0,0|2,0,0]=4 4268 B12R1.283 COCC1OCCCC1C(=O)O Amb27647224 [0,1,0,1,0,0|2,0,0]=4 4269 B12R1.283 C\C=C\C1CCCCC1C(C)=O Amb25282802 [0,1,0,1,0,0|0,0,2]=4 4270 B12R1.283 NC(=O)C1CCCCN1CCO Amb27207263 [0,1,0,1,0,0|2,0,0]=4 4271 B12R1.283 NC(=O)N1CCCCC1CCO Amb28281163 [0,1,0,1,0,0|2,0,0]=4 4272 B12R1.283 NCCC1CCCCN1C(N)=O Amb28381340 [0,1,0,1,0,0|2,0,0]=4 4273 B12R1.283 O=C(O)[C@@H]1CCCCN1CCF Amb27757723 [0,1,0,1,0,0|2,0,0]=4 4274 B12R1.283 [C-]#[N+]CC1CCCCC1C(C)F Amb27199357 [0,1,0,1,0,0|2,0,0]=4 4275 B12R1.289 CC(=O)CC1CCCC1CC#N Amb27164722 [0,1,0,1,0,0|1,0,1]=4 4276 B12R1.289 CC(=O)C[C@@H]1CCC[C@H]1CC#N Amb27620440 [0,1,0,1,0,0|1,0,1]=4 4277 B12R1.289 CCCC1COCC1NC(=O)Cl Amb35636915 [0,1,0,1,0,0|2,0,0]=4 4278 B12R1.289 CCCC1COCC1NC(C)=O Amb35617217 [0,1,0,1,0,0|2,0,0]=4 4279 B12R1.289 CCCC1COCC1NC(N)=O Amb35613744 [0,1,0,1,0,0|2,0,0]=4 4280 B12R1.289 CCSC1CCCC1NC(=O)Cl Amb35633550 [0,1,0,1,0,0|2,0,0]=4 4281 B12R1.289 COCC1CCCN1CC(=O)O Amb21860507 [0,1,0,1,0,0|2,0,0]=4 4282 B12R1.384 C#CCCC1CCCCC1(C)O Amb33213109 [0,1,0,1,0,0|1,0,1]=4 4283 B12R1.384 C#CCC[C@@H]1CCCC[C@@]1(C)O Amb32944326 [0,1,0,1,0,0|1,0,1]=4 4284 B12R1.384 C=CCCC1CCCCC1(C)O Amb32945710 [0,1,0,1,0,0|1,0,0]=3 4285 B12R1.384 C=CCC[C@@H]1CCCC[C@@]1(C)O Amb33213693 [0,1,0,1,0,0|1,0,0]=3 4286 B12R1.384 C=CCNC1CCCCC1(C)C Amb27270660 [0,1,0,1,0,0|2,0,0]=4 4287 B12R1.384 C=CCNC1CCCCC1(C)O Amb35664255 [0,1,0,1,0,0|2,0,0]=4 4288 B12R1.384 C=CCN[C@@H]1CCCC[C@@]1(C)O Amb35665707 [0,1,0,1,0,0|2,0,0]=4 4289 B12R1.384 C=CCSC1CCCCC1(C)O Amb35667559 [0,1,0,1,0,0|2,0,0]=4 4290 B12R1.384 C=CCS[C@@H]1CCCC[C@@]1(C)O Amb35667463 [0,1,0,1,0,0|2,0,0]=4 4291 B12R1.384 CC1(F)CCCCC1CN=C=O Amb27186755 [0,1,0,1,0,0|1,0,1]=4 4292 B12R1.384 CC1(O)CCCCC1CCCO Amb28189528 [0,1,0,1,0,0|0,0,2]=4 4293 B12R1.384 CCCCC1CCCCC1(C)O Amb32945487 [0,1,0,1,0,0|0,0,2]=4 4294 B12R1.384 CCCC[C@@H]1CCCC[C@@]1(C)O Amb33213620 [0,1,0,1,0,0|0,0,2]=4 4295 B12R1.384 CCNCC1CCCCS1(=O)=O Amb27985584 [0,1,0,1,0,0|2,0,0]=4 4296 B12R1.384 CNCCC1CCCCS1(=O)=O Amb35673546 [0,1,0,1,0,0|2,0,0]=4 4297 B12R1.384 C[C@@]1(O)CCCC[C@H]1CCCO Amb27422386 [0,1,0,1,0,0|0,0,2]=4 4298 B12R1.384 NCCCC1CCCCS1(=O)=O Amb35723223 [0,1,0,1,0,0|2,0,0]=4 4299 B12R1.384 O=CCCC1CCCCC1(F)F Amb27811296 [0,1,0,1,0,0|1,0,0]=3 4300 B12R1.384 O=S1(=O)CCCCC1CCCBr Amb32690551 [0,1,0,1,0,0|2,0,0]=4 4301 B12R1.384 O=S1(=O)CCCCC1CCCCl Amb32690550 [0,1,0,1,0,0|2,0,0]=4 4302 B12R1.384 O=S1(=O)CCCCC1CCCO Amb35723304 [0,1,0,1,0,0|2,0,0]=4 4303 B12R1.386 CC(=O)N1CCCC1CCCN Amb31161636 [0,1,0,1,0,0|2,0,0]=4 4304 B12R1.386 CCNCC1CCCN1C(C)=O Amb21861191 [0,1,0,1,0,0|2,0,0]=4 4305 B12R1.386 NCCCN1CCCC1C(N)=O Amb6750987 [0,1,0,1,0,0|2,0,0]=4 4306 B12R1.386 NCCCN1CCC[C@@H]1C(N)=O Amb34915539 [0,1,0,1,0,0|2,0,0]=4 4307 B12R1.386 NCCCN1CCC[C@H]1C(N)=O Amb32668534 [0,1,0,1,0,0|2,0,0]=4 4308 B12R1.390 O=C(O)CCCCOCC1CC1 Amb9207802 [0,1,0,1,0,0|1,0,0]=3 4309 B12R1.390 O=C(O)CNCCCCC1CC1 Amb32675856 [0,1,0,1,0,0|1,0,0]=3 4310 B12R1.405 CC(=O)C1CCCCCC1C#N Amb25918242 [0,1,0,1,0,0|1,0,1]=4 4311 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,1,0,1,0,0|2,0,0]=4 4312 B12R1.405 CC(C)C1CCCCCC1C#N Amb35611346 [0,1,0,1,0,0|1,0,1]=4 4313 B12R1.405 CC(C)C1CCCCCC1C=O Amb35725696 [0,1,0,1,0,0|0,0,0]=2 4314 B12R1.405 CC(C)C1CCCCCC1CBr Amb35721296 [0,1,0,1,0,0|1,0,1]=4 4315 B12R1.405 CC(C)C1CCCCCC1CCl Amb35721295 [0,1,0,1,0,0|1,0,1]=4 4316 B12R1.405 CC(C)C1CCCCCC1CN Amb27405527 [0,1,0,1,0,0|1,0,1]=4 4317 B12R1.405 CC(C)C1CCCCCC1NN Amb35734052 [0,1,0,1,0,0|2,0,0]=4 4318 B12R1.405 CC(C)C1CCCCCC1NO Amb29864626 [0,1,0,1,0,0|1,0,1]=4 4319 B12R1.405 CC(C)N1CCCCCC1C=O Amb27211231 [0,1,0,1,0,0|1,0,0]=3 4320 B12R1.405 CCC1CCCCCC1C(C)Br Amb35721290 [0,1,0,1,0,0|1,0,1]=4 4321 B12R1.405 CCC1CCCCCC1C(C)Cl Amb35721288 [0,1,0,1,0,0|1,0,1]=4 4322 B12R1.405 CCC1CCCCCC1C(C)N Amb35671754 [0,1,0,1,0,0|1,0,1]=4 4323 B12R1.405 CCC1CCCCCC1C(C)O Amb35672751 [0,1,0,1,0,0|0,0,2]=4 4324 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(=O)O Amb18198539 [0,1,0,1,0,0|1,0,0]=3 4325 B12R1.405 CC[C@H]1NCCCC[C@@H]1C(=O)O Amb28247202 [0,1,0,1,0,0|1,0,0]=3 4326 B12R1.405 CNC1CCCCCC1C(N)=O Amb27833351 [0,1,0,1,0,0|1,0,0]=3 4327 B12R1.405 CO[C@H]1CCCCC[C@H]1C(=O)O Amb27489023 [0,1,0,1,0,0|1,0,0]=3 4328 B12R1.405 CS(=O)C1CCCCCC1CN Amb27181216 [0,1,0,1,0,0|2,0,0]=4 4329 B12R1.405 CSC1CCCCCC1C(=O)O Amb18967402 [0,1,0,1,0,0|1,0,0]=3 4330 B12R1.459 CC1(C)SCCC1CCCC=O Amb32725172 [0,1,0,1,0,0|1,0,0]=3 4331 B12R1.459 CC1(F)CCCC1CCN=C=O Amb28323322 [0,1,0,1,0,0|1,0,1]=4 4332 B12R1.522 CCNCCN1CCC1C(N)=O Amb33252130 [0,1,0,1,0,0|2,0,0]=4 4333 B12R1.522 CNCCCN1CCC1C(N)=O Amb33252131 [0,1,0,1,0,0|2,0,0]=4 4334 B12R1.522 NCCCCN1CCC1C(N)=O Amb33195366 [0,1,0,1,0,0|2,0,0]=4 4335 B12R1.906 CC1(N)CCCCCCCCC1 Amb28056747 [0,1,0,1,0,0|1,0,1]=4 4336 B12R1.1033 O=C1CCCCCCCC1(F)F Amb33328744 [0,1,0,1,0,0|1,0,0]=3 4337 B12R1.1335 CC(=N)N1CCCCCCCC1 Amb27607308 [0,1,0,1,0,0|2,0,0]=4 4338 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [0,1,0,1,0,0|1,0,0]=3 4339 B12R1.1335 NC(=S)N1CCCCCCCC1 Amb28282880 [0,1,0,1,0,0|1,1,0]=4 4340 B12R1.1335 O=C(Cl)N1CCCCCCCC1 Amb27802970 [0,1,0,1,0,0|1,0,0]=3 4341 B12R1.1335 O=C(O)C1=CCCCCCCC1 Amb28325718 [0,1,0,1,0,0|0,0,2]=4 4342 B12R1.1335 O=C(O)C1CCCCCCCN1 Amb27171757 [0,1,0,1,0,0|1,0,0]=3 4343 B12R1.1343 C=C(Br)CNC1CCCCCC1 Amb27478131 [0,1,0,1,0,0|2,0,0]=4 4344 B12R1.1343 C=C(Br)COC1CCCCCC1 Amb28206874 [0,1,0,1,0,0|2,0,0]=4 4345 B12R1.1343 C=C(C)CCN1CCCCCC1 Amb27955088 [0,1,0,1,0,0|2,0,0]=4 4346 B12R1.1343 C=C(Cl)CNC1CCCCCC1 Amb19077092 [0,1,0,1,0,0|2,0,0]=4 4347 B12R1.1343 CC(=N)NCC1CCCCCC1 Amb28193193 [0,1,0,1,0,0|2,0,0]=4 4348 B12R1.1343 CC(=O)CCC1CCCCCC1 Amb27468725 [0,1,0,1,0,0|0,0,0]=2 4349 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [0,1,0,1,0,0|1,0,0]=3 4350 B12R1.1343 CC(=O)CCN1CCCOCC1 Amb18806959 [0,1,0,1,0,0|2,0,0]=4 4351 B12R1.1343 CC(=O)NCC1CCCCCC1 Amb27208386 [0,1,0,1,0,0|1,0,0]=3 4352 B12R1.1343 CC(=O)NCC1CCCCCN1 Amb33038736 [0,1,0,1,0,0|2,0,0]=4 4353 B12R1.1343 CC(=O)NCC1CCCCNC1 Amb26605896 [0,1,0,1,0,0|2,0,0]=4 4354 B12R1.1343 CC(=O)NCC1CCCSCC1 Amb29883281 [0,1,0,1,0,0|2,0,0]=4 4355 B12R1.1343 CC(=O)\C=C\C1CCCCCC1 Amb27968526 [0,1,0,1,0,0|0,0,2]=4 4356 B12R1.1343 CC(Cl)CCC1CCCCCC1 Amb27436680 [0,1,0,1,0,0|1,0,1]=4 4357 B12R1.1343 CC(N)CCC1CCCCCC1 Amb25115183 [0,1,0,1,0,0|1,0,1]=4 4358 B12R1.1343 CC(O)CCC1CCCCCC1 Amb26370751 [0,1,0,1,0,0|0,0,2]=4 4359 B12R1.1343 CC(O)CCC1CCCCNC1 Amb27654832 [0,1,0,1,0,0|2,0,0]=4 4360 B12R1.1343 C[C@@H](N)CCC1CCCCCC1 Amb33267870 [0,1,0,1,0,0|1,0,1]=4 4361 B12R1.1343 C[C@@H](O)CCC1CCCCCC1 Amb33267286 [0,1,0,1,0,0|0,0,2]=4 4362 B12R1.1343 C[C@H](N)CCC1CCCCCC1 Amb33224813 [0,1,0,1,0,0|1,0,1]=4 4363 B12R1.1343 C[C@H](O)CCC1CCCCCC1 Amb33267288 [0,1,0,1,0,0|0,0,2]=4 4364 B12R1.1343 N=C(N)CCN1CCCCCC1 Amb6256920 [0,1,0,1,0,0|2,0,0]=4 4365 B12R1.1343 N=C(N)NCC1CCCCCC1 Amb27983875 [0,1,0,1,0,0|2,0,0]=4 4366 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb17142920 [0,1,0,1,0,0|1,0,0]=3 4367 B12R1.1343 NC(=O)CNC1CCCCCC1 Amb1114001 [0,1,0,1,0,0|1,0,0]=3 4368 B12R1.1343 NC(=O)CNC1CCCSCC1 Amb29860743 [0,1,0,1,0,0|2,0,0]=4 4369 B12R1.1343 NC(=O)COC1CCCNCC1 Amb35723364 [0,1,0,1,0,0|2,0,0]=4 4370 B12R1.1343 NC(=O)CSC1CCCNCC1 Amb35672460 [0,1,0,1,0,0|2,0,0]=4 4371 B12R1.1343 NC(=O)NCC1CCCSCC1 Amb30030704 [0,1,0,1,0,0|2,0,0]=4 4372 B12R1.1343 NC(=O)OCC1CCCCNC1 Amb35647544 [0,1,0,1,0,0|2,0,0]=4 4373 B12R1.1343 NC(=S)CCN1CCCCCC1 Amb6266789 [0,1,0,1,0,0|1,1,0]=4 4374 B12R1.1343 NC(=S)COC1CCCCCC1 Amb19059515 [0,1,0,1,0,0|1,1,0]=4 4375 B12R1.1343 NC(=S)NCC1CCCCCC1 Amb28193224 [0,1,0,1,0,0|1,1,0]=4 4376 B12R1.1343 O=C(Cl)NCC1CCCCCC1 Amb35625593 [0,1,0,1,0,0|1,0,0]=3 4377 B12R1.1343 O=C(Cl)NCC1CCCSCC1 Amb35627018 [0,1,0,1,0,0|2,0,0]=4 4378 B12R1.1343 O=C(O)C#CC1CCCCCC1 Amb24556561 [0,1,0,1,0,0|0,0,2]=4 4379 B12R1.1343 O=C(O)CCC1CCCCCC1 Amb18825578 [0,1,0,1,0,0|0,0,0]=2 4380 B12R1.1343 O=C(O)CCC1CCCCCN1 Amb18198528 [0,1,0,1,0,0|1,0,0]=3 4381 B12R1.1343 O=C(O)CCC1CCCNCC1 Amb18198557 [0,1,0,1,0,0|1,0,0]=3 4382 B12R1.1343 O=C(O)CCC1CCCOCC1 Amb18825358 [0,1,0,1,0,0|1,0,0]=3 4383 B12R1.1343 O=C(O)CCC1CCCSCC1 Amb18820668 [0,1,0,1,0,0|1,0,0]=3 4384 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb2721891 [0,1,0,1,0,0|1,0,0]=3 4385 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb33552757 [0,1,0,1,0,0|1,0,0]=3 4386 B12R1.1343 O=C(O)CCN1CCCNCC1 Amb2699587 [0,1,0,1,0,0|2,0,0]=4 4387 B12R1.1343 O=C(O)CCN1CCCSCC1 Amb18977928 [0,1,0,1,0,0|2,0,0]=4 4388 B12R1.1343 O=C(O)CNC1CCCCCC1 Amb8428138 [0,1,0,1,0,0|1,0,0]=3 4389 B12R1.1343 O=C(O)CNC1CCCNCC1 Amb27449632 [0,1,0,1,0,0|2,0,0]=4 4390 B12R1.1343 O=C(O)CNC1CCCSCC1 Amb35700457 [0,1,0,1,0,0|2,0,0]=4 4391 B12R1.1343 O=C(O)COC1CCCCCC1 Amb18972071 [0,1,0,1,0,0|1,0,0]=3 4392 B12R1.1343 O=C(O)\C=C\C1CCCCCC1 Amb24715822 [0,1,0,1,0,0|0,0,2]=4 4393 B12R1.1343 O=[N+]([O-])CCC1CCCCCC1 Amb33268613 [0,1,0,1,0,0|1,0,0]=3 4394 B12R1.1392 CC(=O)C=C1CCCCCCC1 Amb28253982 [0,1,0,1,0,0|0,0,2]=4 4395 B12R1.1392 CC(=O)CC1CCCCCCN1 Amb27395289 [0,1,0,1,0,0|1,0,0]=3 4396 B12R1.1392 CC(=O)NC1CCCCCCC1 Amb5797421 [0,1,0,1,0,0|1,0,0]=3 4397 