0 B11R0.3 C=CCCCCC#CCCC#C Amb17779515 [0,0,0,0,0,0|1,0,3]=4 1 B11R0.3 C=CCCCCCCCCC=C Amb19944679 [0,0,0,0,0,0|1,0,0]=1 2 B11R0.3 C=CCCCCCCCC[Mg]Br Amb22897280 [0,0,0,0,0,0|2,0,0]=2 3 B11R0.3 C=CCCCCCCCC[Zn]Br Amb22898142 [0,0,0,0,0,0|2,0,0]=2 4 B11R0.3 C=COCCCCCCOC=C Amb22351238 [0,0,0,0,0,0|3,0,0]=3 5 B11R0.3 CCCCCCCCCCCF Amb17939015 [0,0,0,0,0,0|1,0,3]=4 6 B11R0.3 CCCCCCCCCCCS Amb22366963 [0,0,0,0,0,0|0,1,3]=4 7 B11R0.3 CCCCCCCCCCOC Amb21520322 [0,0,0,0,0,0|2,0,2]=4 8 B11R0.3 CCCCCCCCCC[13CH]=[13CH2] Amb22351201 [0,0,0,0,0,0|1,0,1]=2 9 B11R0.3 CCCCCCCCCC[Hg]Cl Amb22359876 [0,0,0,0,0,0|2,0,2]=4 10 B11R0.3 CCCCCCCCCC[Mg]Br Amb22363113 [0,0,0,0,0,0|2,0,2]=4 11 B11R0.3 CCCCCCCCCC[Mg]Cl Amb22737569 [0,0,0,0,0,0|2,0,2]=4 12 B11R0.3 CCCCCCCCCN=C=O Amb22336763 [0,0,0,0,0,0|1,0,3]=4 13 B11R0.3 CCCCCCCCOCC=O Amb18807440 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [0,0,0,0,0,0|0,0,4]=4 15 B11R0.3 CC\C=C/CCCCCCC=O Amb10807471 [0,0,0,0,0,0|0,0,4]=4 16 B11R0.3 CNCCCCCCCCNC Amb22336315 [0,0,0,0,0,0|3,0,1]=4 17 B11R0.3 COCCCCCCCCOC Amb21618846 [0,0,0,0,0,0|3,0,1]=4 18 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [0,0,0,0,0,0|0,0,4]=4 19 B11R0.3 ICCCCCCCCCCI Amb10071532 [0,0,0,0,0,0|2,0,2]=4 20 B11R0.3 NCCCCCCCCCCBr Amb17609917 [0,0,0,0,0,0|2,0,2]=4 21 B11R0.3 NCCCCCCCCCCN Amb22732919 [0,0,0,0,0,0|2,0,2]=4 22 B11R0.3 NCCCCCCCCCCO Amb17607975 [0,0,0,0,0,0|1,0,3]=4 23 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [0,0,0,0,0,0|1,0,1]=2 24 B11R0.3 O=CCCSCCSCCC=O Amb22474335 [0,0,0,0,0,0|3,0,0]=3 25 B11R0.3 OCCCCCCCCCCCl Amb10844747 [0,0,0,0,0,0|1,0,3]=4 26 B10R0.71 C=CCCCCCCCC=C Amb22729808 [1,0,0,0,0,0|0,0,1]=2 27 B10R0.71 C=CCCCCCCCC=O Amb22734770 [1,0,0,0,0,0|0,0,0]=1 28 B10R0.71 C=CCCCCCCCCCl Amb22898754 [1,0,0,0,0,0|1,0,0]=2 29 B10R0.71 CCCCCCCCCNC Amb10609826 [1,0,0,0,0,0|1,0,2]=4 30 B10R0.71 CCCCCCCCCOC Amb2582537 [1,0,0,0,0,0|1,0,2]=4 31 B10R0.71 CCCCCCCCCSC Amb22230926 [1,0,0,0,0,0|1,0,2]=4 32 B10R0.71 CCCCCCCCC[Mg]Br Amb22000598 [1,0,0,0,0,0|2,0,1]=4 33 B10R0.71 CCCCCCCCC[Zn]Br Amb22000508 [1,0,0,0,0,0|2,0,1]=4 34 B10R0.71 CCCCCCCCOC=O Amb22231360 [1,0,0,0,0,0|1,0,1]=3 35 B10R0.71 CCCCC\C=C\CCC=O Amb10071527 [1,0,0,0,0,0|0,0,3]=4 36 B10R0.71 COCCCCCCCCO Amb17617052 [1,0,0,0,0,0|1,0,2]=4 37 B10R0.71 ICCCCCCCCCI Amb20242392 [1,0,0,0,0,0|2,0,1]=4 38 B10R0.71 N#CCCCCCCCCO Amb22641582 [1,0,0,0,0,0|1,0,2]=4 39 B10R0.71 O=CCCCCC\C=C/CC Amb10807429 [1,0,0,0,0,0|0,0,3]=4 40 B10R0.71 OCCCCCCCCC#C Amb16231465 [1,0,0,0,0,0|0,0,3]=4 41 B10R0.71 OCCCCCCCCCCl Amb16234125 [1,0,0,0,0,0|1,0,2]=4 42 B12R0.5 C=CCCCCCCCCCCBr Amb22899287 [0,1,0,0,0,0|1,0,1]=3 43 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [0,1,0,0,0,0|1,0,1]=3 44 B12R0.5 