B12R1.1392 CC(=O)NC1CCCCCNC1 Amb32659965 [0,1,0,1,0,0|2,0,0]=4 4398 B12R1.1392 CC(=O)OC1CCCCCCC1 Amb4016350 [0,1,0,1,0,0|1,0,0]=3 4399 B12R1.1392 CC(O)CC1CCCCCCN1 Amb28041807 [0,1,0,1,0,0|1,0,1]=4 4400 B12R1.1392 CN(C)CC1CCCCCCC1 Amb27973635 [0,1,0,1,0,0|2,0,0]=4 4401 B12R1.1392 N=C(N)CN1CCCCCCC1 Amb6750450 [0,1,0,1,0,0|2,0,0]=4 4402 B12R1.1392 N=C(N)NC1CCCCCCC1 Amb18801546 [0,1,0,1,0,0|2,0,0]=4 4403 B12R1.1392 O=C(Cl)NC1CCCCCCC1 Amb35637075 [0,1,0,1,0,0|1,0,0]=3 4404 B12R1.1392 O=C(Cl)OC1CCCCCCC1 Amb27480779 [0,1,0,1,0,0|1,0,0]=3 4405 B12R1.1392 O=C(O)C=C1CCCCCCC1 Amb6749166 [0,1,0,1,0,0|0,0,2]=4 4406 B12R1.1392 O=C(O)CC1CCCCCCC1 Amb6749259 [0,1,0,1,0,0|0,0,0]=2 4407 B12R1.1392 O=C(O)CC1CCCCCCO1 Amb27634953 [0,1,0,1,0,0|1,0,0]=3 4408 B12R1.1392 O=C(O)CN1CCCCCCC1 Amb6613276 [0,1,0,1,0,0|1,0,0]=3 4409 B12R1.1392 O=C(O)C[C@H]1CCCCCCN1 Amb27985858 [0,1,0,1,0,0|1,0,0]=3 4410 B12R1.1755 CCCCCC[C@@H]1C[C@H]1C(=O)O Amb33098453 [0,1,0,1,0,0|0,0,0]=2 4411 B12R1.1755 CCCCCC[C@H]1C[C@H]1C(=O)O Amb33098421 [0,1,0,1,0,0|0,0,0]=2 4412 B12R2.2 C1CCC(C2CCCC2)CC1 Amb22230461 [0,0,0,2,0,0|1,0,1]=4 4413 B12R2.2 C1CCC(C2CCCC2)NC1 Amb2237219 [0,0,0,2,0,0|1,0,1]=4 4414 B12R2.2 C1CCC(C2CCCN2)CC1 Amb9711881 [0,0,0,2,0,0|1,0,1]=4 4415 B12R2.2 C1CCC(C2CCCNC2)C1 Amb18200886 [0,0,0,2,0,0|2,0,0]=4 4416 B12R2.2 C1CCC(C2CCCNC2)C1 Amb29083229 [0,0,0,2,0,0|2,0,0]=4 4417 B12R2.2 C1CCC(C2CCNC2)CC1 Amb33546720 [0,0,0,2,0,0|2,0,0]=4 4418 B12R2.2 C1CCC(C2CCNC2)CC1 Amb6356134 [0,0,0,2,0,0|2,0,0]=4 4419 B12R2.4 BrCC1CCCC12CCCC2 Amb24723376 [0,0,0,2,0,0|1,0,1]=4 4420 B12R2.4 ClCC1CCCC12CCCC2 Amb25944569 [0,0,0,2,0,0|1,0,1]=4 4421 B12R2.4 NCC1CCCC12CCCC2 Amb26877681 [0,0,0,2,0,0|1,0,1]=4 4422 B12R2.4 O=CC1CCOC12CCCC2 Amb27643527 [0,0,0,2,0,0|1,0,0]=3 4423 B12R2.4 OCC1CCCC12CCCC2 Amb25846971 [0,0,0,2,0,0|0,0,2]=4 4424 B12R2.7 C=C1CCCCC12CCCC2 Amb27840368 [0,0,0,2,0,0|1,0,0]=3 4425 B12R2.7 NC1CCCCC12CCCC2 Amb25893022 [0,0,0,2,0,0|1,0,1]=4 4426 B12R2.7 O=C1CCCCC12CCCC2 Amb16186573 [0,0,0,2,0,0|0,0,0]=2 4427 B12R2.7 O=C1CCCCC12CCCO2 Amb24361053 [0,0,0,2,0,0|1,0,0]=3 4428 B12R2.7 O=C1CCCCC12CCNC2 Amb18200976 [0,0,0,2,0,0|1,0,0]=3 4429 B12R2.7 O=C1CCCCC12SCCS2 Amb3430427 [0,0,0,2,0,0|2,0,0]=4 4430 B12R2.7 O=C1CCCOC12CCCC2 Amb25767581 [0,0,0,2,0,0|1,0,0]=3 4431 B12R2.7 O=C1CCCOC12CCOC2 Amb33620856 [0,0,0,2,0,0|2,0,0]=4 4432 B12R2.7 O=C1CCNCC12CCCC2 Amb18831092 [0,0,0,2,0,0|1,0,0]=3 4433 B12R2.7 O=C1CCNCC12CCOC2 Amb18200448 [0,0,0,2,0,0|2,0,0]=4 4434 B12R2.7 O=C1CCNCC12CCSC2 Amb18198494 [0,0,0,2,0,0|2,0,0]=4 4435 B12R2.7 O=C1CCOCC12CCCC2 Amb18200741 [0,0,0,2,0,0|1,0,0]=3 4436 B12R2.7 O=C1CCOCC12CCNC2 Amb18200462 [0,0,0,2,0,0|2,0,0]=4 4437 B12R2.7 O=C1CCSCC12CCNC2 Amb18198495 [0,0,0,2,0,0|2,0,0]=4 4438 B12R2.7 O=C1COCCC12CCNC2 Amb18200463 [0,0,0,2,0,0|2,0,0]=4 4439 B12R2.7 O=C1CSCCC12CCNC2 Amb18198496 [0,0,0,2,0,0|2,0,0]=4 4440 B12R2.7 O=C1NCCCC12CCCC2 Amb15701513 [0,0,0,2,0,0|1,0,0]=3 4441 B12R2.7 O=C1NCCCC12CCCN2 Amb18125784 [0,0,0,2,0,0|2,0,0]=4 4442 B12R2.7 O=C1NCCCC12CCCN2 Amb33716952 [0,0,0,2,0,0|2,0,0]=4 4443 B12R2.7 O=C1NCCCC12CCNC2 Amb28421908 [0,0,0,2,0,0|2,0,0]=4 4444 B12R2.7 O=C1NCCCC12CCNC2 Amb31156294 [0,0,0,2,0,0|2,0,0]=4 4445 B12R2.7 O=C1NCCCC12CCOC2 Amb26571809 [0,0,0,2,0,0|2,0,0]=4 4446 B12R2.7 O=C1NCCC[C@]12CCCN2 Amb27257960 [0,0,0,2,0,0|2,0,0]=4 4447 B12R2.7 O=C1NCCNC12CCCC2 Amb10083832 [0,0,0,2,0,0|2,0,0]=4 4448 B12R2.7 O=C1NCCNC12CCCC2 Amb32410136 [0,0,0,2,0,0|2,0,0]=4 4449 B12R2.7 O=C1NCCOC12CCCC2 Amb23455543 [0,0,0,2,0,0|2,0,0]=4 4450 B12R2.7 O=C1OCCCC12CCCN2 Amb27792977 [0,0,0,2,0,0|2,0,0]=4 4451 B12R2.7 O=C1OCCC[C@]12CCCN2 Amb27258970 [0,0,0,2,0,0|2,0,0]=4 4452 B12R2.7 O=C1OCCNC12CCCC2 Amb5781663 [0,0,0,2,0,0|2,0,0]=4 4453 B12R2.7 SC1CCCCC12CCCC2 Amb27176658 [0,0,0,2,0,0|0,1,1]=4 4454 B12R2.10 CN1CCCC1C2CCCC2 Amb27485655 [0,0,0,2,0,0|2,0,0]=4 4455 B12R2.10 NC1CCCC1C2CCCC2 Amb18280255 [0,0,0,2,0,0|1,0,1]=4 4456 B12R2.10 NN1CCCC1C2CCCC2 Amb24380481 [0,0,0,2,0,0|2,0,0]=4 4457 B12R2.10 N[C@H]1CCC[C@@H]1C2CCCC2 Amb28058948 [0,0,0,2,0,0|1,0,1]=4 4458 B12R2.10 O=C1CCCC1=C2CCCC2 Amb612816 [0,0,0,2,0,0|0,0,2]=4 4459 B12R2.10 O=C1CCCC1C2CCCC2 Amb3907631 [0,0,0,2,0,0|0,0,0]=2 4460 B12R2.10 O=C1CCCC1C2CCCN2 Amb22157196 [0,0,0,2,0,0|1,0,0]=3 4461 B12R2.10 O=C1CCCC1C2CCCN2 Amb32701574 [0,0,0,2,0,0|1,0,0]=3 4462 B12R2.10 O=C1CCCC1C2CCSC2 Amb35697105 [0,0,0,2,0,0|1,0,0]=3 4463 B12R2.10 O=C1CCCC1C2OCCO2 Amb25370789 [0,0,0,2,0,0|2,0,0]=4 4464 B12R2.10 O=C1CCCC1C2SCCS2 Amb27852274 [0,0,0,2,0,0|2,0,0]=4 4465 B12R2.10 O=C1CCCN1C2CCNC2 Amb27838180 [0,0,0,2,0,0|2,0,0]=4 4466 B12R2.10 O=C1CCCN1C2CCNC2 Amb30584626 [0,0,0,2,0,0|2,0,0]=4 4467 B12R2.10 O=C1CCCN1[C@H]2CCNC2 Amb28048312 [0,0,0,2,0,0|2,0,0]=4 4468 B12R2.10 O=C1CCC[C@H]1C2CCCC2 Amb27823646 [0,0,0,2,0,0|0,0,0]=2 4469 B12R2.10 O=C1CNCN1C2CCCC2 Amb26366126 [0,0,0,2,0,0|2,0,0]=4 4470 B12R2.10 O=C1COCC1C2CCCC2 Amb35639033 [0,0,0,2,0,0|1,0,0]=3 4471 B12R2.10 O=C1CSCC1C2CCCC2 Amb27758429 [0,0,0,2,0,0|1,0,0]=3 4472 B12R2.10 O=C1CSCC1C2CCSC2 Amb35697111 [0,0,0,2,0,0|2,0,0]=4 4473 B12R2.10 O=C1NCCC1C2CCCC2 Amb28289229 [0,0,0,2,0,0|1,0,0]=3 4474 B12R2.10 O=C1NCCC1C2CCOC2 Amb28313284 [0,0,0,2,0,0|2,0,0]=4 4475 B12R2.10 O=C1NCCC1C2CCSC2 Amb35711404 [0,0,0,2,0,0|2,0,0]=4 4476 B12R2.10 O=C1NCCN1C2CCCC2 Amb26323524 [0,0,0,2,0,0|2,0,0]=4 4477 B12R2.10 OC1CCCC1C2CCCC2 Amb18796798 [0,0,0,2,0,0|0,0,2]=4 4478 B12R2.10 O[C@@H]1CCC[C@H]1C2CCCC2 Amb27849769 [0,0,0,2,0,0|0,0,2]=4 4479 B12R2.12 CC1CCC1NC2C=CCC2 Amb30006693 [0,0,0,2,0,0|2,0,0]=4 4480 B12R2.12 NC1CCC1CC2CCCC2 Amb27478684 [0,0,0,2,0,0|1,0,1]=4 4481 B12R2.12 O=C1CCN1CC2CCCN2 Amb27225034 [0,0,0,2,0,0|2,0,0]=4 4482 B12R2.12 O=C1CCN1CC2CCNC2 Amb27438559 [0,0,0,2,0,0|2,0,0]=4 4483 B12R2.12 OC1CCC1CC2CCCC2 Amb32944652 [0,0,0,2,0,0|0,0,2]=4 4484 B12R2.15 CNCC1CCC12CCCC2 Amb30025746 [0,0,0,2,0,0|2,0,0]=4 4485 B12R2.15 NCCC1CCC12CCCC2 Amb35619515 [0,0,0,2,0,0|1,0,1]=4 4486 B12R2.15 O=C=NC1CCC12CCCC2 Amb30025781 [0,0,0,2,0,0|1,0,1]=4 4487 B12R2.15 O=CNC1CCC12CCCC2 Amb30026107 [0,0,0,2,0,0|1,0,0]=3 4488 B12R2.20 NC1CC1CCC2CCCC2 Amb33374581 [0,0,0,2,0,0|1,0,1]=4 4489 B12R2.20 N[C@@H]1C[C@H]1CCC2CCCC2 Amb33374582 [0,0,0,2,0,0|1,0,1]=4 4490 B12R2.25 C=CCNC1CC12CCCC2 Amb27785558 [0,0,0,2,0,0|2,0,0]=4 4491 B12R2.25 O=CCCC1CC12CCCC2 Amb27849175 [0,0,0,2,0,0|0,0,0]=2 4492 B12R2.33 NCC1CC1CC2CCCC2 Amb24615983 [0,0,0,2,0,0|1,0,1]=4 4493 B12R2.33 NC[C@@H]1C[C@H]1CC2CCCC2 Amb33378859 [0,0,0,2,0,0|1,0,1]=4 4494 B12R2.98 C1=CC(CC2CCCC2)NC1 Amb27458109 [0,0,0,2,0,0|2,0,0]=4 4495 B12R2.98 C1=CC(CC2CCNC2)CC1 Amb27839807 [0,0,0,2,0,0|2,0,0]=4 4496 B12R2.98 C1=CC(NC2CCCC2)CC1 Amb35629789 [0,0,0,2,0,0|2,0,0]=4 4497 B12R2.98 C1=CCC(CC2CCCC2)C1 Amb29888134 [0,0,0,2,0,0|1,0,1]=4 4498 B12R2.98 C1CCC(CC2CCCN2)C1 Amb32665334 [0,0,0,2,0,0|1,0,1]=4 4499 B12R2.98 C1CCC(CC2CCCN2)C1 Amb6248066 [0,0,0,2,0,0|1,0,1]=4 4500 B12R2.98 C1CCC(CC2CCNC2)C1 Amb33212370 [0,0,0,2,0,0|2,0,0]=4 4501 B12R2.144 C=CCN1CCC2CCCC21 Amb27198290 [0,0,0,2,0,0|2,0,0]=4 4502 B12R2.144 NCCC1CCC2CCCC12 Amb27872206 [0,0,0,2,0,0|1,0,1]=4 4503 B12R2.144 O=CC[C@H]1C=C[C@@H]2CCC[C@H]12 Amb27854283 [0,0,0,2,0,0|0,0,2]=4 4504 B12R2.144 O=CNC1CCN2CCCC12 Amb27867036 [0,0,0,2,0,0|2,0,0]=4 4505 B12R2.144 O=COC1CCC2CCCC21 Amb26910225 [0,0,0,2,0,0|1,0,0]=3 4506 B12R2.229 NC1CCCC[C@H]2CCC[C@H]12 Amb27781515 [0,0,0,2,0,0|1,0,1]=4 4507 B12R2.229 O=C1C=CCC[C@@H]2CCCC12 Amb27227133 [0,0,0,2,0,0|0,0,2]=4 4508 B12R2.229 O=C1CCCCC2NCCC12 Amb27206471 [0,0,0,2,0,0|1,0,0]=3 4509 B12R2.229 O=C1CCCCN2CCCC12 Amb26853749 [0,0,0,2,0,0|1,0,0]=3 4510 B12R2.229 O=C1CCCNC2COCC12 Amb27962396 [0,0,0,2,0,0|2,0,0]=4 4511 B12R2.229 O=C1CCNCC2CCCN12 Amb24438731 [0,0,0,2,0,0|2,0,0]=4 4512 B12R2.229 O=C1NCCCC2CCCC12 Amb25046678 [0,0,0,2,0,0|1,0,0]=3 4513 B12R2.229 O=C1NCCCC2CNCC12 Amb32410414 [0,0,0,2,0,0|2,0,0]=4 4514 B12R2.229 O=C1NCCCC2NCCC12 Amb33041082 [0,0,0,2,0,0|2,0,0]=4 4515 B12R2.229 O=C1NCCCC2OCCC12 Amb33041076 [0,0,0,2,0,0|2,0,0]=4 4516 B12R2.229 O=C1NCCCN2CCCC12 Amb13951606 [0,0,0,2,0,0|2,0,0]=4 4517 B12R2.229 O=C1NCCC[C@@H]2CCC[C@H]12 Amb27767881 [0,0,0,2,0,0|1,0,0]=3 4518 B12R2.229 O=C1NCCC[C@H]2CCC[C@@H]12 Amb25248002 [0,0,0,2,0,0|1,0,0]=3 4519 B12R2.229 O[C@@H]1CCCC[C@@H]2CCC[C@H]12 Amb28350092 [0,0,0,2,0,0|0,0,2]=4 4520 B12R2.286 C=CCCN1CC2CCCC21 Amb27176732 [0,0,0,2,0,0|2,0,0]=4 4521 B12R2.315 CCC1CNCC2CCCC12 Amb27597599 [0,0,0,2,0,0|2,0,0]=4 4522 B12R2.315 O=CC1CC=CC2CCCC12 Amb27646493 [0,0,0,2,0,0|0,0,2]=4 4523 B12R2.315 O=CC1CCCN2CCCC12 Amb27872342 [0,0,0,2,0,0|1,0,0]=3 4524 B12R2.315 O=CN1CCCC2CCCC21 Amb27667322 [0,0,0,2,0,0|1,0,0]=3 4525 B12R2.315 O=CN1CCCC2COCC21 Amb29872464 [0,0,0,2,0,0|2,0,0]=4 4526 B12R2.315 O=C[C@@H]1CC=C[C@H]2CCC[C@H]21 Amb28066528 [0,0,0,2,0,0|0,0,2]=4 4527 B12R2.315 O=C[C@H]1CC=C[C@H]2CCC[C@H]12 Amb26386046 [0,0,0,2,0,0|0,0,2]=4 4528 B12R2.315 O=C[C@H]1CCCN2CCC[C@@H]12 Amb27420179 [0,0,0,2,0,0|1,0,0]=3 4529 B12R2.315 O=C[C@H]1CCCN2CCC[C@H]12 Amb28199928 [0,0,0,2,0,0|1,0,0]=3 4530 B12R2.315 OC[C@@H]1CCC[C@@H]2CCC[C@@H]21 Amb27422224 [0,0,0,2,0,0|0,0,2]=4 4531 B12R2.315 OC[C@H]1CCC[C@@H]2CCC[C@H]12 Amb27981754 [0,0,0,2,0,0|0,0,2]=4 4532 B12R2.315 OC[C@H]1CCC[C@H]2CCC[C@H]12 Amb27790377 [0,0,0,2,0,0|0,0,2]=4 4533 B12R2.382 C1CCCC2CNCC2CC1 Amb25995070 [0,0,0,2,0,0|1,0,1]=4 4534 B12R2.382 C1CCCC2CNCC2CC1 Amb33621088 [0,0,0,2,0,0|1,0,1]=4 4535 B12R2.2056 C1=CC(NCC2CCC2)CC1 Amb30006694 [0,0,0,2,0,0|2,0,0]=4 4536 B12R2.2056 C1CCC(CCC2CCN2)C1 Amb33374571 [0,0,0,2,0,0|1,0,1]=4 4537 B12R2.2056 C1CCC(CCC2CNC2)C1 Amb26879765 [0,0,0,2,0,0|2,0,0]=4 4538 B12R2.2336 BrCCCC1CC2C=CC1C2 Amb33477240 [0,0,0,2,0,0|2,0,0]=4 4539 B12R2.2336 BrCCCC1CC2CCC1C2 Amb25866014 [0,0,0,2,0,0|1,0,1]=4 4540 B12R2.2336 C#CCCC1CC2CCC1C2 Amb33148767 [0,0,0,2,0,0|1,0,1]=4 4541 B12R2.2336 C=CCCN1CC2CCC1C2 Amb28065630 [0,0,0,2,0,0|2,0,0]=4 4542 B12R2.2336 CCCNC1CC2C=CC1C2 Amb35588976 [0,0,0,2,0,0|2,0,0]=4 4543 B12R2.2336 CCCNC1C[C@H]2C=C[C@@H]1C2 Amb35639547 [0,0,0,2,0,0|2,0,0]=4 4544 B12R2.2336 CCNC[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb27633923 [0,0,0,2,0,0|2,0,0]=4 4545 B12R2.2336 CNCCC1CC2C=CC1C2 Amb33223728 [0,0,0,2,0,0|2,0,0]=4 4546 B12R2.2336 CNCCC1CC2CCC1C2 Amb8853681 [0,0,0,2,0,0|2,0,0]=4 4547 B12R2.2336 ClCCCC1CC2CCC1C2 Amb28347514 [0,0,0,2,0,0|1,0,1]=4 4548 B12R2.2336 N#CCCC1CC2CCC1C2 Amb24563302 [0,0,0,2,0,0|1,0,1]=4 4549 B12R2.2336 NCCCC1CC2C=CC1C2 Amb33374720 [0,0,0,2,0,0|2,0,0]=4 4550 B12R2.2336 NCCCC1CC2CCC1C2 Amb25680255 [0,0,0,2,0,0|1,0,1]=4 4551 B12R2.2336 NOCCC1CC2CCC1C2 Amb33143348 [0,0,0,2,0,0|2,0,0]=4 4552 B12R2.2336 O=C=NCC1CC2CCC1C2 Amb6278443 [0,0,0,2,0,0|1,0,1]=4 4553 B12R2.2336 O=CC#CC1CC2CCC1C2 Amb24334795 [0,0,0,2,0,0|0,0,2]=4 4554 B12R2.2336 O=CCCC1CC2C=CC1C2 Amb31296664 [0,0,0,2,0,0|0,0,2]=4 4555 B12R2.2336 O=CCCC1CC2CCC1C2 Amb26371105 [0,0,0,2,0,0|0,0,0]=2 4556 B12R2.2336 O=CCCC1CC2CCC1O2 Amb32874088 [0,0,0,2,0,0|1,0,0]=3 4557 B12R2.2336 O=CCCN1CC2CC1CS2 Amb27666177 [0,0,0,2,0,0|2,0,0]=4 4558 B12R2.2336 O=CNCC1CC2CCC1C2 Amb28365457 [0,0,0,2,0,0|1,0,0]=3 4559 B12R2.2336 O=CNCC1CC2CCC1O2 Amb27413978 [0,0,0,2,0,0|2,0,0]=4 4560 B12R2.2336 O=C\C=C\C1CC2CCC1C2 Amb33225592 [0,0,0,2,0,0|0,0,2]=4 4561 B12R2.2336 OCCCC1CC2C=CC1C2 Amb25149606 [0,0,0,2,0,0|2,0,0]=4 4562 B12R2.2336 OCCCC1CC2CCC1C2 Amb28458174 [0,0,0,2,0,0|0,0,2]=4 4563 B12R2.2336 OCCC[C@H]1C[C@H]2C=C[C@H]1C2 Amb27651738 [0,0,0,2,0,0|2,0,0]=4 4564 B12R2.2336 OCCC[C@H]1C[C@H]2CC[C@H]1C2 Amb27650430 [0,0,0,2,0,0|0,0,2]=4 4565 B12R2.2336 SCCCC1CC2C=CC1C2 Amb33378031 [0,0,0,2,0,0|2,0,0]=4 4566 B12R2.2336 SCCCC1CC2CCC1C2 Amb33148413 [0,0,0,2,0,0|0,1,1]=4 4567 B12R2.2336 [C-]#[N+]CCC1CC2CCC1C2 Amb33143678 [0,0,0,2,0,0|2,0,0]=4 4568 B12R2.2383 C1CCC(CCCC2CO2)C1 Amb26992711 [0,0,0,2,0,0|0,0,2]=4 4569 B12R2.4328 C1CCC2(CCCC2)CNC1 Amb25114830 [0,0,0,2,0,0|2,0,0]=4 4570 B12R2.4328 C1CCC2(CCCC2)CNC1 Amb33483729 [0,0,0,2,0,0|2,0,0]=4 4571 B12R2.4328 C1CCCC2(CC1)CCCN2 Amb26055030 [0,0,0,2,0,0|1,0,1]=4 4572 B12R2.4328 C1CCCC2(CC1)CCCN2 Amb32712077 [0,0,0,2,0,0|1,0,1]=4 4573 B12R2.4328 C1CCCC2(CC1)CCNC2 Amb16186663 [0,0,0,2,0,0|2,0,0]=4 4574 B12R2.4328 C1CCCC2(CC1)CCNC2 Amb32410138 [0,0,0,2,0,0|2,0,0]=4 4575 B12R2.4328 C1CCNC2(CC1)CCCC2 Amb32946826 [0,0,0,2,0,0|1,0,1]=4 4576 B12R2.41 C1=NC2CCCCCN2CC1 Amb27960550 [0,0,0,2,0,0|2,0,0]=4 4577 B12R2.41 C1=NCC2CCCCN2CC1 Amb25072842 [0,0,0,2,0,0|2,0,0]=4 4578 B12R2.41 C1CCC2=C(CC1)NCCC2 Amb27668830 [0,0,0,2,0,0|1,0,1]=4 4579 B12R2.41 C1CCC2=NCCCC2NC1 Amb27265796 [0,0,0,2,0,0|2,0,0]=4 4580 B12R2.41 C1CCC2=NCCCN2CC1 Amb582155 [0,0,0,2,0,0|2,0,0]=4 4581 B12R2.41 C1CCC2CCCCC2NC1 Amb25997083 [0,0,0,2,0,0|1,0,1]=4 4582 B12R2.41 C1CCC2CCCCC2NC1 Amb28652851 [0,0,0,2,0,0|1,0,1]=4 4583 B12R2.41 C1CCC2CCNCC2CC1 Amb27455041 [0,0,0,2,0,0|1,0,1]=4 4584 B12R2.41 C1CCC2CCNCC2CC1 Amb33465451 [0,0,0,2,0,0|1,0,1]=4 4585 B12R2.41 C1CCC2CCNCCC2C1 Amb27446599 [0,0,0,2,0,0|1,0,1]=4 4586 B12R2.41 C1CCN2CCCCC2=NC1 Amb16184886 [0,0,0,2,0,0|2,0,0]=4 4587 B12R2.41 C1CC[C@@H]2CCNC[C@@H]2CC1 Amb27441724 [0,0,0,2,0,0|1,0,1]=4 4588 B12R2.124 O=C1CCC2CCC1CC2O Amb28349154 [0,0,0,2,0,0|1,0,0]=3 4589 B12R2.124 O=C1OC2CCC1CCC2O Amb27603946 [0,0,0,2,0,0|2,0,0]=4 4590 B12R2.127 O=C1CCC2CCCC1CC2 Amb27401639 [0,0,0,2,0,0|0,0,0]=2 4591 B12R2.127 O=C1CC[C@@H]2CCC[C@H]1CC2 Amb27789304 [0,0,0,2,0,0|0,0,0]=2 4592 B12R2.127 OC1CCC2CCCC1CC2 Amb27653056 [0,0,0,2,0,0|0,0,2]=4 4593 B12R2.127 O[C@@H]1CC[C@H]2CCC[C@@H]1CC2 Amb27457961 [0,0,0,2,0,0|0,0,2]=4 4594 B12R2.192 CC1CC2CC2CC1CC#N Amb33230265 [0,0,0,2,0,0|1,0,1]=4 4595 B12R2.192 CNCC1CC2CC2CC1C Amb33230261 [0,0,0,2,0,0|2,0,0]=4 4596 B12R2.210 O=C1CCCCCC1C2CC2 Amb27594090 [0,0,0,2,0,0|0,0,0]=2 4597 B12R2.210 O=C1CCNCCN1C2CC2 Amb25266056 [0,0,0,2,0,0|2,0,0]=4 4598 B12R2.210 O=C1CNCCCN1C2CC2 Amb26373348 [0,0,0,2,0,0|2,0,0]=4 4599 B12R2.210 OC1CCCCCC1C2CC2 Amb25795651 [0,0,0,2,0,0|0,0,2]=4 4600 B12R2.210 O[C@@H]1CCCCC[C@H]1C2CC2 Amb33213583 [0,0,0,2,0,0|0,0,2]=4 4601 B12R2.214 O=C1C[C@H]2CCC[C@H]1CC2=O Amb27212488 [0,0,0,2,0,0|1,0,1]=4 4602 B12R2.455 O=C1CCC[C@H]2CCC[C@@H]1C2 Amb27781976 [0,0,0,2,0,0|0,0,0]=2 4603 B12R2.455 O=C1CCNC2CCCN1C2 Amb33719111 [0,0,0,2,0,0|2,0,0]=4 4604 B12R2.455 O=C1CNCC2CCCN1C2 Amb21927865 [0,0,0,2,0,0|2,0,0]=4 4605 B12R2.461 C=C1CCCCCC12CC2Br Amb28126591 [0,0,0,2,0,0|2,0,0]=4 4606 B12R2.461 C=C1CCCCCC12CC2Cl Amb27165749 [0,0,0,2,0,0|2,0,0]=4 4607 B12R2.461 CC1CCCCCC12CC2N Amb29858055 [0,0,0,2,0,0|1,0,1]=4 4608 B12R2.707 O=C1C2CCCCC1CNC2 Amb27765885 [0,0,0,2,0,0|1,0,0]=3 4609 B12R2.707 OC1C2CCCCC1CCC2 Amb27977908 [0,0,0,2,0,0|0,0,2]=4 4610 B12R2.707 O[C@@H]1[C@@H]2C=CC[C@H]1CCCC2 Amb27213894 [0,0,0,2,0,0|2,0,0]=4 4611 B12R2.707 O[C@H]1[C@@H]2CC=C[C@H]1CCCC2 Amb27197934 [0,0,0,2,0,0|2,0,0]=4 4612 B12R2.996 C[C@@H]1C[C@H]2CCCC[C@H]1C2=O Amb27199188 [0,0,0,2,0,0|0,0,0]=2 4613 B12R2.1019 O=C1NC2CCCC1CCC2 Amb22364869 [0,0,0,2,0,0|1,0,0]=3 4614 B12R2.1019 O=C1NC2CCCC1CNC2 Amb6893904 [0,0,0,2,0,0|2,0,0]=4 4615 B12R2.1019 O=C1N[C@@H]2CCC[C@@H]1CNC2 Amb25139620 [0,0,0,2,0,0|2,0,0]=4 4616 B12R2.1019 O=C1N[C@H]2CCC[C@@H]1CNC2 Amb22757908 [0,0,0,2,0,0|2,0,0]=4 4617 B12R2.1019 O=C1N[C@H]2CCC[C@H]1CNC2 Amb23385287 [0,0,0,2,0,0|2,0,0]=4 4618 B12R2.1019 OC1CC2CCCC1CCC2 Amb27494930 [0,0,0,2,0,0|0,0,2]=4 4619 B12R2.1041 NC1CC2CCCCCC2C1 Amb33330789 [0,0,0,2,0,0|1,0,1]=4 4620 B12R2.1041 NC1CC2CCCCCC2C1 Amb33465482 [0,0,0,2,0,0|1,0,1]=4 4621 B12R2.1041 O=C1C=C2CCCCCC2C1 Amb26053092 [0,0,0,2,0,0|0,0,2]=4 4622 B12R2.1041 O=C1CC2CCCCCC2C1 Amb24486177 [0,0,0,2,0,0|0,0,0]=2 4623 B12R2.1041 O=C1CC2CCCCCN2C1 Amb27851753 [0,0,0,2,0,0|1,0,0]=3 4624 B12R2.1041 O=C1CC2NCCCCC2N1 Amb27839666 [0,0,0,2,0,0|2,0,0]=4 4625 B12R2.1041 O=C1C[C@@H]2CCCCC[C@@H]2N1 Amb28455139 [0,0,0,2,0,0|1,0,0]=3 4626 B12R2.1041 O=C1C[C@@H]2CCCNC[C@H]2N1 Amb18200726 [0,0,0,2,0,0|2,0,0]=4 4627 B12R2.1041 O=C1C[C@@H]2CCNCC[C@H]2N1 Amb18200725 [0,0,0,2,0,0|2,0,0]=4 4628 B12R2.1041 O=C1C[C@@H]2CCNCC[C@H]2O1 Amb30527443 [0,0,0,2,0,0|2,0,0]=4 4629 B12R2.1041 O=C1C[C@@H]2CNCCC[C@H]2N1 Amb18200729 [0,0,0,2,0,0|2,0,0]=4 4630 B12R2.1041 O=C1C[C@H]2CCCCC[C@@H]2N1 Amb27446186 [0,0,0,2,0,0|1,0,0]=3 4631 B12R2.1041 O=C1C[C@H]2OCCCC[C@H]2N1 Amb27459725 [0,0,0,2,0,0|2,0,0]=4 4632 B12R2.1041 O=C1NC2CCCCCC2S1 Amb28068684 [0,0,0,2,0,0|2,0,0]=4 4633 B12R2.1041 OC1CC2CCCCCC2C1 Amb27649351 [0,0,0,2,0,0|0,0,2]=4 4634 B12R2.1787 CNC1CC2CCCCCC21 Amb28365505 [0,0,0,2,0,0|2,0,0]=4 4635 B12R2.2284 CCC[C@@]12C=C[C@@H]1CCC2=O Amb28052538 [0,0,0,2,0,0|0,0,2]=4 4636 B12R2.2286 CCCC1C(=O)C2CCCC12 Amb28381257 [0,0,0,2,0,0|0,0,0]=2 4637 B12R2.2286 CCC[C@H]1C(=O)[C@@H]2CCC[C@H]12 Amb27970182 [0,0,0,2,0,0|0,0,0]=2 4638 B12R2.2286 CCO[C@@H]1C(=O)[C@@H]2CCC[C@H]12 Amb28386617 [0,0,0,2,0,0|1,0,0]=3 4639 B12R2.2286 O=C1C(CCCl)C2CCCC12 Amb27184095 [0,0,0,2,0,0|1,0,0]=3 4640 B12R2.2417 NC12CCCCCC1CCC2 Amb27184540 [0,0,0,2,0,0|1,0,1]=4 4641 B12R2.4800 CO[C@@H]1[C@H]2CC[C@@H]1C(=O)NC2 Amb27841238 [0,0,0,2,0,0|2,0,0]=4 4642 B12R2.5472 CC1CCCCCC12CCN2 Amb35671751 [0,0,0,2,0,0|1,0,1]=4 4643 B12R2.5472 O=C1NCCCCC12CCC2 Amb32992850 [0,0,0,2,0,0|1,0,0]=3 4644 B12R2.5472 O=C1NCCCCC12CNC2 Amb32862917 [0,0,0,2,0,0|2,0,0]=4 4645 B12R2.5472 O=C1NCCCNC12CCC2 Amb33098632 [0,0,0,2,0,0|2,0,0]=4 4646 B12R2.24 BrC1CC[C@@H]2CCCC[C@@H]2C1 Amb27624578 [0,0,0,2,0,0|1,0,1]=4 4647 B12R2.24 Br[C@@H]1CC[C@H]2CCCC[C@@H]2C1 Amb28287715 [0,0,0,2,0,0|1,0,1]=4 4648 B12R2.24 C=C1CN[C@@H]2CCCC[C@@H]2C1 Amb28458281 [0,0,0,2,0,0|2,0,0]=4 4649 B12R2.24 CC1CCC2CCCCC2N1 Amb18831050 [0,0,0,2,0,0|1,0,1]=4 4650 B12R2.24 CC1CCC2CCCCC2N1 Amb33734874 [0,0,0,2,0,0|1,0,1]=4 4651 B12R2.24 CC1CNC2CCCCC2C1 Amb25771949 [0,0,0,2,0,0|2,0,0]=4 4652 B12R2.24 CC1CNC2CCCCC2C1 Amb33743663 [0,0,0,2,0,0|2,0,0]=4 4653 B12R2.24 CN1CCC2CCCCC2C1 Amb24454101 [0,0,0,2,0,0|2,0,0]=4 4654 B12R2.24 C[C@@H]1C=C[C@H]2CCCC[C@H]2N1 Amb27423958 [0,0,0,2,0,0|2,0,0]=4 4655 B12R2.24 C[C@@H]1CC[C@@H]2CCCC[C@@H]2N1 Amb28385045 [0,0,0,2,0,0|1,0,1]=4 4656 B12R2.24 C[C@@H]1C[C@@H]2CCCC[C@H]2CN1 Amb27851424 [0,0,0,2,0,0|1,0,1]=4 4657 B12R2.24 C[C@H]1CC[C@H]2CCCC[C@H]2N1 Amb27870707 [0,0,0,2,0,0|1,0,1]=4 4658 B12R2.24 ClC1CC[C@@H]2CCCC[C@@H]2C1 Amb27659360 [0,0,0,2,0,0|1,0,1]=4 4659 B12R2.24 ClC1CC[C@H]2CCCC[C@@H]2C1 Amb28384111 [0,0,0,2,0,0|1,0,1]=4 4660 B12R2.24 Cl[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 