C=CCCCCCCCCC[Mg]Br Amb22897367 [0,1,0,0,0,0|1,0,1]=3 45 B12R0.5 C=CCCCCCCCCC[Zn]Br Amb22897886 [0,1,0,0,0,0|1,0,1]=3 46 B12R0.5 C=CCOCCNCCOCC=C Amb22524262 [0,1,0,0,0,0|3,0,0]=4 47 B12R0.5 CCCCCCCCCCN=C=O Amb22348014 [0,1,0,0,0,0|0,0,3]=4 48 B12R0.5 CCCCCCCCCCOC=C Amb22735088 [0,1,0,0,0,0|1,0,1]=3 49 B12R0.5 CCCCCCCCCC\C=C\Cl Amb22731233 [0,1,0,0,0,0|1,0,1]=3 50 B12R0.5 CCCCCCCCC\C=C\C=O Amb22351858 [0,1,0,0,0,0|0,0,3]=4 51 B12R0.5 CCCCCCCC\C=C\CC=O Amb22735030 [0,1,0,0,0,0|0,0,3]=4 52 B12R0.5 C\C=C\CCCCCCCCCO Amb22731398 [0,1,0,0,0,0|0,0,2]=3 53 B12R0.5 O=COCCCCCCCOC=O Amb22365094 [0,1,0,0,0,0|2,0,0]=3 54 B12R0.234 C=CCCCCCCCCC(=O)[O-] Amb10843808 [0,1,0,0,0,0|0,0,0]=1 55 B12R0.234 C=CCCCCCCCCC(O)=O Amb22353389 [0,1,0,0,0,0|0,0,0]=1 56 B12R0.234 C=CCCCCCCCCC(O)=O Amb22731323 [0,1,0,0,0,0|0,0,0]=1 57 B12R0.234 CC(=O)OCCCCCCCC=C Amb22733550 [0,1,0,0,0,0|1,0,0]=2 58 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,1,0,0,0,0|2,0,1]=4 59 B12R0.234 CC(C)CCCCCCCCC=O Amb22055859 [0,1,0,0,0,0|0,0,2]=3 60 B12R0.234 CCCCCCCCCOC(=O)Cl Amb22732385 [0,1,0,0,0,0|1,0,2]=4 61 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,1,0,0,0,0|1,0,1]=3 62 B12R1.8 C=CCCCOC1CCCCO1 Amb21961860 [0,0,0,1,0,0|1,0,2]=4 63 B12R1.8 C=CCCCOC1CNCCC1 Amb21957513 [0,0,0,1,0,0|3,0,0]=4 64 B12R1.8 C=CCOCCC1CCCCN1 Amb21956554 [0,0,0,1,0,0|2,0,1]=4 65 B12R1.8 C=CCOCCC1CNCCC1 Amb21956539 [0,0,0,1,0,0|3,0,0]=4 66 B12R1.8 C=CCSCCC1CCCCN1 Amb17503509 [0,0,0,1,0,0|2,0,1]=4 67 B12R1.8 O=CCCCOC1CCCCO1 Amb17620504 [0,0,0,1,0,0|2,0,1]=4 68 B12R1.18 C=C1CCCCCC1CCCCl Amb24565800 [0,0,0,1,0,0|1,0,1]=3 69 B12R1.18 C=C=CCC1CCCCCC1=O Amb25273025 [0,0,0,1,0,0|0,0,2]=3 70 B12R1.18 C=CCCC1CCCCCC1=O Amb24729033 [0,0,0,1,0,0|0,0,0]=1 71 B12R1.18 C=CCCC1CCCCCC1Br Amb24452398 [0,0,0,1,0,0|1,0,1]=3 72 B12R1.18 C=CCCC1CCCCNC1=O Amb24448445 [0,0,0,1,0,0|1,0,0]=2 73 B12R1.18 C=CCNC1CCCCCC1O Amb18970408 [0,0,0,1,0,0|1,0,2]=4 74 B12R1.18 C=CCN[C@@H]1CCCCC[C@H]1O Amb25337651 [0,0,0,1,0,0|1,0,2]=4 75 B12R1.18 C=CCOC1CCCCCC1=O Amb24633444 [0,0,0,1,0,0|1,0,0]=2 76 B12R1.18 C=CCOC1CCCCCC1N Amb25050869 [0,0,0,1,0,0|2,0,1]=4 77 B12R1.18 C=CCSC1CCCCCC1N Amb25338901 [0,0,0,1,0,0|2,0,1]=4 78 B12R1.18 C=CCSC1CCCCCC1O Amb24641065 [0,0,0,1,0,0|1,0,2]=4 79 B12R1.18 C=C\C=C\C1CCCCCC1=O Amb25202607 [0,0,0,1,0,0|0,0,2]=3 80 B12R1.18 CC#CCC1CCCCCC1=O Amb18798357 [0,0,0,1,0,0|0,0,3]=4 81 B12R1.18 CC1CCCCCC1NCC=C Amb25305413 [0,0,0,1,0,0|2,0,1]=4 82 B12R1.18 CCCCC1CCCCCC1=O Amb18799266 [0,0,0,1,0,0|0,0,2]=3 83 B12R1.18 CNCCN1CCCCCC1=O Amb18977654 [0,0,0,1,0,0|2,0,1]=4 84 B12R1.18 COCCC1CCCCCC1=O Amb18801861 [0,0,0,1,0,0|1,0,1]=3 85 B12R1.18 COCC[C@@H]1CCCCCC1=O Amb25667371 [0,0,0,1,0,0|1,0,1]=3 86 B12R1.18 COCC[C@H]1CCCCCC1=O Amb25128881 [0,0,0,1,0,0|1,0,1]=3 87 B12R1.18 CSCCC1CCCCCC1=O Amb24342167 [0,0,0,1,0,0|1,0,1]=3 88 B12R1.18 C\C=C\CC1CCCCCC1=O Amb24470381 [0,0,0,1,0,0|0,0,2]=3 89 B12R1.18 NCCCN1CCCCCC1=O Amb1153735 [0,0,0,1,0,0|2,0,1]=4 90 B12R1.18 O=C1CCCCCC1CCCF Amb25692540 [0,0,0,1,0,0|1,0,1]=3 91 B12R1.18 O=C1CCCCCN1CCCS Amb24402028 [0,0,0,1,0,0|2,0,1]=4 92 B12R1.18 O=CCCN1CCCCCC1=O Amb18789015 [0,0,0,1,0,0|2,0,0]=3 93 B12R1.18 O=CCCN1CCOCCC1=O Amb25678813 [0,0,0,1,0,0|3,0,0]=4 94 B12R1.37 C=CCCCCCC1OCCO1 Amb24351682 [0,0,0,1,0,0|1,0,2]=4 95 B12R1.37 C=CCCCOCC1CNCC1 Amb21956721 [0,0,0,1,0,0|3,0,0]=4 96 B12R1.37 O=CCCCCCC1OCCO1 Amb25835714 [0,0,0,1,0,0|2,0,1]=4 97 B12R1.52 C#CCN1CCCCCCC1=O Amb18788385 [0,0,0,1,0,0|1,0,2]=4 98 B12R1.52 C=C1CCCCCCC1CC=O Amb24444868 [0,0,0,1,0,0|0,0,0]=1 99 B12R1.52 C=C1CCCCCCC1N=[N+]=[N-] Amb25311331 [0,0,0,1,0,0|3,0,0]=4 100 B12R1.52 C=CCC1CCCC=CCC1=O Amb24737373 [0,0,0,1,0,0|0,0,2]=3 101 B12R1.52 C=CCC1CCCCCCC1=O Amb24584339 [0,0,0,1,0,0|0,0,0]=1 102 B12R1.52 C=CCC1CCCCCNC1=N Amb25339678 [0,0,0,1,0,0|2,0,0]=3 103 B12R1.52 C=C\C=C/1\CCCCCCC1=O Amb25768397 [0,0,0,1,0,0|0,0,2]=3 104 B12R1.52 CCCC1CCCCCCC1=O Amb25050208 [0,0,0,1,0,0|0,0,2]=3 105 B12R1.52 O=C1CCCCCCN1CCS Amb25734060 [0,0,0,1,0,0|2,0,1]=4 106 B12R1.52 O=CCN1CCCCCCC1=O Amb18806129 [0,0,0,1,0,0|2,0,0]=3 107 B12R1.73 COC1CCCCCCCC1=O Amb24706984 [0,0,0,1,0,0|1,0,1]=3 108 B12R1.73 N#CC1CCCCCCCC1=O Amb25340929 [0,0,0,1,0,0|1,0,1]=3 109 B12R1.73 N=NC1CCCCCCCC1=O Amb24452294 [0,0,0,1,0,0|2,0,0]=3 110 B12R1.73 NCN1CCCCCCCC1=O Amb25152335 [0,0,0,1,0,0|2,0,1]=4 111 B12R1.73 O=C1CCCCCCCN1CCl Amb24391520 [0,0,0,1,0,0|2,0,1]=4 112 B12R1.73 O=CC1CCCCCCCC1=O Amb24381375 [0,0,0,1,0,0|1,0,0]=2 113 B12R1.73 [N-]=[N+]=C1CCCCCCCC1=O Amb17594137 [0,0,0,1,0,0|2,0,1]=4 114 B12R1.121 C#CCCN1CCCCC1C=O Amb18798440 [0,0,0,1,0,0|1,0,2]=4 115 B12R1.121 C=CC1CCCCN1CCC#C Amb24749191 [0,0,0,1,0,0|2,0,1]=4 116 B12R1.121 C=CCNC1CCCCC1C#N Amb18300956 [0,0,0,1,0,0|2,0,1]=4 117 B12R1.121 C=C\C=C\C1CCCCC1C=O Amb25713077 [0,0,0,1,0,0|0,0,2]=3 118 B12R1.121 C\C=C\CN1CCCCC1C=O Amb24665077 [0,0,0,1,0,0|1,0,2]=4 119 B12R1.121 OCC1CCCCC1CNC=O Amb24407374 [0,0,0,1,0,0|2,0,1]=4 120 B12R1.150 CC1CCCCCCCCC1=O Amb24645477 [0,0,0,1,0,0|0,0,2]=3 121 B12R1.150 C[C@H]1CCCCCCCCC1=O Amb24456546 [0,0,0,1,0,0|0,0,2]=3 122 B12R1.150 O=C1CCCCCCCCC1=O Amb17594209 [0,0,0,1,0,0|1,0,0]=2 123 B12R1.150 O=C1NCCCCCCCC1Cl Amb25295490 [0,0,0,1,0,0|2,0,1]=4 124 B12R1.169 C=CCC1CCCCC1N=[N+]=[N-] Amb25110114 [0,0,0,1,0,0|3,0,0]=4 125 B12R1.169 C=CC[C@H]1CCCC[C@H]1N=[N+]=[N-] Amb24561698 [0,0,0,1,0,0|3,0,0]=4 126 B12R1.169 O=CN[C@H]1CCCC[C@H]1NC=O Amb25771875 [0,0,0,1,0,0|3,0,0]=4 127 B12R1.173 O=CCN1CCCCCCCC1 Amb25840505 [0,0,0,1,0,0|1,0,2]=4 