Amb27983789 [0,0,0,2,0,0|1,0,1]=4 4661 B12R2.24 Cl[C@@H]1CC[C@H]2CCCC[C@@H]2C1 Amb28196729 [0,0,0,2,0,0|1,0,1]=4 4662 B12R2.24 Cl[C@H]1CC[C@@H]2CCCC[C@@H]2C1 Amb28051828 [0,0,0,2,0,0|1,0,1]=4 4663 B12R2.24 N=C1CC[C@@H]2CCCC[C@@H]2N1 Amb28060881 [0,0,0,2,0,0|2,0,0]=4 4664 B12R2.24 NC1CCC2CCCCC2C1 Amb448593 [0,0,0,2,0,0|1,0,1]=4 4665 B12R2.24 N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 Amb27776798 [0,0,0,2,0,0|1,0,1]=4 4666 B12R2.24 N[C@H]1CC[C@@H]2CCCC[C@@H]2C1 Amb27776799 [0,0,0,2,0,0|1,0,1]=4 4667 B12R2.24 O=C1C=C2CCCCC2CC1 Amb17593740 [0,0,0,2,0,0|0,0,2]=4 4668 B12R2.24 O=C1C=C2CCCC[C@@H]2CC1 Amb28074789 [0,0,0,2,0,0|0,0,2]=4 4669 B12R2.24 O=C1CC2CCCCC2CN1 Amb27600042 [0,0,0,2,0,0|1,0,0]=3 4670 B12R2.24 O=C1CC2CCCCC2NN1 Amb28460723 [0,0,0,2,0,0|2,0,0]=4 4671 B12R2.24 O=C1CC2NCCCC2CN1 Amb27470207 [0,0,0,2,0,0|2,0,0]=4 4672 B12R2.24 O=C1CCC2=C(CCCC2)C1 Amb17593744 [0,0,0,2,0,0|0,0,2]=4 4673 B12R2.24 O=C1CCC2CCCCC2C1 Amb2782888 [0,0,0,2,0,0|0,0,0]=2 4674 B12R2.24 O=C1CCC2CCCCC2O1 Amb3361282 [0,0,0,2,0,0|1,0,0]=3 4675 B12R2.24 O=C1CCC2CCCCN2C1 Amb27950553 [0,0,0,2,0,0|1,0,0]=3 4676 B12R2.24 O=C1CCC2CCCC[C@H]2C1 Amb28122431 [0,0,0,2,0,0|0,0,0]=2 4677 B12R2.24 O=C1CCC2CCCNC2C1 Amb18644586 [0,0,0,2,0,0|1,0,0]=3 4678 B12R2.24 O=C1CCC2CCCOC2C1 Amb27599499 [0,0,0,2,0,0|1,0,0]=3 4679 B12R2.24 O=C1CCC2CCNCC2N1 Amb27839692 [0,0,0,2,0,0|2,0,0]=4 4680 B12R2.24 O=C1CCC2CCSCC2N1 Amb28318107 [0,0,0,2,0,0|2,0,0]=4 4681 B12R2.24 O=C1CCC2CNCCC2N1 Amb13888807 [0,0,0,2,0,0|2,0,0]=4 4682 B12R2.24 O=C1CCC2CNCCC2N1 Amb33549631 [0,0,0,2,0,0|2,0,0]=4 4683 B12R2.24 O=C1CCC2COCCC2C1 Amb26423658 [0,0,0,2,0,0|1,0,0]=3 4684 B12R2.24 O=C1CCC2COCCC2N1 Amb27639153 [0,0,0,2,0,0|2,0,0]=4 4685 B12R2.24 O=C1CCC2CSCCC2N1 Amb28041501 [0,0,0,2,0,0|2,0,0]=4 4686 B12R2.24 O=C1CCC2NCCCC2C1 Amb27232951 [0,0,0,2,0,0|1,0,0]=3 4687 B12R2.24 O=C1CCN2CCCCC2C1 Amb17778369 [0,0,0,2,0,0|1,0,0]=3 4688 B12R2.24 O=C1CCN2CCOCC2C1 Amb18200451 [0,0,0,2,0,0|2,0,0]=4 4689 B12R2.24 O=C1CCN2CCSCC2C1 Amb18198490 [0,0,0,2,0,0|2,0,0]=4 4690 B12R2.24 O=C1CC[C@@H]2C=CCC[C@H]2C1 Amb27195823 [0,0,0,2,0,0|0,0,2]=4 4691 B12R2.24 O=C1CC[C@@H]2CCC=C[C@@H]2C1 Amb27260489 [0,0,0,2,0,0|0,0,2]=4 4692 B12R2.24 O=C1CC[C@@H]2CCCC[C@@H]2C1 Amb28246539 [0,0,0,2,0,0|0,0,0]=2 4693 B12R2.24 O=C1CC[C@@H]2CCCC[C@H]2C1 Amb17674190 [0,0,0,2,0,0|0,0,0]=2 4694 B12R2.24 O=C1CC[C@@H]2CCNC[C@H]2N1 Amb18200727 [0,0,0,2,0,0|2,0,0]=4 4695 B12R2.24 O=C1CC[C@@H]2CNCC[C@H]2N1 Amb18200730 [0,0,0,2,0,0|2,0,0]=4 4696 B12R2.24 O=C1CC[C@@H]2NCCC[C@H]2C1 Amb28457417 [0,0,0,2,0,0|1,0,0]=3 4697 B12R2.24 O=C1CC[C@H]2CCCC[C@H]2O1 Amb24590114 [0,0,0,2,0,0|1,0,0]=3 4698 B12R2.24 O=C1CC[C@H]2CNCC[C@@H]2C1 Amb27881809 [0,0,0,2,0,0|1,0,0]=3 4699 B12R2.24 O=C1CC[C@H]2CNCC[C@H]2N1 Amb27492957 [0,0,0,2,0,0|2,0,0]=4 4700 B12R2.24 O=C1CC[C@H]2COCC[C@@H]2C1 Amb27434232 [0,0,0,2,0,0|1,0,0]=3 4701 B12R2.24 O=C1CN2CCCCC2CN1 Amb32708548 [0,0,0,2,0,0|2,0,0]=4 4702 B12R2.24 O=C1CN2CCCC[C@H]2CN1 Amb25336412 [0,0,0,2,0,0|2,0,0]=4 4703 B12R2.24 O=C1CNC2CCCCC2N1 Amb9277175 [0,0,0,2,0,0|2,0,0]=4 4704 B12R2.24 O=C1CN[C@@H]2CCCC[C@@H]2N1 Amb25175818 [0,0,0,2,0,0|2,0,0]=4 4705 B12R2.24 O=C1CN[C@@H]2CCCC[C@H]2N1 Amb27851403 [0,0,0,2,0,0|2,0,0]=4 4706 B12R2.24 O=C1CN[C@H]2CCCC[C@@H]2C1 Amb27794443 [0,0,0,2,0,0|1,0,0]=3 4707 B12R2.24 O=C1CN[C@H]2CCCC[C@@H]2N1 Amb28246439 [0,0,0,2,0,0|2,0,0]=4 4708 B12R2.24 O=C1COC2CCCOC2C1 Amb26498086 [0,0,0,2,0,0|2,0,0]=4 4709 B12R2.24 O=C1CO[C@@H]2CCCO[C@@H]2C1 Amb24614776 [0,0,0,2,0,0|2,0,0]=4 4710 B12R2.24 O=C1CO[C@H]2CCCO[C@H]2C1 Amb32663802 [0,0,0,2,0,0|2,0,0]=4 4711 B12R2.24 O=C1NCC2CCCCC2O1 Amb27176513 [0,0,0,2,0,0|2,0,0]=4 4712 B12R2.24 O=C1NC[C@@H]2CCCC[C@@H]2O1 Amb27877099 [0,0,0,2,0,0|2,0,0]=4 4713 B12R2.24 O=C1N[C@@H]2CCCC[C@H]2CO1 Amb27431413 [0,0,0,2,0,0|2,0,0]=4 4714 B12R2.24 O=C1N[C@H]2CCCCC2CO1 Amb28251134 [0,0,0,2,0,0|2,0,0]=4 4715 B12R2.24 OC1C=C2CCCCC2CC1 Amb28067462 [0,0,0,2,0,0|2,0,0]=4 4716 B12R2.24 OC1CCC2CCCCC2C1 Amb765625 [0,0,0,2,0,0|0,0,2]=4 4717 B12R2.24 OC1CC[C@@H]2CCCC[C@H]2C1 Amb27781953 [0,0,0,2,0,0|0,0,2]=4 4718 B12R2.24 OC1CC[C@H]2CCCC[C@@H]2C1 Amb27422295 [0,0,0,2,0,0|0,0,2]=4 4719 B12R2.24 OC1CC[C@H]2CCCC[C@H]2C1 Amb26565110 [0,0,0,2,0,0|0,0,2]=4 4720 B12R2.24 O[C@@H]1C=C[C@H]2CCCC[C@@H]2C1 Amb28321550 [0,0,0,2,0,0|2,0,0]=4 4721 B12R2.24 O[C@@H]1CC[C@@H]2CCCC[C@H]2C1 Amb27198537 [0,0,0,2,0,0|0,0,2]=4 4722 B12R2.24 O[C@@H]1CC[C@H]2CCCC[C@H]2C1 Amb28205912 [0,0,0,2,0,0|0,0,2]=4 4723 B12R2.24 O[C@H]1C=C2CCCC[C@@H]2CC1 Amb27858028 [0,0,0,2,0,0|2,0,0]=4 4724 B12R2.24 O[C@H]1CC[C@H]2CCCC[C@@H]2C1 Amb24556449 [0,0,0,2,0,0|0,0,2]=4 4725 B12R2.24 S=C1C[C@H]2CCCC[C@@H]2CN1 Amb27845473 [0,0,0,2,0,0|1,1,0]=4 4726 B12R2.24 SC1CCC2CCCCC2C1 Amb32788105 [0,0,0,2,0,0|0,1,1]=4 4727 B12R2.32 CNC1CC2CCCCC2C1 Amb27665885 [0,0,0,2,0,0|2,0,0]=4 4728 B12R2.32 NCC1CC2CCCCC2C1 Amb18200892 [0,0,0,2,0,0|1,0,1]=4 4729 B12R2.32 O=CC1CC2CCCCC2C1 Amb27949662 [0,0,0,2,0,0|0,0,0]=2 4730 B12R2.32 O=CC1CC2CCCCN2O1 Amb18125866 [0,0,0,2,0,0|2,0,0]=4 4731 B12R2.32 O=CN1CC2CCCCC2C1 Amb27867137 [0,0,0,2,0,0|1,0,0]=3 4732 B12R2.32 O=CN1C[C@H]2CCCC[C@H]2C1 Amb27595443 [0,0,0,2,0,0|1,0,0]=3 4733 B12R2.32 O=C[C@@H]1C[C@H]2CCCCN2O1 Amb26546859 [0,0,0,2,0,0|2,0,0]=4 4734 B12R2.32 O=C[C@H]1C[C@@H]2OCCC[C@@H]2O1 Amb28142098 [0,0,0,2,0,0|2,0,0]=4 4735 B12R2.32 O=C[C@H]1C[C@H]2CCCCN2O1 Amb28200854 [0,0,0,2,0,0|2,0,0]=4 4736 B12R2.32 O=NN1CC2CCCCC2C1 Amb33482969 [0,0,0,2,0,0|2,0,0]=4 4737 B12R2.86 CC1CCC12NCCNC2=O Amb28365661 [0,0,0,2,0,0|2,0,0]=4 4738 B12R2.86 CC1CCCCC12CCC2=O Amb28460751 [0,0,0,2,0,0|0,0,0]=2 4739 B12R2.86 C[C@@H]1CCCC[C@@]12CCC2=O Amb27973006 [0,0,0,2,0,0|0,0,0]=2 4740 B12R2.115 CC1CC1N2CCCCC2=N Amb18181774 [0,0,0,2,0,0|2,0,0]=4 4741 B12R2.125 O=C1CCC2=CCCCC1C2 Amb27605515 [0,0,0,2,0,0|0,0,2]=4 4742 B12R2.125 O=C1CC[C@H]2CCCC[C@@H]1C2 Amb27440545 [0,0,0,2,0,0|0,0,0]=2 4743 B12R2.130 CC1=CCC2CC1CCC2=O Amb27599423 [0,0,0,2,0,0|0,0,2]=4 4744 B12R2.130 NC1CCN2CC1CCC2=O Amb33719114 [0,0,0,2,0,0|2,0,0]=4 4745 B12R2.130 O=C1CCC2CC1CCC2=O Amb1144596 [0,0,0,2,0,0|1,0,1]=4 4746 B12R2.130 O=C1CCC2OC1CCC2O Amb28461197 [0,0,0,2,0,0|2,0,0]=4 4747 B12R2.130 O=C1CC[C@@H]2C[C@H]1CC[C@H]2O Amb27629667 [0,0,0,2,0,0|1,0,0]=3 4748 B12R2.130 O=C1CC[C@H]2CN1CC[C@H]2O Amb33719108 [0,0,0,2,0,0|2,0,0]=4 4749 B12R2.130 O=C1CC[C@H]2C[C@@H]1CCC2=O Amb10842213 [0,0,0,2,0,0|1,0,1]=4 4750 B12R2.130 O=C1CC[C@H]2C[C@@H]1CCC2O Amb27211968 [0,0,0,2,0,0|1,0,0]=3 4751 B12R2.130 O=C1CC[C@H]2C[C@@H]1CC[C@@H]2O Amb28201131 [0,0,0,2,0,0|1,0,0]=3 4752 B12R2.162 CCC[C@@H]1[C@H]2CC[C@@H]1C(=O)C2 Amb27432605 [0,0,0,2,0,0|0,0,0]=2 4753 B12R2.196 C=C1CCC2C(=O)CCCC12 Amb28144076 [0,0,0,2,0,0|0,0,2]=4 4754 B12R2.196 CC1CCC[C@@H]2C(=O)C=C[C@H]12 Amb27859386 [0,0,0,2,0,0|0,0,2]=4 4755 B12R2.196 CC1CCNC2C(=O)NCC12 Amb35789561 [0,0,0,2,0,0|2,0,0]=4 4756 B12R2.196 CC1CC[C@@H]2C(=O)CCC[C@H]12 Amb28202266 [0,0,0,2,0,0|0,0,0]=2 4757 B12R2.196 CN1CCC[C@H]2C(=O)NC[C@H]21 Amb27240361 [0,0,0,2,0,0|2,0,0]=4 4758 B12R2.196 C[C@@H]1CCC2=C1CCCC2=O Amb27785375 [0,0,0,2,0,0|0,0,2]=4 4759 B12R2.196 C[C@@H]1CCC=C2C(=O)CC[C@@H]21 Amb28285838 [0,0,0,2,0,0|0,0,2]=4 4760 B12R2.196 C[C@@H]1CCC[C@@H]2C(=O)C=C[C@@H]21 Amb28052226 [0,0,0,2,0,0|0,0,2]=4 4761 B12R2.196 C[C@@H]1CCC[C@@H]2C(=O)CC[C@H]21 Amb28054350 [0,0,0,2,0,0|0,0,0]=2 4762 B12R2.196 C[C@@H]1CN[C@@H]2C(=O)CCC[C@H]12 Amb27670092 [0,0,0,2,0,0|1,0,0]=3 4763 B12R2.196 C[C@H]1CCC[C@@H]2C(=O)C=C[C@H]12 Amb27629690 [0,0,0,2,0,0|0,0,2]=4 4764 B12R2.196 NC1CCC2C(=O)NCCC12 Amb28434825 [0,0,0,2,0,0|2,0,0]=4 4765 B12R2.196 O=C1CCCC2C(O)CCN12 Amb27768343 [0,0,0,2,0,0|2,0,0]=4 4766 B12R2.196 O=C1CC[C@@H]2[C@@H](O)CCCN12 Amb27478742 [0,0,0,2,0,0|2,0,0]=4 4767 B12R2.196 O=C1CC[C@@H]2[C@H](O)CCCN12 Amb27457878 [0,0,0,2,0,0|2,0,0]=4 4768 B12R2.215 O=C1CC2CCCCC1CC2 Amb27256513 [0,0,0,2,0,0|0,0,0]=2 4769 B12R2.225 O=C1CNCCN1CC2CC2 Amb28365424 [0,0,0,2,0,0|2,0,0]=4 4770 B12R2.225 O=C1CNCCN1CC2CC2 Amb32412619 [0,0,0,2,0,0|2,0,0]=4 4771 B12R2.225 OC1CCCCC1CC2CC2 Amb26051834 [0,0,0,2,0,0|0,0,2]=4 4772 B12R2.225 O[C@@H]1CCCC[C@H]1CC2CC2 Amb32944532 [0,0,0,2,0,0|0,0,2]=4 4773 B12R2.303 C=C1CCCC[C@]12C[C@@H]2CO Amb27472520 [0,0,0,2,0,0|2,0,0]=4 4774 B12R2.303 C=C1CCCC[C@]12C[C@H]2C=O Amb27256409 [0,0,0,2,0,0|0,0,2]=4 4775 B12R2.303 C=C1CCCC[C@]12C[C@H]2CO Amb27206187 [0,0,0,2,0,0|2,0,0]=4 4776 B12R2.303 C=C[C@@H]1C[C@]12CCCCC2=O Amb27781981 [0,0,0,2,0,0|0,0,2]=4 4777 B12R2.306 CO[C@@H]1C[C@@H]2C(=O)CCC[C@@H]21 Amb27427688 [0,0,0,2,0,0|1,0,0]=3 4778 B12R2.306 N#CC1CC2C(=O)CCCC12 Amb28202273 [0,0,0,2,0,0|1,0,1]=4 4779 B12R2.332 C=CC1CC2CCCC1C2=O Amb27212032 [0,0,0,2,0,0|0,0,2]=4 4780 B12R2.338 CC1=CC2CCC1CC2C=O Amb27789443 [0,0,0,2,0,0|0,0,2]=4 4781 B12R2.338 CCC1CC2CCC1NC2=O Amb27605876 [0,0,0,2,0,0|1,0,0]=3 4782 B12R2.338 COC1CC2CCC1NC2=O Amb27169079 [0,0,0,2,0,0|2,0,0]=4 4783 B12R2.338 CO[C@H]1C[C@H]2CC[C@@H]1CC2=O Amb27199144 [0,0,0,2,0,0|1,0,0]=3 4784 B12R2.338 O=C1CN2CC[C@H]1C[C@@H]2CO Amb27844196 [0,0,0,2,0,0|2,0,0]=4 4785 B12R2.517 BrC1CCCCC1C2CCC2 Amb27163524 [0,0,0,2,0,0|1,0,1]=4 4786 B12R2.517 N=C1CCCCN1C2CCC2 Amb18181773 [0,0,0,2,0,0|2,0,0]=4 4787 B12R2.517 O=C1CCCCC1C2COC2 Amb24053248 [0,0,0,2,0,0|1,0,0]=3 4788 B12R2.517 O=C1CCCCC1N2CCC2 Amb27797053 [0,0,0,2,0,0|1,0,0]=3 4789 B12R2.517 O=C1CCCCN1C2CNC2 Amb25348096 [0,0,0,2,0,0|2,0,0]=4 4790 B12R2.517 O=C1CCCCN1C2CNC2 Amb32687557 [0,0,0,2,0,0|2,0,0]=4 4791 B12R2.517 O=C1CCCCN1C2CNC2 Amb32941834 [0,0,0,2,0,0|2,0,0]=4 4792 B12R2.517 O=C1CNCCN1C2CCC2 Amb25703138 [0,0,0,2,0,0|2,0,0]=4 4793 B12R2.517 O=C1NCCCN1C2CCC2 Amb27801889 [0,0,0,2,0,0|2,0,0]=4 4794 B12R2.517 OC1CCCCC1C2CCC2 Amb27664564 [0,0,0,2,0,0|0,0,2]=4 4795 B12R2.517 O[C@@H]1CCCC[C@H]1C2CCC2 Amb32944468 [0,0,0,2,0,0|0,0,2]=4 4796 B12R2.587 CC12CCCCC1CCC2O Amb27270918 [0,0,0,2,0,0|0,0,2]=4 4797 B12R2.587 CC12CCCCC1CNC2=O Amb27805455 [0,0,0,2,0,0|1,0,0]=3 4798 B12R2.587 CC12CCOCC1CNC2=O Amb27472783 [0,0,0,2,0,0|2,0,0]=4 4799 B12R2.587 C[C@@]12CCCC[C@@H]1CC[C@H]2N Amb27658856 [0,0,0,2,0,0|1,0,1]=4 4800 B12R2.587 C[C@]12CC=CC[C@@H]1CCC2=O Amb27428253 [0,0,0,2,0,0|0,0,2]=4 4801 B12R2.587 C[C@]12CCC=C[C@H]1CCC2=O Amb27493500 [0,0,0,2,0,0|0,0,2]=4 4802 B12R2.587 C[C@]12CCCC[C@@H]1CCC2=O Amb28052497 [0,0,0,2,0,0|0,0,0]=2 4803 B12R2.587 C[C@]12CCCC[C@@H]1OCC2=O Amb27855020 [0,0,0,2,0,0|1,0,0]=3 4804 B12R2.587 C[C@]12CCCC[C@H]1CCC2=O Amb27212012 [0,0,0,2,0,0|0,0,0]=2 4805 B12R2.587 C[C@]12CCCC[C@H]1OCC2=O Amb27210527 [0,0,0,2,0,0|1,0,0]=3 4806 B12R2.587 O=C1CC[C@@H]2CCCC[C@]12O Amb27256393 [0,0,0,2,0,0|1,0,0]=3 4807 B12R2.587 O=C1CC[C@H]2CCCC[C@]12O Amb27854683 [0,0,0,2,0,0|1,0,0]=3 4808 B12R2.587 O=C1COC2CCCCC12O Amb27854649 [0,0,0,2,0,0|2,0,0]=4 4809 B12R2.587 O=C1CO[C@H]2CCCC[C@]12O Amb28131477 [0,0,0,2,0,0|2,0,0]=4 4810 B12R2.587 O=C1OCC2CCCCC12O Amb27176726 [0,0,0,2,0,0|2,0,0]=4 4811 B12R2.812 CN1CCC[C@@H]2C(CC=O)[C@@H]21 Amb27965702 [0,0,0,2,0,0|1,0,0]=3 4812 B12R2.931 C=CCN1C[C@H]2CCCC[C@H]21 Amb28435635 [0,0,0,2,0,0|2,0,0]=4 4813 B12R2.931 CNCC1CC2CCCCC21 Amb27193904 [0,0,0,2,0,0|2,0,0]=4 4814 B12R2.931 N#CCC1CC2CCCCC12 Amb27201862 [0,0,0,2,0,0|1,0,1]=4 4815 B12R2.931 NCCC1CC2CCCCC12 Amb25216405 [0,0,0,2,0,0|1,0,1]=4 4816 B12R2.1081 BrC1C=CCC2CCCCC12 Amb27879580 [0,0,0,2,0,0|2,0,0]=4 4817 B12R2.1081 BrC1CCC[C@H]2CCCC[C@H]12 Amb28053700 [0,0,0,2,0,0|1,0,1]=4 4818 B12R2.1081 Br[C@@H]1CCC[C@@H]2CCCC[C@@H]21 Amb28286727 [0,0,0,2,0,0|1,0,1]=4 4819 B12R2.1081 Br[C@H]1CCC[C@H]2CCCC[C@H]12 Amb28401406 [0,0,0,2,0,0|1,0,1]=4 4820 B12R2.1081 CC1CCCC2CCCCC12 Amb25916340 [0,0,0,2,0,0|1,0,1]=4 4821 B12R2.1081 CC1CCCC2CCCCN12 Amb25065581 [0,0,0,2,0,0|1,0,1]=4 4822 B12R2.1081 CC1CCCC2CCCNC12 Amb9725875 [0,0,0,2,0,0|2,0,0]=4 4823 B12R2.1081 CC1CCCC2NCCCC12 Amb26539872 [0,0,0,2,0,0|1,0,1]=4 4824 B12R2.1081 CN1CCC[C@H]2CCCC[C@H]21 Amb26620561 [0,0,0,2,0,0|2,0,0]=4 4825 B12R2.1081 C[C@@H]1CCC[C@H]2CCCN[C@@H]21 Amb27441708 [0,0,0,2,0,0|2,0,0]=4 4826 B12R2.1081 C[C@@H]1CCC[C@H]2NCCC[C@@H]12 Amb27778037 [0,0,0,2,0,0|1,0,1]=4 4827 B12R2.1081 C[C@H]1CCC[C@@H]2CCCN[C@@H]12 Amb27814165 [0,0,0,2,0,0|2,0,0]=4 4828 B12R2.1081 C[C@H]1CCC[C@H]2C=CCC[C@H]12 Amb28062466 [0,0,0,2,0,0|1,0,0]=3 4829 B12R2.1081 C[C@H]1CCC[C@H]2CCCN[C@H]12 Amb28323085 [0,0,0,2,0,0|2,0,0]=4 4830 B12R2.1081 N=C1CCNC2CCCCC12 Amb27840270 [0,0,0,2,0,0|2,0,0]=4 4831 B12R2.1081 NC1CCCC2CCCCC12 Amb22886461 [0,0,0,2,0,0|1,0,1]=4 4832 B12R2.1081 NC1CCCC2CCCCC12 Amb28652945 [0,0,0,2,0,0|1,0,1]=4 4833 B12R2.1081 O=C1CCC=C2CCCCC12 Amb27409497 [0,0,0,2,0,0|0,0,2]=4 4834 B12R2.1081 O=C1CCCC2CC=CCC12 Amb26053363 [0,0,0,2,0,0|0,0,2]=4 4835 B12R2.1081 O=C1CCCC2CCCCC12 Amb3941631 [0,0,0,2,0,0|0,0,0]=2 4836 B12R2.1081 O=C1CCCC2CNCCC12 Amb18125580 [0,0,0,2,0,0|1,0,0]=3 4837 B12R2.1081 O=C1CCCN2CCCCC12 Amb25337490 [0,0,0,2,0,0|1,0,0]=3 4838 B12R2.1081 O=C1CCCN2CCSCC12 Amb32674582 [0,0,0,2,0,0|2,0,0]=4 4839 B12R2.1081 O=C1CCC[C@@H]2CC=CC[C@H]12 Amb27447275 [0,0,0,2,0,0|0,0,2]=4 4840 B12R2.1081 O=C1CCC[C@@H]2CCCC[C@@H]12 Amb22800177 [0,0,0,2,0,0|0,0,0]=2 4841 B12R2.1081 O=C1CCC[C@@H]2CNCCN12 Amb25084217 [0,0,0,2,0,0|2,0,0]=4 4842 B12R2.1081 O=C1CCC[C@H]2CC=CC[C@H]12 Amb27212455 [0,0,0,2,0,0|0,0,2]=4 4843 B12R2.1081 O=C1CCC[C@H]2CNCCN12 Amb25869368 [0,0,0,2,0,0|2,0,0]=4 4844 B12R2.1081 O=C1CCC[C@H]2NCCC[C@H]12 Amb27461786 [0,0,0,2,0,0|1,0,0]=3 4845 B12R2.1081 O=C1CCNC2CCCCC12 Amb1948705 [0,0,0,2,0,0|1,0,0]=3 4846 B12R2.1081 O=C1CCNC2CCCCN12 Amb26372843 [0,0,0,2,0,0|2,0,0]=4 4847 B12R2.1081 O=C1CCNC2COCCC12 Amb28367024 [0,0,0,2,0,0|2,0,0]=4 4848 B12R2.1081 O=C1CCN[C@@H]2CCCC[C@@H]12 Amb1048126 [0,0,0,2,0,0|1,0,0]=3 4849 B12R2.1081 O=C1CCOC2CCCCC12 Amb18831001 [0,0,0,2,0,0|1,0,0]=3 4850 B12R2.1081 O=C1CCOC2CCNCC12 Amb18200476 [0,0,0,2,0,0|2,0,0]=4 4851 B12R2.1081 O=C1CCOC2CCOCC12 Amb18200229 [0,0,0,2,0,0|2,0,0]=4 4852 B12R2.1081 O=C1CCOC2CCSCC12 Amb18198203 [0,0,0,2,0,0|2,0,0]=4 4853 B12R2.1081 O=C1CCS[C@H]2CCCC[C@H]12 Amb27227098 [0,0,0,2,0,0|1,0,0]=3 4854 B12R2.1081 O=C1CNCC2CCCCN12 Amb10604047 [0,0,0,2,0,0|2,0,0]=4 4855 B12R2.1081 O=C1CNCC2CCCCN12 Amb22728017 [0,0,0,2,0,0|2,0,0]=4 4856 B12R2.1081 O=C1CNC[C@@H]2CCCCN12 Amb22751890 [0,0,0,2,0,0|2,0,0]=4 4857 B12R2.1081 O=C1CNC[C@H]2CCCCN12 Amb26480693 [0,0,0,2,0,0|2,0,0]=4 4858 B12R2.1081 O=C1NCCC2CCCNC12 Amb23455297 [0,0,0,2,0,0|2,0,0]=4 4859 B12R2.1081 O=C1NCCC2CCNCC12 Amb23455307 [0,0,0,2,0,0|2,0,0]=4 4860 B12R2.1081 O=C1NCCC2NCCCC12 Amb23455312 [0,0,0,2,0,0|2,0,0]=4 4861 B12R2.1081 O=C1NCCN2CCCCC12 Amb2692469 [0,0,0,2,0,0|2,0,0]=4 4862 B12R2.1081 O=C1NCC[C@@H]2CCNC[C@H]12 Amb31251634 [0,0,0,2,0,0|2,0,0]=4 4863 B12R2.1081 O=C1NCC[C@@H]2CCNC[C@H]12 Amb33457745 [0,0,0,2,0,0|2,0,0]=4 4864 B12R2.1081 O=C1NCO[C@H]2CCCC[C@H]12 Amb27464384 [0,0,0,2,0,0|2,0,0]=4 4865 B12R2.1081 O=C1OCC[C@@H]2CCCCN12 Amb27954932 [0,0,0,2,0,0|2,0,0]=4 4866 B12R2.1081 OC1CCCC2CCCCC12 Amb25701854 [0,0,0,2,0,0|0,0,2]=4 4867 B12R2.1081 OC1CCC[C@@H]2CCCC[C@H]12 Amb26443989 [0,0,0,2,0,0|0,0,2]=4 4868 B12R2.1081 OC1CCC[C@H]2CCCC[C@@H]12 Amb24763685 [0,0,0,2,0,0|0,0,2]=4 4869 B12R2.1081 O[C@@H]1C=CC[C@H]2CCCC[C@H]12 Amb27198135 [0,0,0,2,0,0|2,0,0]=4 4870 B12R2.1081 O[C@@H]1CCC[C@@H]2CCCC[C@@H]21 Amb27427919 [0,0,0,2,0,0|0,0,2]=4 4871 B12R2.1081 O[C@@H]1CCC[C@H]2CCCC=C12 Amb27969072 [0,0,0,2,0,0|2,0,0]=4 4872 B12R2.1081 O[C@@H]1CCC[C@H]2CCCC[C@H]12 Amb27646612 [0,0,0,2,0,0|0,0,2]=4 4873 B12R2.1081 O[C@H]1CCC[C@@H]2CCCCC12 Amb22504288 [0,0,0,2,0,0|0,0,2]=4 4874 B12R2.1081 O[C@H]1CCC[C@H]2CCCC=C12 Amb27219825 [0,0,0,2,0,0|2,0,0]=4 4875 B12R2.1515 C=CCCN1CCCC2CC21 Amb27220475 [0,0,0,2,0,0|2,0,0]=4 4876 B12R2.1515 C=CCNC1CCC[C@@H]2C[C@H]12 Amb28399200 [0,0,0,2,0,0|2,0,0]=4 4877 B12R2.1515 C=CCNC1CCC[C@H]2C[C@@H]12 Amb27975928 [0,0,0,2,0,0|2,0,0]=4 4878 B12R2.1515 O=C=NCC1CCCC2CC12 Amb35673310 [0,0,0,2,0,0|1,0,1]=4 4879 B12R2.1515 O=CNCC1CCCC2CC12 Amb35742526 [0,0,0,2,0,0|1,0,0]=3 4880 B12R2.2079 C=CCNC12CCCCC1C2 Amb35727735 [0,0,0,2,0,0|2,0,0]=4 4881 B12R2.2079 O=C=NCC12CCCCC1C2 Amb35727727 [0,0,0,2,0,0|1,0,1]=4 4882 B12R2.2079 O=CNCC12CCCCC1C2 Amb35682215 [0,0,0,2,0,0|1,0,0]=3 4883 B12R2.2317 CC1C=CC2CCCC1C2=O Amb27857093 [0,0,0,2,0,0|0,0,2]=4 4884 B12R2.2317 CN1[C@H]2CCC[C@@H]1C(=O)CC2 Amb27467801 [0,0,0,2,0,0|1,0,0]=3 4885 B12R2.2317 C[C@@H]1C=C[C@@H]2CCC[C@H]1C2=O Amb27434261 [0,0,0,2,0,0|0,0,2]=4 4886 B12R2.2317 NC1CCC2CCCC1C2=O Amb35750751 [0,0,0,2,0,0|1,0,0]=3 4887 B12R2.2317 NC1CCC2CCCC1C2=O Amb35752088 [0,0,0,2,0,0|1,0,0]=3 4888 B12R2.2317 O=C1C2CCC(Br)C1COC2 Amb27830084 [0,0,0,2,0,0|2,0,0]=4 4889 B12R2.2317 O=C1C2CCC(Cl)C1COC2 Amb27617363 [0,0,0,2,0,0|2,0,0]=4 4890 B12R2.2317 O=C1C2CCC(O)C1COC2 Amb22497914 [0,0,0,2,0,0|2,0,0]=4 4891 B12R2.2317 O=C1C2CCCC1C(O)CC2 Amb25151457 [0,0,0,2,0,0|1,0,0]=3 4892 B12R2.2317 O=C1C2CCC[C@H]1[C@@H](O)CC2 Amb27662239 [0,0,0,2,0,0|1,0,0]=3 4893 B12R2.2317 O=C1CC[C@@H]2CCC[C@@H]1C2=O Amb28324430 [0,0,0,2,0,0|1,0,1]=4 4894 B12R2.2317 O=C1CC[C@@H]2CCC[C@H]1[C@@H]2O Amb28253722 [0,0,0,2,0,0|1,0,0]=3 4895 B12R2.2317 O=C1CC[C@H]2CCCC1C2=O Amb27954160 [0,0,0,2,0,0|1,0,1]=4 4896 B12R2.2317 O=C1[C@@H]2CCC[C@@H]1[C@H](O)CC2 Amb27802677 [0,0,0,2,0,0|1,0,0]=3 4897 B12R2.2317 O=C1[C@@H]2CCC[C@H]1[C@H](Cl)CC2 Amb27630498 [0,0,0,2,0,0|1,0,0]=3 4898 B12R2.2317 O=C1[C@@H]2CC[C@@H](O)[C@H]1COC2 Amb27432701 [0,0,0,2,0,0|2,0,0]=4 4899 B12R2.2317 O=C1[C@@H]2COC[C@H]1CC[C@@H]2Br Amb27488160 [0,0,0,2,0,0|2,0,0]=4 4900 B12R2.2317 O=C1[C@H]2CCC[C@@H]1[C@H](O)CC2 Amb27855017 [0,0,0,2,0,0|1,0,0]=3 4901 B12R2.2317 O=C1[C@H]2CCC[C@H]1[C@@H](O)CC2 Amb28457469 [0,0,0,2,0,0|1,0,0]=3 4902 B12R2.2317 O=C1[C@H]2CCC[C@H]1[C@H](O)CC2 Amb28052235 [0,0,0,2,0,0|1,0,0]=3 4903 B12R2.2317 O=S1C2CCCC1C(Cl)CC2 Amb27816269 [0,0,0,2,0,0|2,0,0]=4 4904 B12R2.2412 FC12CCCCC1CCCC2 Amb27233859 [0,0,0,2,0,0|1,0,1]=4 4905 B12R2.2412 NC12CCCCC1CCCC2 Amb28385707 [0,0,0,2,0,0|1,0,1]=4 4906 B12R2.2412 OC12CCCCC1CCCC2 Amb17593870 [0,0,0,2,0,0|0,0,2]=4 4907 B12R2.1 BrC[C@H]1CC[C@H]2CCCC=C12 Amb27789828 [0,0,0,2,0,0|2,0,0]=4 4908 B12R2.1 CCC1CNC2CCCCC12 Amb27635166 [0,0,0,2,0,0|2,0,0]=4 4909 B12R2.1 ClCC1CCC2CCCCC12 Amb27237554 [0,0,0,2,0,0|1,0,1]=4 4910 B12R2.1 O=CC1CCC2CCCCC12 Amb27861470 [0,0,0,2,0,0|0,0,0]=2 4911 B12R2.1 O=CC1CCN2CCCCC12 Amb27755057 [0,0,0,2,0,0|1,0,0]=3 4912 B12R2.1 O=CC1CON2CCCCC12 Amb18125867 [0,0,0,2,0,0|2,0,0]=4 4913 B12R2.1 O=C[C@@H]1CC[C@H]2CCCC[C@H]12 Amb28142395 [0,0,0,2,0,0|0,0,0]=2 4914 B12R2.1 O=C[C@@H]1CON2CCCC[C@H]12 Amb24694325 [0,0,0,2,0,0|2,0,0]=4 4915 B12R2.1 O=C[C@H]1CCN2CCCC[C@@H]12 Amb26586175 [0,0,0,2,0,0|1,0,0]=3 4916 B12R2.1 O=C[C@H]1CC[C@H]2CCCC[C@H]12 Amb28057793 [0,0,0,2,0,0|0,0,0]=2 4917 B12R2.1 O=C[C@H]1CON2CCCC[C@H]12 Amb24736115 [0,0,0,2,0,0|2,0,0]=4 4918 B12R2.1 O=NC1NC[C@@H]2CCCC[C@H]12 Amb27793328 [0,0,0,2,0,0|2,0,0]=4 4919 B12R2.1 OC[C@H]1CC[C@@H]2CCCC[C@H]12 Amb27857980 [0,0,0,2,0,0|0,0,2]=4 4920 B12R2.44 CCC1C=CC2CNCC2C1 Amb27793089 [0,0,0,2,0,0|2,0,0]=4 4921 B12R2.44 CC[C@@H]1C=C[C@@H]2CNC[C@@H]2C1 Amb27638582 [0,0,0,2,0,0|2,0,0]=4 4922 B12R2.44 CC[C@H]1C=C[C@H]2CNC[C@@H]2C1 Amb27239413 [0,0,0,2,0,0|2,0,0]=4 4923 B12R2.44 O=CC1CCC2OCOC2C1 Amb25139609 [0,0,0,2,0,0|2,0,0]=4 4924 B12R2.44 O=CC1CN2CCCC2CO1 Amb27856562 [0,0,0,2,0,0|2,0,0]=4 4925 B12R2.44 O=CN1CCC2COCC2C1 Amb30029151 [0,0,0,2,0,0|2,0,0]=4 4926 B12R2.52 CCC1CCCC12CC2CBr Amb27400208 [0,0,0,2,0,0|1,0,1]=4 4927 B12R2.82 CC1C(=N)NC[C@@H]2CCC[C@H]12 Amb28057589 [0,0,0,2,0,0|2,0,0]=4 4928 B12R2.82 CC1C(=O)CCC2CCCC21 Amb27859375 [0,0,0,2,0,0|0,0,0]=2 4929 B12R2.82 CC1C(=O)NCC2CCCN21 Amb28245443 [0,0,0,2,0,0|2,0,0]=4 4930 B12R2.82 CC1CNC2CCCC2C1=O Amb9782243 [0,0,0,2,0,0|1,0,0]=3 4931 B12R2.82 CC1CNC2CCCC2S1=O Amb28317934 [0,0,0,2,0,0|2,0,0]=4 4932 B12R2.82 CC1NCC2CCCN2C1=O Amb28071066 [0,0,0,2,0,0|2,0,0]=4 4933 B12R2.82 CN1C(=O)CCC2CNCC21 Amb24392090 [0,0,0,2,0,0|2,0,0]=4 4934 B12R2.82 CN1C(=O)CC[C@@H]2CNC[C@H]21 Amb18200734 [0,0,0,2,0,0|2,0,0]=4 4935 B12R2.82 CN1CCN2CCCC2C1=O Amb24084739 [0,0,0,2,0,0|2,0,0]=4 4936 B12R2.82 CN1CC[C@@H]2CNC[C@@H]2C1=O Amb27623041 [0,0,0,2,0,0|2,0,0]=4 4937 B12R2.82 C[C@@H]1NC[C@@H]2CCCN2C1=O Amb27194996 [0,0,0,2,0,0|2,0,0]=4 4938 B12R2.82 C[C@@H]1NC[C@@H]2CCCN2C1=O Amb32434784 [0,0,0,2,0,0|2,0,0]=4 4939 B12R2.82 C[C@@H]1NC[C@H]2CCCN2C1=O Amb32434768 [0,0,0,2,0,0|2,0,0]=4 4940 B12R2.82 C[C@H]1NC[C@@H]2CCCN2C1=O Amb32434780 [0,0,0,2,0,0|2,0,0]=4 4941 B12R2.82 C[C@H]1NC[C@H]2CCCN2C1=O Amb32434767 [0,0,0,2,0,0|2,0,0]=4 4942 B12R2.82 O=C1C(O)CCC2CCCN12 Amb28079016 [0,0,0,2,0,0|2,0,0]=4 4943 B12R2.83 O=C1CCC2CCCC2CC1 Amb17593806 [0,0,0,2,0,0|0,0,0]=2 4944 B12R2.83 O=C1CCC2CCCC2CN1 Amb24689525 [0,0,0,2,0,0|1,0,0]=3 4945 B12R2.83 O=C1CCN2CCCC2CN1 Amb26559296 [0,0,0,2,0,0|2,0,0]=4 4946 B12R2.83 O=C1CC[C@@H]2CCC[C@@H]2CN1 Amb27207694 [0,0,0,2,0,0|1,0,0]=3 4947 B12R2.264 C=CCCN1C2CCC1CC2 Amb27840382 [0,0,0,2,0,0|2,0,0]=4 4948 B12R2.308 CCC1CC2CC1CC2CO Amb27978219 [0,0,0,2,0,0|0,0,2]=4 4949 B12R2.308 N#CC1CC2CC1CC2C=O Amb27862090 [0,0,0,2,0,0|1,0,1]=4 4950 B12R2.308 O=CC1CC2CC1CC2C=O Amb27184076 [0,0,0,2,0,0|1,0,1]=4 4951 B12R2.329 N#C[C@H]1C[C@@H]2CC[C@H]1[C@@H]2C=O Amb28131434 [0,0,0,2,0,0|1,0,1]=4 4952 B12R2.367 C=C[C@@H]1CC[C@@H]2C(=O)CC[C@H]12 Amb28351511 [0,0,0,2,0,0|0,0,2]=4 4953 B12R2.367 CC1CCC2C1CCN2C=O Amb26000068 [0,0,0,2,0,0|1,0,0]=3 4954 B12R2.367 O=C1CC[C@H]2[C@@H](CO)CCN12 Amb28065325 [0,0,0,2,0,0|2,0,0]=4 4955 B12R2.367 O=C1CC[C@H]2[C@H](CO)CCN12 Amb27857944 [0,0,0,2,0,0|2,0,0]=4 4956 B12R2.2042 C=C1CCC2CCCC12CO Amb27650247 [0,0,0,2,0,0|2,0,0]=4 4957 B12R2.2042 C=C1CC[C@@H]2CCC[C@]12CO Amb27853824 [0,0,0,2,0,0|2,0,0]=4 4958 B12R2.2042 CC1CCC2CCCC12CO Amb27661075 [0,0,0,2,0,0|0,0,2]=4 4959 B12R2.2085 CCCCC12CCC1CNC2 Amb27813430 [0,0,0,2,0,0|2,0,0]=4 4960 B12R2.2140 CNC1CCCC1C2CCC2 Amb27642277 [0,0,0,2,0,0|2,0,0]=4 4961 B12R2.2140 O=CC1CCCN1C2CCC2 Amb27201902 [0,0,0,2,0,0|1,0,0]=3 4962 B12R2.3971 O=CC12CCCCC1NCC2 Amb33229386 [0,0,0,2,0,0|1,0,0]=3 4963 B12R2.72 C=CC1C(O)CC2CCCC21 Amb27486396 [0,0,0,2,0,0|2,0,0]=4 4964 B12R2.72 CO[C@@H]1C(=O)C[C@@H]2CCC[C@@H]21 Amb27486168 [0,0,0,2,0,0|1,0,0]=3 4965 B12R2.72 CO[C@@H]1C(=O)C[C@H]2CCC[C@@H]12 Amb28194559 [0,0,0,2,0,0|1,0,0]=3 4966 B12R2.72 CO[C@H]1C(=O)C[C@@H]2CCC[C@@H]21 Amb28194500 [0,0,0,2,0,0|1,0,0]=3 4967 B12R2.72 C\C=C1\C(=O)C[C@H]2CCC[C@@H]12 Amb27854639 [0,0,0,2,0,0|0,0,2]=4 4968 B12R2.72 O=C1C[C@H]2CCC[C@H]2[C@@H]1CO Amb27256406 [0,0,0,2,0,0|1,0,0]=3 4969 B12R2.199 CN1C2CCCC(=O)C1CC2 Amb28240363 [0,0,0,2,0,0|1,0,0]=3 4970 B12R2.199 CN1[C@H]2CCCC(=O)[C@@H]1CC2 Amb26413358 [0,0,0,2,0,0|1,0,0]=3 4971 B12R2.199 C[C@H]1[C@@H]2CC[C@H]1CCCC2=O Amb28052409 [0,0,0,2,0,0|0,0,0]=2 4972 B12R2.200 O=C1ONCC2CCC1CC2 Amb28293015 [0,0,0,2,0,0|2,0,0]=4 4973 B12R2.527 O=C1CCCCCCC12CC2 Amb22756132 [0,0,0,2,0,0|0,0,0]=2 4974 B12R2.549 CC1[C@@H]2CCCCC[C@@H](O)[C@H]12 Amb27472770 [0,0,0,2,0,0|0,0,2]=4 4975 B12R2.549 C[C@@H]1[C@@H]2[C@@H](O)CCCCC[C@H]12 Amb28064110 [0,0,0,2,0,0|0,0,2]=4 4976 B12R2.549 C[C@@H]1[C@@H]2[C@H](O)CCCCC[C@H]12 Amb27844225 [0,0,0,2,0,0|0,0,2]=4 4977 B12R2.694 O=C1C2CC=CCCC1CC2 Amb27954210 [0,0,0,2,0,0|0,0,2]=4 4978 B12R2.694 O=C1C2CCCCCC1CC2 Amb22356366 [0,0,0,2,0,0|0,0,0]=2 4979 B12R2.1067 N[C@@H]1C[C@@H]2CCCCCC[C@@H]21 Amb35788169 [0,0,0,2,0,0|1,0,1]=4 4980 B12R2.1067 N[C@@H]1C[C@@H]2CCCCCC[C@@H]21 Amb35788575 [0,0,0,2,0,0|1,0,1]=4 4981 B12R2.1067 O=C1CC2=C1CCCCCC2 Amb28144214 [0,0,0,2,0,0|0,0,2]=4 4982 B12R2.1067 O=C1CC2CCCCCCC12 Amb27666446 [0,0,0,2,0,0|0,0,0]=2 4983 B12R2.1067 O=C1C[C@@H]2CCCCCC[C@H]12 Amb28429638 [0,0,0,2,0,0|0,0,0]=2 4984 B12R2.1067 O=C1NC2CCCCCCC12 Amb20667702 [0,0,0,2,0,0|1,0,0]=3 4985 B12R2.1067 O=C1N[C@@H]2CCCCCC[C@H]12 Amb26891895 [0,0,0,2,0,0|1,0,0]=3 4986 B12R2.1067 O=C1N[C@H]2CCCCCC[C@@H]12 Amb27207647 [0,0,0,2,0,0|1,0,0]=3 4987 B12R2.2047 CC1C(CO)[C@H]2CCCC[C@@H]12 Amb27443249 [0,0,0,2,0,0|0,0,2]=4 4988 B12R2.2047 CCC1C(O)C2CCCCC12 Amb27400204 [0,0,0,2,0,0|0,0,2]=4 4989 B12R2.2047 O=C1[C@@H]2CCCC[C@@H]2N1CO Amb27457808 [0,0,0,2,0,0|2,0,0]=4 4990 B12R2.2102 O=CC1CCC2CCCC1C2 Amb28250918 [0,0,0,2,0,0|0,0,0]=2 4991 B12R2.2202 CCC1C(=O)NCC2CCN21 Amb32640052 [0,0,0,2,0,0|2,0,0]=4 4992 B12R2.3967 CC[C@]12CCCCC[C@H]1C2Br Amb28436784 [0,0,0,2,0,0|1,0,1]=4 4993 B12R2.3967 N#CC12CCCCCC1C2=O Amb27750225 [0,0,0,2,0,0|1,0,1]=4 4994 B12R2.8 BrC1CCCC12CCCCC2 Amb27823859 [0,0,0,2,0,0|1,0,1]=4 4995 B12R2.8 C=C1CCCC12CCCCC2 Amb28458584 [0,0,0,2,0,0|1,0,0]=3 4996 B12R2.8 CC1CCCC12CCCNC2 Amb27412367 [0,0,0,2,0,0|2,0,0]=4 4997 B12R2.8 CC1CNCC12C=CCCC2 Amb27667115 [0,0,0,2,0,0|2,0,0]=4 4998 B12R2.8 C[C@@H]1CNC[C@]12C=CCCC2 Amb27493373 [0,0,0,2,0,0|2,0,0]=4 4999 B12R2.8 NC1CCCC12CCCCC2 Amb25882848 [0,0,0,2,0,0|1,0,1]=4 5000 B12R2.8 NC1CCCC12CCCCC2 Amb28652948 [0,0,0,2,0,0|1,0,1]=4 5001 B12R2.8 O=C1C=CCC12CCCCC2 Amb28285014 [0,0,0,2,0,0|0,0,2]=4 5002 B12R2.8 O=C1CCCC12CCCCC2 Amb22276895 [0,0,0,2,0,0|0,0,0]=2 5003 B12R2.8 O=C1CCCC12CCCCO2 Amb24401976 [0,0,0,2,0,0|1,0,0]=3 5004 B12R2.8 O=C1CCCC12CCCOC2 Amb33494037 [0,0,0,2,0,0|1,0,0]=3 5005 B12R2.8 O=C1CCCC12CCNCC2 Amb26509672 [0,0,0,2,0,0|1,0,0]=3 5006 B12R2.8 O=C1CCCC12CCNCC2 Amb32729447 [0,0,0,2,0,0|1,0,0]=3 5007 B12R2.8 O=C1CCCC12CCOCC2 Amb28381132 [0,0,0,2,0,0|1,0,0]=3 5008 B12R2.8 O=C1CCC[C@@]12CCCCO2 Amb28047345 [0,0,0,2,0,0|1,0,0]=3 5009 B12R2.8 O=C1CCOC12CCCCC2 Amb25792788 [0,0,0,2,0,0|1,0,0]=3 5010 B12R2.8 O=C1CCOC12CCCNC2 Amb32722010 [0,0,0,2,0,0|2,0,0]=4 5011 B12R2.8 O=C1CCOC12CCCSC2 Amb32990579 [0,0,0,2,0,0|2,0,0]=4 5012 B12R2.8 O=C1CCOC12CCNCC2 Amb24686947 [0,0,0,2,0,0|2,0,0]=4 5013 B12R2.8 O=C1CCOC12CCOCC2 Amb32751787 [0,0,0,2,0,0|2,0,0]=4 5014 B12R2.8 O=C1CCOC12CCSCC2 Amb32990567 [0,0,0,2,0,0|2,0,0]=4 5015 B12R2.8 O=C1NCCC12CCCCC2 Amb22757031 [0,0,0,2,0,0|1,0,0]=3 5016 B12R2.8 O=C1NCCC12CCCCN2 Amb24603983 [0,0,0,2,0,0|2,0,0]=4 5017 B12R2.8 O=C1NCCC12CCCCN2 Amb32410205 [0,0,0,2,0,0|2,0,0]=4 5018 B12R2.8 O=C1NCCC12CCCNC2 Amb19957872 [0,0,0,2,0,0|2,0,0]=4 5019 B12R2.8 O=C1NCCC12CCCNC2 Amb19957877 [0,0,0,2,0,0|2,0,0]=4 5020 B12R2.8 O=C1NCCC12CCCOC2 Amb33070930 [0,0,0,2,0,0|2,0,0]=4 5021 B12R2.8 O=C1NCCC12CCNCC2 Amb20171624 [0,0,0,2,0,0|2,0,0]=4 5022 B12R2.8 O=C1NCCC12CCNCC2 Amb33533573 [0,0,0,2,0,0|2,0,0]=4 5023 B12R2.8 O=C1NCCC12CCOCC2 Amb25922646 [0,0,0,2,0,0|2,0,0]=4 5024 B12R2.8 O=C1NCNC12CCCCC2 Amb27259481 [0,0,0,2,0,0|2,0,0]=4 5025 B12R2.8 O=C1OCCC12CCNCC2 Amb20241454 [0,0,0,2,0,0|2,0,0]=4 5026 B12R2.8 O=C1OCCC12CCNCC2 Amb28351881 [0,0,0,2,0,0|2,0,0]=4 5027 B12R2.8 O=C1OCCC12CCOCC2 Amb25727138 [0,0,0,2,0,0|2,0,0]=4 5028 B12R2.8 SC1CCCC12CCCCC2 Amb25088517 [0,0,0,2,0,0|0,1,1]=4 5029 B12R2.11 CC1CC1CC2CCCNC2 Amb33144905 [0,0,0,2,0,0|2,0,0]=4 5030 B12R2.11 NC1CC1CC2CCCCC2 Amb25904763 [0,0,0,2,0,0|1,0,1]=4 5031 B12R2.11 N[C@@H]1C[C@H]1CC2CCCCC2 Amb33422515 [0,0,0,2,0,0|1,0,1]=4 5032 B12R2.16 CNCC1CC12CCCCC2 Amb18287103 [0,0,0,2,0,0|2,0,0]=4 5033 B12R2.16 O=CCC1CC12CCOCC2 Amb27200527 [0,0,0,2,0,0|1,0,0]=3 5034 B12R2.16 O=CNC1CC12CCCCC2 Amb27424299 [0,0,0,2,0,0|1,0,0]=3 5035 B12R2.23 NC1CCC1C2CCCCC2 Amb27958459 [0,0,0,2,0,0|1,0,1]=4 5036 B12R2.23 O=C1CCC1=C2CCCCC2 Amb24607327 [0,0,0,2,0,0|0,0,2]=4 5037 B12R2.23 O=C1CCC1C2CCCCC2 Amb25059650 [0,0,0,2,0,0|0,0,0]=2 5038 B12R2.23 O=C1CCC1N2CCOCC2 Amb25282658 [0,0,0,2,0,0|2,0,0]=4 5039 B12R2.23 O=C1CCN1C2CCCNC2 Amb24358797 [0,0,0,2,0,0|2,0,0]=4 5040 B12R2.23 O=C1CCN1C2CCNCC2 Amb28186973 [0,0,0,2,0,0|2,0,0]=4 5041 B12R2.23 OC1CCC1C2CCCCC2 Amb32945093 [0,0,0,2,0,0|0,0,2]=4 5042 B12R2.27 BrCC1CC1C2CCCCC2 