128 B12R1.215 O=C1CC=CCCCCCCC1 Amb25112664 [0,0,0,1,0,0|0,0,2]=3 129 B12R1.215 O=C1CCCCCCCCC#C1 Amb25706996 [0,0,0,1,0,0|0,0,2]=3 130 B12R1.215 O=C1CCCCCCCCCO1 Amb22732305 [0,0,0,1,0,0|1,0,1]=3 131 B12R1.215 O=C1CCCCCCNCCN1 Amb25784699 [0,0,0,1,0,0|2,0,1]=4 132 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,0,0,1,0,0|2,0,1]=4 133 B12R1.215 S=C1CCCCCCCCCN1 Amb24399743 [0,0,0,1,0,0|1,1,1]=4 134 B12R1.267 BrCCNCC1CCCCC1=O Amb1146038 [0,0,0,1,0,0|2,0,1]=4 135 B12R1.267 C#CCCOC1CCCCC1=O Amb25128883 [0,0,0,1,0,0|1,0,2]=4 136 B12R1.267 C=CCCCC1CCCCC1=O Amb17594142 [0,0,0,1,0,0|0,0,0]=1 137 B12R1.267 C=CC\C=C\C1CCCCC1=O Amb25236967 [0,0,0,1,0,0|0,0,2]=3 138 B12R1.267 CCCCCC1CCCCC1=O Amb18788895 [0,0,0,1,0,0|0,0,2]=3 139 B12R1.267 C\C=C\COC1CCCCC1=O Amb25179608 [0,0,0,1,0,0|1,0,2]=4 140 B12R1.267 C\C=C\OCC1CCCCC1=O Amb24512358 [0,0,0,1,0,0|1,0,2]=4 141 B12R1.267 N#CCCCC1CCCCC1=O Amb18646376 [0,0,0,1,0,0|1,0,1]=3 142 B12R1.267 [N-]=[N+]=NCCC1CCCCC1=O Amb25125254 [0,0,0,1,0,0|3,0,0]=4 143 B12R1.281 C=CCC1CCCCCC1CN Amb24763160 [0,0,0,1,0,0|1,0,1]=3 144 B12R1.281 C=CCC=1CCCCCC1C=O Amb24497297 [0,0,0,1,0,0|0,0,2]=3 145 B12R1.281 C=CCN1CCCCCC1CCl Amb25703239 [0,0,0,1,0,0|2,0,1]=4 146 B12R1.281 CCC1CCCCCN1CC=C Amb24354161 [0,0,0,1,0,0|2,0,1]=4 147 B12R1.281 CCC1CCCCCN1CC=O Amb25693680 [0,0,0,1,0,0|1,0,2]=4 148 B12R1.281 CNC1CCCCCC1CC=C Amb18799003 [0,0,0,1,0,0|2,0,0]=3 149 B12R1.281 OCC1CCCCCN1CC=O Amb25153991 [0,0,0,1,0,0|2,0,1]=4 150 B12R1.329 C#CCNC1CCCCCC=C1 Amb25136647 [0,0,0,1,0,0|2,0,1]=4 151 B12R1.329 C=CCCN1CCCCCCC1 Amb25822796 [0,0,0,1,0,0|2,0,1]=4 152 B12R1.329 C=CCNC1CCCCCC=C1 Amb24387264 [0,0,0,1,0,0|2,0,0]=3 153 B12R1.329 CCNCC1CCCCCC=C1 Amb25157900 [0,0,0,1,0,0|2,0,1]=4 154 B12R1.329 FCCNC1CCCCCC=C1 Amb25669896 [0,0,0,1,0,0|2,0,1]=4 155 B12R1.329 NCCOC1CCCCCC=C1 Amb25334073 [0,0,0,1,0,0|2,0,1]=4 156 B12R1.329 O=CCCN1CCCCCCC1 Amb18789074 [0,0,0,1,0,0|1,0,2]=4 157 B12R1.329 OCCNC1CCCCCC=C1 Amb25157875 [0,0,0,1,0,0|1,0,2]=4 158 B12R1.372 CC#CCCCC1CCCC1=O Amb25128888 [0,0,0,1,0,0|0,0,3]=4 159 B12R1.372 CCCCCCC1CCOC1=O Amb22230226 [0,0,0,1,0,0|1,0,2]=4 160 B12R1.550 C1CCCCCC=CC=CC=C1 Amb22230446 [0,0,0,1,0,0|1,0,2]=4 161 B12R1.1414 O=CNCCC1CCCCCC1 Amb24692921 [0,0,0,1,0,0|1,0,2]=4 162 B9R0.45 C#CCCCCCCC=O Amb25300437 [2,0,0,0,0,0|0,0,2]=4 163 B9R0.45 C=C=CCCCCCC=O Amb25827473 [2,0,0,0,0,0|0,0,2]=4 164 B9R0.45 C=CCCCCC#CC=O Amb25092936 [2,0,0,0,0,0|0,0,2]=4 165 B9R0.45 C=CCCCCCCCBr Amb19895211 [2,0,0,0,0,0|1,0,0]=3 166 B9R0.45 C=CCCCCCCCN Amb24763980 [2,0,0,0,0,0|1,0,0]=3 167 B9R0.45 C=CCCCCCCCO Amb22733549 [2,0,0,0,0,0|0,0,1]=3 168 B9R0.45 C=CCCCCCC[Zn]Br Amb22898145 [2,0,0,0,0,0|2,0,0]=4 169 B9R0.45 C=CCCCCNCCN Amb25821120 [2,0,0,0,0,0|2,0,0]=4 170 B9R0.45 C=CCCCCNCCO Amb24478970 [2,0,0,0,0,0|1,0,1]=4 171 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [2,0,0,0,0,0|0,0,2]=4 172 B9R0.45 C=CCCCNCCCN Amb24656881 [2,0,0,0,0,0|2,0,0]=4 173 B9R0.45 C=CCCCOCCC=O Amb24731422 [2,0,0,0,0,0|1,0,0]=3 174 B9R0.45 C=CCCCOCCCBr Amb25842130 [2,0,0,0,0,0|2,0,0]=4 175 B9R0.45 C=CCCCOCCCCl Amb24701986 [2,0,0,0,0,0|2,0,0]=4 176 B9R0.45 C=CCCCSCCC=C Amb25285386 [2,0,0,0,0,0|1,0,1]=4 177 B9R0.45 C=CCCCSCCCF Amb25168450 [2,0,0,0,0,0|2,0,0]=4 178 B9R0.45 C=CCCCSCCCO Amb25325049 [2,0,0,0,0,0|1,0,1]=4 179 B9R0.45 C=CCCNCCCCF Amb25818131 [2,0,0,0,0,0|2,0,0]=4 180 B9R0.45 C=CCCOCCCC=O Amb24598274 [2,0,0,0,0,0|1,0,0]=3 181 B9R0.45 C=CCCOCCCCCl Amb18798172 [2,0,0,0,0,0|2,0,0]=4 182 B9R0.45 C=CCCOCCCCS Amb24673342 [2,0,0,0,0,0|1,1,0]=4 183 B9R0.45 C=CCCOCCNC=O Amb25362975 [2,0,0,0,0,0|2,0,0]=4 184 B9R0.45 C=CCC\C=C\CCC=O Amb25770517 [2,0,0,0,0,0|0,0,2]=4 185 B9R0.45 C=CCNCCCCC=C Amb24388074 [2,0,0,0,0,0|1,0,1]=4 186 B9R0.45 C=CCNCCCCCBr Amb25169345 [2,0,0,0,0,0|2,0,0]=4 187 B9R0.45 C=CCNCCCCCCl Amb25274553 [2,0,0,0,0,0|2,0,0]=4 188 B9R0.45 C=CCNCCCCCI Amb24479620 [2,0,0,0,0,0|2,0,0]=4 189 B9R0.45 C=CCOCCCCC=O Amb25105437 [2,0,0,0,0,0|1,0,0]=3 190 B9R0.45 C=CCOCCCCCBr Amb25141774 [2,0,0,0,0,0|2,0,0]=4 191 B9R0.45 C=CCOCCCCCO Amb25792274 [2,0,0,0,0,0|1,0,1]=4 192 B9R0.45 C=CCOCCCCCS Amb25136655 [2,0,0,0,0,0|1,1,0]=4 193 B9R0.45 C=COCCCCCCBr Amb25804472 [2,0,0,0,0,0|2,0,0]=4 194 B9R0.45 C=COCCCCCCCl Amb25340486 [2,0,0,0,0,0|2,0,0]=4 195 B9R0.45 C=COCCCCNC=O Amb24480781 [2,0,0,0,0,0|2,0,0]=4 196 B9R0.45 C=C\C=C\CCCCC=O Amb24678814 [2,0,0,0,0,0|0,0,2]=4 197 B9R0.45 CCCCCC#CCC=C Amb10563782 [2,0,0,0,0,0|0,0,2]=4 198 B9R0.45 CCCCCCC#CC=O Amb25227346 [2,0,0,0,0,0|0,0,2]=4 199 B9R0.45 CCCCCCC=CC=O Amb24061310 [2,0,0,0,0,0|0,0,2]=4 200 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [2,0,0,0,0,0|1,0,1]=4 201 B9R0.45 CCCCCCCCNN Amb22552570 [2,0,0,0,0,0|2,0,0]=4 202 B9R0.45 CCCCCCCCSC Amb10553780 [2,0,0,0,0,0|1,0,1]=4 203 B9R0.45 CCCCCCCCSCl Amb25226772 [2,0,0,0,0,0|2,0,0]=4 204 B9R0.45 CCCCCCCCS[Au] Amb22354036 [2,0,0,0,0,0|2,0,0]=4 205 B9R0.45 CCCCCCCC[13C]#[13CH] Amb22338942 [2,0,0,0,0,0|0,0,2]=4 206 B9R0.45 CCCCCCCC[Hg]Cl Amb22359875 [2,0,0,0,0,0|2,0,0]=4 207 B9R0.45 CCCCCCCC[Mg]Br Amb22363181 [2,0,0,0,0,0|2,0,0]=4 208 B9R0.45 CCCCCCCC[Mg]Cl Amb22349193 [2,0,0,0,0,0|2,0,0]=4 209 B9R0.45 CCCCCCCOC=C Amb25817973 [2,0,0,0,0,0|1,0,0]=3 210 B9R0.45 CCCCCCC\C=C\Cl Amb25322197 [2,0,0,0,0,0|1,0,1]=4 211 B9R0.45 CCCCCCC\C=C\I Amb24708038 [2,0,0,0,0,0|1,0,1]=4 212 B9R0.45 CCCCCCOCC=C Amb17933923 [2,0,0,0,0,0|1,0,0]=3 213 B9R0.45 CCCCCCSCC=C Amb22733767 [2,0,0,0,0,0|1,0,0]=3 214 B9R0.45 CCCCCC\C=C/C=C Amb22641680 [2,0,0,0,0,0|0,0,2]=4 215 B9R0.45 CCCCCNOCC=C Amb25359199 [2,0,0,0,0,0|2,0,0]=4 216 B9R0.45 CCCCCSCCC=C Amb25120497 [2,0,0,0,0,0|1,0,0]=3 217 B9R0.45 CCCCC\C=C/CC=O Amb22731181 [2,0,0,0,0,0|0,0,2]=4 218 B9R0.45 CCCCOCCCC=C Amb25662912 [2,0,0,0,0,0|1,0,0]=3 219 B9R0.45 CCCCOCCOC=C Amb22363292 [2,0,0,0,0,0|2,0,0]=4 220 B9R0.45 CCCCSCCCC=C Amb24482054 [2,0,0,0,0,0|1,0,0]=3 221 B9R0.45 CCCC\C=C/CCC=O Amb24477003 [2,0,0,0,0,0|0,0,2]=4 222 B9R0.45 CCCNCCNCC=C Amb25075002 [2,0,0,0,0,0|2,0,0]=4 223 B9R0.45 CCCNCCSCC=C Amb24449067 [2,0,0,0,0,0|2,0,0]=4 224 B9R0.45 CCCONCCCC=C Amb25707203 [2,0,0,0,0,0|2,0,0]=4 225 B9R0.45 CCCSCCNCC=C Amb18797757 [2,0,0,0,0,0|2,0,0]=4 226 B9R0.45 CCNCCCOCC=C Amb24441883 [2,0,0,0,0,0|2,0,0]=4 227 B9R0.45 CCNCCCSCC=C Amb25080841 [2,0,0,0,0,0|2,0,0]=4 228 B9R0.45 CCNCCOCCC=C Amb25365870 [2,0,0,0,0,0|2,0,0]=4 229 B9R0.45 CCOCCCCCC=O Amb25724799 [2,0,0,0,0,0|1,0,0]=3 230 B9R0.45 CCOCCCSCC=C Amb25851910 [2,0,0,0,0,0|2,0,0]=4 231 B9R0.45 CCSCCCCCC=O Amb25205442 [2,0,0,0,0,0|1,0,0]=3 232 B9R0.45 CCSCCOCCC=O Amb24526413 [2,0,0,0,0,0|2,0,0]=4 233 B9R0.45 CNCCCCOCC=C Amb24476920 [2,0,0,0,0,0|2,0,0]=4 234 B9R0.45 CNCCCNCCC=C Amb25739865 [2,0,0,0,0,0|2,0,0]=4 235 B9R0.45 COCCCCCNC=O Amb24688397 [2,0,0,0,0,0|2,0,0]=4 236 B9R0.45 COCCCCNCC=C Amb24607244 [2,0,0,0,0,0|2,0,0]=4 237 B9R0.45 COCCCOCCC=O Amb25742389 [2,0,0,0,0,0|2,0,0]=4 238 B9R0.45 COCOCCCCC=O Amb24333716 [2,0,0,0,0,0|2,0,0]=4 239 B9R0.45 CSCCCCNCC=C Amb25147739 [2,0,0,0,0,0|2,0,0]=4 240 B9R0.45 CSCCCSCCC=C Amb25169431 [2,0,0,0,0,0|2,0,0]=4 241 B9R0.45 CSCCCSCCC=O Amb24441129 [2,0,0,0,0,0|2,0,0]=4 242 B9R0.45 C\C=C/CCCCCC=O Amb25289217 [2,0,0,0,0,0|0,0,2]=4 243 B9R0.45 C\C=C\CCCCCC=O Amb24681796 [2,0,0,0,0,0|0,0,2]=4 244 B9R0.45 C\C=C\CCCCCCC Amb22730483 [2,0,0,0,0,0|0,0,2]=4 245 B9R0.45 FCCCCCCCCF Amb22641491 [2,0,0,0,0,0|2,0,0]=4 246 B9R0.45 ICCCCCCCCI Amb20242379 [2,0,0,0,0,0|2,0,0]=4 247 B9R0.45 NCCCCCCCCBr Amb24744173 [2,0,0,0,0,0|2,0,0]=4 248 B9R0.45 NCCCCCCCCCl Amb25147234 [2,0,0,0,0,0|2,0,0]=4 249 B9R0.45 NCCCCCCCCF Amb25063266 [2,0,0,0,0,0|2,0,0]=4 250 B9R0.45 NCCCCCCCCO Amb24116967 [2,0,0,0,0,0|1,0,1]=4 251 B9R0.45 NCCCCCCCCS Amb25757074 [2,0,0,0,0,0|1,1,0]=4 252 B9R0.45 O=CCCCCCCCF Amb25075653 [2,0,0,0,0,0|1,0,0]=3 253 B9R0.45 O=CCCCC\C=C/CC Amb10844749 [2,0,0,0,0,0|0,0,2]=4 254 B9R0.45 O=COCCCCCCBr Amb25074988 [2,0,0,0,0,0|2,0,0]=4 255 B9R0.45 OCCCCCCCC=O Amb25765567 [2,0,0,0,0,0|1,0,0]=3 256 B9R0.45 OCCCCCCCCF Amb25330666 [2,0,0,0,0,0|1,0,1]=4 257 B9R0.45 OCCCCCCNC=O Amb24452880 [2,0,0,0,0,0|2,0,0]=4 258 B9R0.45 OCCCCCNCC=C Amb17334217 [2,0,0,0,0,0|1,0,1]=4 259 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [2,0,0,0,0,0|2,0,0]=4 260 B11R0.40 CCCCCCCCC(C)C=O