Amb27589912 [0,0,0,2,0,0|1,0,1]=4 5043 B12R2.27 C#CC1CC1C2CCCCC2 Amb25270044 [0,0,0,2,0,0|1,0,1]=4 5044 B12R2.27 C#C[C@@H]1C[C@@H]1C2CCCCC2 Amb28121460 [0,0,0,2,0,0|1,0,1]=4 5045 B12R2.27 C#C[C@@H]1C[C@H]1C2CCCCC2 Amb25834658 [0,0,0,2,0,0|1,0,1]=4 5046 B12R2.27 C#C[C@H]1C[C@H]1C2CCCCC2 Amb27974472 [0,0,0,2,0,0|1,0,1]=4 5047 B12R2.27 NCC1CC1C2CCCCC2 Amb18288220 [0,0,0,2,0,0|1,0,1]=4 5048 B12R2.27 NCC1CC1C2CCCCC2 Amb32990203 [0,0,0,2,0,0|1,0,1]=4 5049 B12R2.27 NC[C@@H]1C[C@H]1C2CCCCC2 Amb25175796 [0,0,0,2,0,0|1,0,1]=4 5050 B12R2.27 NC[C@@H]1C[C@H]1C2CCCCC2 Amb32661484 [0,0,0,2,0,0|1,0,1]=4 5051 B12R2.27 O=CC1CC1C2CCCCC2 Amb26334685 [0,0,0,2,0,0|0,0,0]=2 5052 B12R2.27 O=CC1CC1C2CCCOC2 Amb32669254 [0,0,0,2,0,0|1,0,0]=3 5053 B12R2.27 O=CC1CC1C2CCCSC2 Amb32669276 [0,0,0,2,0,0|1,0,0]=3 5054 B12R2.27 O=CC1CC1C2CCOCC2 Amb27835105 [0,0,0,2,0,0|1,0,0]=3 5055 B12R2.27 O=CC1CC1C2CCSCC2 Amb32669256 [0,0,0,2,0,0|1,0,0]=3 5056 B12R2.27 O=CC1OC1C2CCCCC2 Amb27403549 [0,0,0,2,0,0|1,0,0]=3 5057 B12R2.27 O=C[C@@H]1C[C@@H]1C2CCCCC2 Amb27250630 [0,0,0,2,0,0|0,0,0]=2 5058 B12R2.27 O=C[C@@H]1C[C@H]1C2CCCCC2 Amb27423820 [0,0,0,2,0,0|0,0,0]=2 5059 B12R2.27 O=C[C@@H]1O[C@@H]1C2CCCCC2 Amb27841160 [0,0,0,2,0,0|1,0,0]=3 5060 B12R2.27 O=C[C@@H]1O[C@H]1C2CCCCC2 Amb26386163 [0,0,0,2,0,0|1,0,0]=3 5061 B12R2.27 OC[C@@H]1C[C@@H]1C2CCCCC2 Amb28071027 [0,0,0,2,0,0|0,0,2]=4 5062 B12R2.27 OC[C@@H]1C[C@H]1C2CCCCC2 Amb27428247 [0,0,0,2,0,0|0,0,2]=4 5063 B12R2.27 OC[C@H]1C[C@@H]1C2CCCCC2 Amb27420304 [0,0,0,2,0,0|0,0,2]=4 5064 B12R2.35 BrCC1CCC12CCCCC2 Amb29874131 [0,0,0,2,0,0|1,0,1]=4 5065 B12R2.35 ClCC1CCC12CCCCC2 Amb29874130 [0,0,0,2,0,0|1,0,1]=4 5066 B12R2.35 N#CC1CCC12CCCCC2 Amb29873612 [0,0,0,2,0,0|1,0,1]=4 5067 B12R2.35 NCC1CCC12CCCCC2 Amb29874154 [0,0,0,2,0,0|1,0,1]=4 5068 B12R2.35 O=CC1CCC12CCCCC2 Amb28186611 [0,0,0,2,0,0|0,0,0]=2 5069 B12R2.35 OCC1CCC12CCCCC2 Amb35619207 [0,0,0,2,0,0|0,0,2]=4 5070 B12R2.35 ONC1CCC12CCCCC2 Amb35739586 [0,0,0,2,0,0|1,0,1]=4 5071 B12R2.186 BrCCC1CC2CCC1CC2 Amb35615755 [0,0,0,2,0,0|1,0,1]=4 5072 B12R2.186 C=CCC1CN2CCC1CC2 Amb27630688 [0,0,0,2,0,0|2,0,0]=4 5073 B12R2.186 CNCC1CC2CCC1CC2 Amb27493051 [0,0,0,2,0,0|2,0,0]=4 5074 B12R2.186 CNC[C@@H]1C[C@@H]2C=C[C@@H]1CC2 Amb27440497 [0,0,0,2,0,0|2,0,0]=4 5075 B12R2.186 ClCCC1CC2C=CC1CC2 Amb30018616 [0,0,0,2,0,0|2,0,0]=4 5076 B12R2.186 ClCCC1CC2CCC1CC2 Amb35726307 [0,0,0,2,0,0|1,0,1]=4 5077 B12R2.186 NCCC1CC2C=CC1CC2 Amb27789113 [0,0,0,2,0,0|2,0,0]=4 5078 B12R2.186 NOCC1CC2CCC1CC2 Amb35721743 [0,0,0,2,0,0|2,0,0]=4 5079 B12R2.186 O=CCC1CC2CCC1CC2 Amb35721833 [0,0,0,2,0,0|0,0,0]=2 5080 B12R2.186 O=CCN1CC2CCC1CC2 Amb27405329 [0,0,0,2,0,0|1,0,0]=3 5081 B12R2.186 O=CNC1CC2CCC1CC2 Amb28365786 [0,0,0,2,0,0|1,0,0]=3 5082 B12R2.186 O=CNC1CN2CCC1CC2 Amb27255531 [0,0,0,2,0,0|2,0,0]=4 5083 B12R2.186 ONCC1CC2CCC1CC2 Amb35627301 [0,0,0,2,0,0|1,0,1]=4 5084 B12R2.1509 CNCCC1[C@H]2CCCC[C@@H]12 Amb27215669 [0,0,0,2,0,0|2,0,0]=4 5085 B12R2.1509 NCCCC1[C@H]2CCCC[C@@H]12 Amb27209958 [0,0,0,2,0,0|1,0,1]=4 5086 B12R2.1509 O=CCCC1C2CCCNC12 Amb28349285 [0,0,0,2,0,0|1,0,0]=3 5087 B12R2.1509 O=CCCC1[C@H]2CCCO[C@@H]12 Amb27965703 [0,0,0,2,0,0|1,0,0]=3 5088 B12R2.1974 C=CCCCN1CCC2CC21 Amb27270314 [0,0,0,2,0,0|2,0,0]=4 5089 B12R2.1974 C=CCCNC1CCC2CC21 Amb27269578 [0,0,0,2,0,0|2,0,0]=4 5090 B12R2.1974 C=CCCNC1CC[C@@H]2C[C@H]12 Amb27672848 [0,0,0,2,0,0|2,0,0]=4 5091 B12R2.2057 C1=CC(CNC2CC2)CCC1 Amb27253950 [0,0,0,2,0,0|2,0,0]=4 5092 B12R2.2057 C1CCC(CCC2CC2)NC1 Amb18296301 [0,0,0,2,0,0|1,0,1]=4 5093 B12R2.2057 C1CCC(CCC2CO2)CC1 Amb28397107 [0,0,0,2,0,0|0,0,2]=4 5094 B12R2.2057 C1CNCC(CCC2CC2)C1 Amb27241623 [0,0,0,2,0,0|2,0,0]=4 5095 B12R2.2058 C1CC(CC2CCCNC2)C1 Amb22642808 [0,0,0,2,0,0|2,0,0]=4 5096 B12R2.2058 C1CCC(CC2CCC2)NC1 Amb22642849 [0,0,0,2,0,0|1,0,1]=4 5097 B12R2.2058 C1CCC(CC2CCC2)NC1 Amb35745517 [0,0,0,2,0,0|1,0,1]=4 5098 B12R2.2058 C1CCC(CC2CCN2)CC1 Amb26494845 [0,0,0,2,0,0|1,0,1]=4 5099 B12R2.2058 C1CCC(CC2CNC2)CC1 Amb18960078 [0,0,0,2,0,0|2,0,0]=4 5100 B12R2.4370 C1CCC2(CC1)CCCCC2 Amb27169776 [0,0,0,2,0,0|1,0,1]=4 5101 B12R2.4370 C1CCC2(CC1)CCCCN2 Amb18200900 [0,0,0,2,0,0|1,0,1]=4 5102 B12R2.4370 C1CCC2(CC1)CCCCN2 Amb33299310 [0,0,0,2,0,0|1,0,1]=4 5103 B12R2.4370 C1CCC2(CC1)CCCNC2 Amb2786554 [0,0,0,2,0,0|2,0,0]=4 5104 B12R2.18 C=C1C(=O)C[C@H]2CCCC[C@H]12 Amb28457413 [0,0,0,2,0,0|0,0,2]=4 5105 B12R2.18 C=C1C(O)CC2CCCCC12 Amb27768502 [0,0,0,2,0,0|2,0,0]=4 5106 B12R2.18 C=C1CC2CCCCC2C1O Amb28063939 [0,0,0,2,0,0|2,0,0]=4 5107 B12R2.18 CC1=C2CCCCC2CC1=O Amb28381119 [0,0,0,2,0,0|0,0,2]=4 5108 B12R2.18 CC1=C[C@H]2CCCC[C@H]2C1=O Amb28077352 [0,0,0,2,0,0|0,0,2]=4 5109 B12R2.18 CC1C(=O)NC2CCCCC21 Amb27169069 [0,0,0,2,0,0|1,0,0]=3 5110 B12R2.18 CC1CC2CCCCN2C1=O Amb27664094 [0,0,0,2,0,0|1,0,0]=3 5111 B12R2.18 CC1CC2CNCCN2C1=O Amb24092221 [0,0,0,2,0,0|2,0,0]=4 5112 B12R2.18 CN1C(=O)CC2CNCCC21 Amb24652663 [0,0,0,2,0,0|2,0,0]=4 5113 B12R2.18 CN1C(=O)CC2CNCCC21 Amb33456914 [0,0,0,2,0,0|2,0,0]=4 5114 B12R2.18 CN1C(=O)C[C@@H]2CCNC[C@H]21 Amb18200728 [0,0,0,2,0,0|2,0,0]=4 5115 B12R2.18 CN1C(=O)C[C@@H]2CNCC[C@H]21 Amb18200732 [0,0,0,2,0,0|2,0,0]=4 5116 B12R2.18 CN1C(=O)C[C@H]2CCCC[C@H]21 Amb27805058 [0,0,0,2,0,0|1,0,0]=3 5117 B12R2.18 CN1C(=O)C[C@H]2CNCC[C@H]21 Amb33457465 [0,0,0,2,0,0|2,0,0]=4 5118 B12R2.18 CN1C(=O)C[C@H]2CNCC[C@H]21 Amb33457466 [0,0,0,2,0,0|2,0,0]=4 5119 B12R2.18 CN1C(=O)NC2CCCCC21 Amb28068628 [0,0,0,2,0,0|2,0,0]=4 5120 B12R2.18 CN1CC2CCCCC2C1=O Amb27480772 [0,0,0,2,0,0|1,0,0]=3 5121 B12R2.18 CN1CC2CCNCC2C1=O Amb22405961 [0,0,0,2,0,0|2,0,0]=4 5122 B12R2.18 CN1CC2CNCCC2C1=O Amb27593537 [0,0,0,2,0,0|2,0,0]=4 5123 B12R2.18 CN1CC2NCCCC2C1=O Amb25040182 [0,0,0,2,0,0|2,0,0]=4 5124 B12R2.18 CN1C[C@@H]2CCCC[C@@H]2C1=O Amb27818182 [0,0,0,2,0,0|1,0,0]=3 5125 B12R2.18 CN1C[C@@H]2CCNC[C@@H]2C1=O Amb23439202 [0,0,0,2,0,0|2,0,0]=4 5126 B12R2.18 CN1C[C@@H]2CCNC[C@H]2C1=O Amb34915199 [0,0,0,2,0,0|2,0,0]=4 5127 B12R2.18 CN1C[C@@H]2NCCC[C@@H]2C1=O Amb25211932 [0,0,0,2,0,0|2,0,0]=4 5128 B12R2.18 CN1C[C@H]2CCNC[C@H]2C1=O Amb26433329 [0,0,0,2,0,0|2,0,0]=4 5129 B12R2.18 CN1C[C@H]2NCCC[C@H]2C1=O Amb26528635 [0,0,0,2,0,0|2,0,0]=4 5130 B12R2.18 C[C@@H]1C(=O)C[C@@H]2CCCC[C@H]21 Amb28202052 [0,0,0,2,0,0|0,0,0]=2 5131 B12R2.18 C[C@@H]1O[C@@H]2CCCC[C@@H]2C1=O Amb28052415 [0,0,0,2,0,0|1,0,0]=3 5132 B12R2.18 C[C@H]1C[C@@H]2CNCCN2C1=O Amb25359747 [0,0,0,2,0,0|2,0,0]=4 5133 B12R2.18 NC1C(=O)O[C@H]2CCCC[C@H]12 Amb28134744 [0,0,0,2,0,0|2,0,0]=4 5134 B12R2.18 NC1CC2CCCCN2C1=O Amb27968651 [0,0,0,2,0,0|2,0,0]=4 5135 B12R2.18 NC1CC2CCCCN2C1=O Amb28719604 [0,0,0,2,0,0|2,0,0]=4 5136 B12R2.18 N[C@@H]1C(=O)O[C@H]2CCCC[C@H]21 Amb27629634 [0,0,0,2,0,0|2,0,0]=4 5137 B12R2.18 N[C@H]1C(=O)O[C@@H]2CCCC[C@@H]21 Amb25919463 [0,0,0,2,0,0|2,0,0]=4 5138 B12R2.18 O=C1C(O)CC2CCCCC12 Amb27486139 [0,0,0,2,0,0|1,0,0]=3 5139 B12R2.18 O=C1CC2CCCCC2C1Br Amb27194317 [0,0,0,2,0,0|1,0,0]=3 5140 B12R2.18 O=C1C[C@@H]2CCCC[C@@H]2C1Br Amb27643537 [0,0,0,2,0,0|1,0,0]=3 5141 B12R2.18 O=C1C[C@@H]2CCCC[C@@H]2C1Cl Amb28291598 [0,0,0,2,0,0|1,0,0]=3 5142 B12R2.18 O=C1C[C@@H]2CCCC[C@@H]2[C@@H]1Cl Amb27419916 [0,0,0,2,0,0|1,0,0]=3 5143 B12R2.18 O=C1C[C@@H]2CCCC[C@@H]2[C@H]1Cl Amb27419917 [0,0,0,2,0,0|1,0,0]=3 5144 B12R2.18 O=C1O[C@@H]2CCCC[C@@H]2[C@@H]1O Amb27197167 [0,0,0,2,0,0|2,0,0]=4 5145 B12R2.165 O=CCN1C2CCC1COC2 Amb35596429 [0,0,0,2,0,0|2,0,0]=4 5146 B12R2.165 O=CCN1C2CCCC1CC2 Amb27435659 [0,0,0,2,0,0|1,0,0]=3 5147 B12R2.185 CCCC1CC2CCC1C2O Amb27206030 [0,0,0,2,0,0|0,0,2]=4 5148 B12R2.185 CCC[C@@H]1C[C@H]2CC[C@@H]1C2O Amb27631952 [0,0,0,2,0,0|0,0,2]=4 5149 B12R2.185 CCOC1CC2CCC1C2=O Amb28351557 [0,0,0,2,0,0|1,0,0]=3 5150 B12R2.185 CCO[C@@H]1C[C@H]2CC[C@@H]1C2=O Amb27199143 [0,0,0,2,0,0|1,0,0]=3 5151 B12R2.185 O=COC1CC2CCC1C2Cl Amb27646556 [0,0,0,2,0,0|2,0,0]=4 5152 B12R2.259 CCCC1CCCCC12CO2 Amb33745413 [0,0,0,2,0,0|0,0,2]=4 5153 B12R2.259 NCCC1CCCCC12CC2 Amb18200888 [0,0,0,2,0,0|1,0,1]=4 5154 B12R2.333 NCC1CC2C=CC1CCC2 Amb28421926 [0,0,0,2,0,0|2,0,0]=4 5155 B12R2.333 O=CC1CC2C=CC1CCC2 Amb27794854 [0,0,0,2,0,0|0,0,2]=4 5156 B12R2.333 OCC1CC2C=CC1CCC2 Amb27651569 [0,0,0,2,0,0|2,0,0]=4 5157 B12R2.377 CC1CC2CC1CCC2CO Amb25097850 [0,0,0,2,0,0|0,0,2]=4 5158 B12R2.377 CO[C@@H]1CCC2C[C@@H]1NC2=O Amb28205946 [0,0,0,2,0,0|2,0,0]=4 5159 B12R2.2048 CNC1CCCCC1C2CC2 Amb27977221 [0,0,0,2,0,0|2,0,0]=4 5160 B12R2.2048 N#CC1CCCCC1C2CC2 Amb27851224 [0,0,0,2,0,0|1,0,1]=4 5161 B12R2.2048 NCC1CCCCC1C2CC2 Amb26372291 [0,0,0,2,0,0|1,0,1]=4 5162 B12R2.2048 NCC1CCCCC1C2CC2 Amb28652981 [0,0,0,2,0,0|1,0,1]=4 5163 B12R2.2048 NNC1CCCCC1C2CC2 Amb29853672 [0,0,0,2,0,0|2,0,0]=4 5164 B12R2.2048 O=CC1CCCCN1C2CC2 Amb27864418 [0,0,0,2,0,0|1,0,0]=3 5165 B12R2.2048 ONC1CCCCC1C2CC2 Amb35669342 [0,0,0,2,0,0|1,0,1]=4 5166 B12R2.2112 BrCC1CCCCC12CCC2 Amb33620501 [0,0,0,2,0,0|1,0,1]=4 5167 B12R2.2112 CCC1CCCCC12CCN2 Amb28411631 [0,0,0,2,0,0|1,0,1]=4 5168 B12R2.2112 NCC1CCCCC12CCC2 Amb24727601 [0,0,0,2,0,0|1,0,1]=4 5169 B12R2.2112 NCC1CCCCC12CCC2 Amb33483295 [0,0,0,2,0,0|1,0,1]=4 5170 B12R2.2112 OCC1CCCCC12CCC2 Amb27980363 [0,0,0,2,0,0|0,0,2]=4 5171 B12R2.4823 C=CB1C2CCCC1CCC2 Amb28436794 [0,0,0,2,0,0|2,0,0]=4 5172 