Amb22730336 [1,1,0,0,0,0|0,0,1]=3 261 B11R0.40 CCCCCCCCS(=O)C=C Amb1032994 [1,1,0,0,0,0|1,0,1]=4 262 B11R0.140 C=CCCCC(O)CCCC=C Amb22892833 [1,1,0,0,0,0|0,0,1]=3 263 B11R0.148 C#CCCCCCCCC(O)=O Amb22388895 [1,1,0,0,0,0|0,0,2]=4 264 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [1,1,0,0,0,0|1,0,1]=4 265 B11R0.148 CC(C)CCCCCCCC=O Amb22055758 [1,1,0,0,0,0|0,0,1]=3 266 B11R0.148 CCCCCCCCCC([O-])=O Amb22733551 [1,1,0,0,0,0|0,0,1]=3 267 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [1,1,0,0,0,0|0,0,1]=3 268 B11R0.148 CCCCCCCCNC(=O)C Amb10562300 [1,1,0,0,0,0|1,0,1]=4 269 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [1,1,0,0,0,0|0,0,1]=3 270 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [1,1,0,0,0,0|1,0,1]=4 271 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [1,1,0,0,0,0|1,0,1]=4 272 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [1,1,0,0,0,0|2,0,0]=4 273 B11R0.148 OC(=O)CCCCCCCC=O Amb17939414 [1,1,0,0,0,0|1,0,0]=3 274 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [1,1,0,0,0,0|0,0,1]=3 275 B13R0.335 CCCCCCCCC(O)CC(O)=O Amb21928763 [0,2,0,0,0,0|0,0,2]=4 276 B13R0.54 BrCCCCCCCCCCC(=O)N Amb16207966 [0,2,0,0,0,0|0,0,2]=4 277 B13R0.54 C=CCCCCCCCCOC(=O)C Amb10563791 [0,2,0,0,0,0|0,0,0]=2 278 B13R0.54 CC(C)CCCCCCCCCC=O Amb22055766 [0,2,0,0,0,0|0,0,2]=4 279 B13R0.54 CCCCCCCCCCCC(=C)Br Amb19886460 [0,2,0,0,0,0|1,0,1]=4 280 B13R0.54 CCCCCCCCCCCC(C)=C Amb19886457 [0,2,0,0,0,0|1,0,1]=4 281 B13R0.54 CCCCCCCCCCCC(O)=O Amb22348404 [0,2,0,0,0,0|0,0,2]=4 282 B13R0.54 CCCCCCCCCCCC(O)=O Amb22730643 [0,2,0,0,0,0|0,0,2]=4 283 B13R0.54 CCCCCCCCCCCC([O-])=O Amb17942849 [0,2,0,0,0,0|0,0,2]=4 284 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22729066 [0,2,0,0,0,0|0,0,2]=4 285 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730602 [0,2,0,0,0,0|0,0,2]=4 286 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730786 [0,2,0,0,0,0|0,0,2]=4 287 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731774 [0,2,0,0,0,0|0,0,2]=4 288 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731775 [0,2,0,0,0,0|0,0,2]=4 289 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22733752 [0,2,0,0,0,0|0,0,2]=4 290 B13R0.54 CCCCCCCCCCC[13C](O)=O Amb21928681 [0,2,0,0,0,0|0,0,2]=4 291 B13R0.54 CCCCCCCCCCC[14C](O)=O Amb22349630 [0,2,0,0,0,0|0,0,2]=4 292 B13R0.54 CCCCCCCCCCNC(=O)N Amb2228230 [0,2,0,0,0,0|0,0,2]=4 293 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,2,0,0,0,0|0,0,2]=4 294 B13R0.54 CCCCCCCCCC[13CH2]C(O)=O Amb22353612 [0,2,0,0,0,0|0,0,2]=4 295 B13R0.54 CCCCCCCCCC[13CH2][13C](O)=O Amb22353611 [0,2,0,0,0,0|0,0,2]=4 296 B13R0.54 CCCCCCCCSCCC(=O)N Amb10669601 [0,2,0,0,0,0|0,0,2]=4 297 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,2,0,0,0,0|0,0,2]=4 