B12R2.211 CC1CC1CN2CCNC2=O Amb27591962 [0,0,0,2,0,0|2,0,0]=4 5173 B12R2.211 CC1CC1CN2CNCC2=O Amb27765089 [0,0,0,2,0,0|2,0,0]=4 5174 B12R2.211 C[C@@H]1C[C@H]1NC2CCOC2=O Amb27857429 [0,0,0,2,0,0|2,0,0]=4 5175 B12R2.261 CC1CC12CCCC2CCN Amb33494104 [0,0,0,2,0,0|1,0,1]=4 5176 B12R2.270 C=CCNC1CCC2CC2C1 Amb35703689 [0,0,0,2,0,0|2,0,0]=4 5177 B12R2.270 CNCCC1CCC2CC2C1 Amb35703883 [0,0,0,2,0,0|2,0,0]=4 5178 B12R2.270 NCCCC1CCC2CC2C1 Amb35668780 [0,0,0,2,0,0|1,0,1]=4 5179 B12R2.270 NNCCC1CCC2CC2C1 Amb35704831 [0,0,0,2,0,0|2,0,0]=4 5180 B12R2.270 O=C=NCC1CCC2CC2C1 Amb35714927 [0,0,0,2,0,0|1,0,1]=4 5181 B12R2.270 O=CCCN1CCC2CC2C1 Amb35631232 [0,0,0,2,0,0|1,0,0]=3 5182 B12R2.270 O=CNCC1CCC2CC2C1 Amb35715086 [0,0,0,2,0,0|1,0,0]=3 5183 B12R2.270 O=C\C=C\C1CCC2CC2C1 Amb35600638 [0,0,0,2,0,0|0,0,2]=4 5184 B12R2.270 OCCCC1CCC2CC2C1 Amb33213491 [0,0,0,2,0,0|0,0,2]=4 5185 B12R2.384 BrC1CC12CCCCCCC2 Amb32649173 [0,0,0,2,0,0|1,0,1]=4 5186 B12R2.433 NC1CC1C2CCCCCC2 Amb27480603 [0,0,0,2,0,0|1,0,1]=4 5187 B12R2.433 N[C@@H]1C[C@H]1C2CCCCCC2 Amb32877151 [0,0,0,2,0,0|1,0,1]=4 5188 B12R2.550 O=C1CCCCCC2CC2C1 Amb28122424 [0,0,0,2,0,0|0,0,0]=2 5189 B12R2.670 BrC1C2CCCCCCCC12 Amb28197196 [0,0,0,2,0,0|1,0,1]=4 5190 B12R2.2016 C1CCCCC2OC2CCC1 Amb6358048 [0,0,0,2,0,0|0,0,2]=4 5191 B12R2.1114 O=C1CCCC1SC2COC2 Amb27247317 [0,0,0,2,0,0|2,0,0]=4 5192 B12R2.1114 O=C1CCCN1CC2CNC2 Amb23598551 [0,0,0,2,0,0|2,0,0]=4 5193 B12R2.1114 O=C1NCCC1NC2CCC2 Amb35685835 [0,0,0,2,0,0|2,0,0]=4 5194 B12R2.1114 O=C1NCCN1CC2CCC2 Amb28454345 [0,0,0,2,0,0|2,0,0]=4 5195 B12R2.1114 OC1CCCC1CC2CCC2 Amb24704825 [0,0,0,2,0,0|0,0,2]=4 5196 B12R2.1114 O[C@@H]1CCC[C@H]1CC2CCC2 Amb32945349 [0,0,0,2,0,0|0,0,2]=4 5197 B12R2.1310 O=C1CCC1CCN2CCC2 Amb32697981 [0,0,0,2,0,0|1,0,0]=3 5198 B12R2.1310 OC1CCC1CCC2CCC2 Amb33213766 [0,0,0,2,0,0|0,0,2]=4 5199 B12R2.1462 NCCC1CCCC12CCC2 Amb26952878 [0,0,0,2,0,0|1,0,1]=4 5200 B12R2.1517 C=CCCN1CCC12CCC2 Amb27661917 [0,0,0,2,0,0|2,0,0]=4 5201 B12R2.3807 C1CCCC(C2CCN2)CC1 Amb25071204 [0,0,0,2,0,0|1,0,1]=4 5202 B12R2.3807 C1CCCC(C2CCN2)CC1 Amb33078341 [0,0,0,2,0,0|1,0,1]=4 5203 B12R2.3807 C1CCCC(C2CNC2)CC1 Amb27425304 [0,0,0,2,0,0|2,0,0]=4 5204 B12R2.3807 C1CCCC(C2CNC2)CC1 Amb32645741 [0,0,0,2,0,0|2,0,0]=4 5205 B12R2.3807 C1CCNC(C2CCC2)CC1 Amb2237262 [0,0,0,2,0,0|1,0,1]=4 5206 B12R2.4327 C1CCCC2(CCC1)CCN2 Amb24608219 [0,0,0,2,0,0|1,0,1]=4 5207 B12R2.371 CN1C2CCC(C=O)C1CC2 Amb26927499 [0,0,0,2,0,0|1,0,0]=3 5208 B12R2.496 CC1C(O)[C@H]2CCCCC[C@H]12 Amb28127342 [0,0,0,2,0,0|0,0,2]=4 5209 B12R2.586 CC1NCC2CCCCCC21 Amb27394077 [0,0,0,2,0,0|1,0,1]=4 5210 B12R2.586 O=C1CCC2CCNCCN12 Amb24728512 [0,0,0,2,0,0|2,0,0]=4 5211 B12R2.586 O=C1CCC2CNCCCN12 Amb27962737 [0,0,0,2,0,0|2,0,0]=4 5212 B12R2.586 O=C1CC[C@@H]2CC=CCC[C@H]12 Amb28285915 [0,0,0,2,0,0|0,0,2]=4 5213 B12R2.586 O=C1CC[C@@H]2CCCCC[C@H]12 Amb28351654 [0,0,0,2,0,0|0,0,0]=2 5214 B12R2.586 O=C1NC[C@@H]2CCCCC[C@H]12 Amb27853850 [0,0,0,2,0,0|1,0,0]=3 5215 B12R2.586 O[C@@H]1CC[C@@H]2CCCCC[C@@H]21 Amb27651831 [0,0,0,2,0,0|0,0,2]=4 5216 B12R2.586 O[C@H]1CC[C@@H]2CCCCC[C@H]12 Amb27478671 [0,0,0,2,0,0|0,0,2]=4 5217 B12R2.1809 CCC1CCCCCC12CO2 Amb33736260 [0,0,0,2,0,0|0,0,2]=4 5218 B12R2.1809 NCC1CCCCCC12CC2 Amb18831053 [0,0,0,2,0,0|1,0,1]=4 5219 B12R2.181 C\C=C\[C@H]1CC12CCCC2=O Amb28182523 [0,0,0,2,0,0|0,0,2]=4 5220 B12R2.319 BrCC1CCCC2CC2CC1 Amb32862951 [0,0,0,2,0,0|1,0,1]=4 5221 B12R2.319 ClCC1CCCC2CC2CC1 Amb32862949 [0,0,0,2,0,0|1,0,1]=4 5222 B12R2.319 NCC1CCCC2CC2CC1 Amb33037180 [0,0,0,2,0,0|1,0,1]=4 5223 B12R2.319 O=CC1CCCC2CC2CC1 Amb32862948 [0,0,0,2,0,0|0,0,0]=2 5224 B12R2.319 OCC1CCCC2CC2CC1 Amb24412063 [0,0,0,2,0,0|0,0,2]=4 5225 B12R2.815 O=C=N[C@@H]1[C@H]2CCCCC[C@H]21 Amb27863630 [0,0,0,2,0,0|1,0,1]=4 5226 B12R2.815 O=CCC1C2CCCCCC12 Amb28052748 [0,0,0,2,0,0|0,0,0]=2 5227 B12R2.100 CC1CC2CCCC2CC1=O Amb27974632 [0,0,0,2,0,0|0,0,0]=2 5228 B12R2.100 CN1CC2CCCC2OC1=O Amb26647625 [0,0,0,2,0,0|2,0,0]=4 5229 B12R2.100 CN1CC2CCCN2CC1=O Amb26444084 [0,0,0,2,0,0|2,0,0]=4 5230 B12R2.100 C[C@H]1C[C@@H]2CCC[C@H]2CC1=O Amb28246543 [0,0,0,2,0,0|0,0,0]=2 5231 B12R2.100 O=C1CC2CCCC2CC1Cl Amb27233754 [0,0,0,2,0,0|1,0,0]=3 5232 B12R2.100 O=C1CC2CCCC2C[C@@H]1Cl Amb27760475 [0,0,0,2,0,0|1,0,0]=3 5233 B12R2.100 O=C1C[C@@H]2CCC[C@H]2C[C@@H]1F Amb28202236 [0,0,0,2,0,0|1,0,0]=3 5234 B12R2.100 O=C1C[C@@H]2CCC[C@H]2C[C@H]1Br Amb27466417 [0,0,0,2,0,0|1,0,0]=3 5235 B12R2.100 O=C1C[C@@H]2CCC[C@H]2C[C@H]1F Amb28202237 [0,0,0,2,0,0|1,0,0]=3 5236 B12R2.100 O=C1C[C@H]2CCC[C@@H]2CC1Br Amb27463376 [0,0,0,2,0,0|1,0,0]=3 5237 B12R2.100 O=C1O[C@H]2CCC[C@H]2C[C@@H]1Br Amb27438477 [0,0,0,2,0,0|2,0,0]=4 5238 B12R2.100 O=C1O[C@H]2CCC[C@H]2C[C@H]1Br Amb27624558 [0,0,0,2,0,0|2,0,0]=4 5239 B12R2.1083 O=C1CCC[C@@H]2CCC[C@]12O Amb28202036 [0,0,0,2,0,0|1,0,0]=3 5240 B12R2.2318 O=C1CCC2CC2CCC1O Amb26484308 [0,0,0,2,0,0|1,0,0]=3 5241 B12R2.2474 O=C1CCCCCC[C@@H]2C[C@H]12 Amb28429558 [0,0,0,2,0,0|0,0,0]=2 5242 B12R2.2474 O=C1CCCCCC[C@H]2C[C@@H]12 Amb27435391 [0,0,0,2,0,0|0,0,0]=2 5243 B12R2.2474 O[C@@H]1C=CCCCC[C@H]2C[C@@H]12 Amb28345000 [0,0,0,2,0,0|2,0,0]=4 5244 B12R2.2474 O[C@@H]1CCCCCC[C@@H]2C[C@H]12 Amb28321536 [0,0,0,2,0,0|0,0,2]=4 5245 B12R2.2474 O[C@H]1CCCCCC[C@H]2C[C@@H]12 Amb27428279 [0,0,0,2,0,0|0,0,2]=4 5246 B12R2.466 O=C1CCCC1CCC2CC2 Amb28248743 [0,0,0,2,0,0|0,0,0]=2 5247 B12R2.466 O=C1NCCC1NCC2CC2 Amb35685834 [0,0,0,2,0,0|2,0,0]=4 5248 B12R2.466 O=C1NCCN1CCC2CC2 Amb27839948 [0,0,0,2,0,0|2,0,0]=4 5249 B12R2.466 OC1CCCC1CCC2CC2 Amb26561650 [0,0,0,2,0,0|0,0,2]=4 5250 B12R2.466 O[C@@H]1CCC[C@H]1CCC2CC2 Amb32944233 [0,0,0,2,0,0|0,0,2]=4 5251 B12R2.1298 OC1CCC1CCCC2CC2 Amb32944745 [0,0,0,2,0,0|0,0,2]=4 5252 B12R2.2274 C=CCN1CCCC1C2CC2 Amb28065482 [0,0,0,2,0,0|2,0,0]=4 5253 B12R2.2274 O=CCC1CCCN1C2CC2 Amb28245634 [0,0,0,2,0,0|1,0,0]=3 5254 B12R2.2333 O=CNCC1CCN1C2CC2 Amb35616289 [0,0,0,2,0,0|2,0,0]=4 5255 B12R2.3808 C1CCCC(CC2CO2)CC1 Amb24670704 [0,0,0,2,0,0|0,0,2]=4 5256 B12R2.114 O=C1C=CC[C@@H]2CCC[C@@H]2C1 Amb28411254 [0,0,0,2,0,0|0,0,2]=4 5257 B12R2.114 O=C1CC2CCNC2CCN1 Amb27175292 [0,0,0,2,0,0|2,0,0]=4 5258 B12R2.114 O=C1CCC=C2CCCC2C1 Amb27973068 [0,0,0,2,0,0|0,0,2]=4 5259 B12R2.114 O=C1CCCC2CNCC2N1 Amb28366921 [0,0,0,2,0,0|2,0,0]=4 5260 B12R2.114 O=C1CCC[C@@H]2C=CC[C@@H]2C1 Amb27802704 [0,0,0,2,0,0|0,0,2]=4 5261 B12R2.114 O=C1CCC[C@@H]2CNC[C@@H]2N1 Amb33521821 [0,0,0,2,0,0|2,0,0]=4 5262 B12R2.114 O=C1CCC[C@@H]2CNC[C@H]2N1 Amb18200733 [0,0,0,2,0,0|2,0,0]=4 5263 B12R2.114 O=C1CCC[C@H]2CCC[C@@H]2C1 Amb27434256 [0,0,0,2,0,0|0,0,0]=2 5264 B12R2.114 O=C1COCC2CCCC2N1 Amb26394403 [0,0,0,2,0,0|2,0,0]=4 5265 B12R2.2017 C1=C2CCCCC(CCC1)N2 Amb27798332 [0,0,0,2,0,0|1,0,1]=4 5266 B12R2.2017 C1CCC2CCCCC(C1)N2 Amb27642433 [0,0,0,2,0,0|1,0,1]=4 5267 B12R2.191 CCCC1CC2CC1CC2O Amb27972433 [0,0,0,2,0,0|0,0,2]=4 5268 B12R2.191 CCC[C@H]1C[C@@H]2C[C@H]1CC2=O Amb28052552 [0,0,0,2,0,0|0,0,0]=2 5269 B12R2.191 CCOC1CC2CC1CC2=O Amb27823436 [0,0,0,2,0,0|1,0,0]=3 5270 B12R2.191 O=C1CC2CC1CC2CCO Amb27596944 [0,0,0,2,0,0|1,0,0]=3 5271 B12R2.4960 O=CCC12CCCN1CCC2 Amb27954065 [0,0,0,2,0,0|1,0,0]=3 5272 B12R2.4960 O=CCC12CCC[C@H]1OCC2 Amb33274972 [0,0,0,2,0,0|1,0,0]=3 5273 B12R2.4960 OCCC12CCCC1CCC2 Amb27649794 [0,0,0,2,0,0|0,0,2]=4 5274 B12R2.39 C=CCN1CC2CCCC2C1 Amb27840278 [0,0,0,2,0,0|2,0,0]=4 5275 B12R2.39 O=CCC1C[C@H]2CCC[C@@H]2C1 Amb27881840 [0,0,0,2,0,0|0,0,0]=2 5276 B12R2.39 OCCC1C[C@H]2CCC[C@@H]2C1 Amb28455094 [0,0,0,2,0,0|0,0,2]=4 5277 B12R2.4839 O=CC1C2C=CCCCCC12 Amb27949620 [0,0,0,2,0,0|0,0,2]=4 5278 B12R2.4839 OC[C@H]1[C@H]2CCCCCC[C@@H]12 Amb28079207 [0,0,0,2,0,0|0,0,2]=4 5279 B12R2.96 C=C1CCCC12CCCC2=O Amb27486116 [0,0,0,2,0,0|0,0,2]=4 5280 B12R2.96 C=C1CCC[C@@]12CCC[C@H]2O Amb27206107 [0,0,0,2,0,0|2,0,0]=4 5281 B12R2.96 CC1CC=CC12CCCC2=O Amb24553806 [0,0,0,2,0,0|0,0,2]=4 5282 B12R2.96 CC1CCCC12CCCC2=O Amb28200017 [0,0,0,2,0,0|0,0,0]=2 5283 B12R2.96 CC1CNCC12CCCC2=O Amb32649035 [0,0,0,2,0,0|1,0,0]=3 5284 B12R2.96 CN1CCCC12CCOC2=O Amb27432418 [0,0,0,2,0,0|2,0,0]=4 5285 B12R2.96 NC1CCCC12CCCC2=O Amb27176542 [0,0,0,2,0,0|1,0,0]=3 5286 B12R2.96 O=C1CCCC12CCCC2=O Amb26494477 [0,0,0,2,0,0|1,0,1]=4 5287 B12R2.96 O=C1CCCC12OCCC2Br Amb27879593 [0,0,0,2,0,0|2,0,0]=4 5288 B12R2.182 CCCC1=C[C@H]2C(=O)CC[C@@H]12 Amb28198609 [0,0,0,2,0,0|0,0,2]=4 5289 B12R2.182 CCOC1C[C@H]2C(=O)CC[C@@H]12 Amb27440453 [0,0,0,2,0,0|1,0,0]=3 5290 B12R2.182 CCO[C@@H]1C[C@@H]2C(=O)CC[C@@H]21 Amb27427590 [0,0,0,2,0,0|1,0,0]=3 5291 B12R2.182 CCO[C@H]1C[C@@H]2C(=O)CC[C@H]12 Amb27195790 [0,0,0,2,0,0|1,0,0]=3 5292 B12R2.305 CN1CCCC1C2CC2C=O Amb28345340 [0,0,0,2,0,0|1,0,0]=3 5293 B12R2.2092 CCCCC1[C@@H]2CCC(O)[C@H]12 Amb27653138 [0,0,0,2,0,0|0,0,2]=4 5294 B12R2.2092 CCCC[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27434195 [0,0,0,2,0,0|0,0,0]=2 5295 B12R2.2092 CCCC[C@@H]1[C@@H]2CC[C@@H](O)[C@@H]21 Amb27422532 [0,0,0,2,0,0|0,0,2]=4 5296 B12R2.2092 CCOCC1C2CCC(=O)C21 Amb28201173 [0,0,0,2,0,0|1,0,0]=3 5297 B12R2.2092 CN1CCC2C(CCC=O)C21 Amb27489114 [0,0,0,2,0,0|1,0,0]=3 5298 B12R2.285 O=CCCN1CC2CCC2C1 Amb35626495 [0,0,0,2,0,0|1,0,0]=3 5299 B12R2.1676 NCC1CC12CCCCCC2 Amb18280397 [0,0,0,2,0,0|1,0,1]=4