298 B13R0.54 CCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22353609 [0,2,0,0,0,0|0,0,2]=4 299 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,2,0,0,0,0|0,0,2]=4 300 B13R0.54 N#CCCCCCCCCCC(O)=O Amb22547629 [0,2,0,0,0,0|0,0,2]=4 301 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,2,0,0,0,0|0,0,2]=4 302 B13R0.54 NCCCCCCCCCCC([O-])=O Amb22353821 [0,2,0,0,0,0|0,0,2]=4 303 B13R0.54 OCCCCCCCCCCC(=O)O Amb1814707 [0,2,0,0,0,0|0,0,2]=4 304 B13R0.54 [13CH3]CCCCCCCCCCC(O)=O Amb22353502 [0,2,0,0,0,0|0,0,2]=4 305 B13R0.54 [13CH3]CCCCCCCCCC[13C](O)=O Amb22353610 [0,2,0,0,0,0|0,0,2]=4 306 B13R0.147 C#CCCCCCCCCC(=O)NO Amb1625635 [0,2,0,0,0,0|0,0,2]=4 307 B13R0.147 CCCCCCCCCCC(=O)C=O Amb24084923 [0,2,0,0,0,0|0,0,2]=4 308 B13R0.147 C\C=C\CCCCCCCC(=O)OC Amb22641574 [0,2,0,0,0,0|0,0,2]=4 309 B13R0.147 OCCCCCCCCCC(=O)OC Amb13887310 [0,2,0,0,0,0|1,0,1]=4 310 B13R0.336 C=CCCCCCCCCCCC=C Amb22227679 [0,2,0,0,0,0|1,0,0]=3 311 B13R0.336 CCCCCCCCCC\C=C\C=O Amb22351314 [0,2,0,0,0,0|0,0,2]=4 312 B13R0.336 CCCCCCCCCC\C=C\CO Amb22336246 [0,2,0,0,0,0|1,0,1]=4 313 B13R0.336 OC\C=C\CCCCCCCCCBr Amb22347650 [0,2,0,0,0,0|1,0,1]=4 314 B13R0.154 CCCCCCCC(O)CCC(O)=O Amb22058992 [0,2,0,0,0,0|0,0,2]=4 315 B13R0.154 CCCCCCCC(O)CCC([O-])=O Amb19148937 [0,2,0,0,0,0|0,0,2]=4 316 B13R0.150 CC(CCCCCCCCO)C(O)=O Amb20246737 [0,2,0,0,0,0|1,0,1]=4 317 B13R0.150 CCCCCCCCCC(C)C(O)=O Amb18320092 [0,2,0,0,0,0|0,0,2]=4 318 B13R0.150 CCCCCCCCCC(O)C(O)=O Amb22224801 [0,2,0,0,0,0|0,0,2]=4 319 B13R0.179 CC(C)CCCCCCCCC(O)=O Amb21928890 [0,2,0,0,0,0|0,0,2]=4 320 B13R0.179 CC(CCCCCCCCC(=O)O)N Amb2229643 [0,2,0,0,0,0|0,0,2]=4 321 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22264826 [0,2,0,0,0,0|1,0,0]=3 322 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22351881 [0,2,0,0,0,0|1,0,0]=3 323 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22369048 [0,2,0,0,0,0|1,0,0]=3 324 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22168122 [0,2,0,0,0,0|1,0,0]=3 325 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22730286 [0,2,0,0,0,0|1,0,0]=3 326 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22733850 [0,2,0,0,0,0|1,0,0]=3 327 B13R0.202 CCC(C)CCCCCCCC(O)=O Amb21928874 [0,2,0,0,0,0|0,0,2]=4 328 B13R0.202 CCC(CCCCCCCC(=O)O)N Amb2229644 [0,2,0,0,0,0|0,0,2]=4 329 B13R0.202 OC(=O)CCCCCCCC(F)CBr Amb22547613 [0,2,0,0,0,0|1,0,1]=4 330 B11R1.4 C=CCCCCC1OCCO1 Amb25757926 [1,0,0,1,0,0|1,0,1]=4 331 B11R1.4 O=CCCCCC1OCCO1 Amb24359153 [1,0,0,1,0,0|2,0,0]=4 332 B11R1.4 O=COCCCC1CCCO1 Amb22365098 [1,0,0,1,0,0|2,0,0]=4 333 B11R1.5 C#CCC1CCCCCC1=O Amb18796640 [1,0,0,1,0,0|0,0,2]=4 334 B11R1.5 C=CCC1CCCCCC1=O Amb18181756 [1,0,0,1,0,0|0,0,0]=2 335 B11R1.5 C=CCC1CCCCCC1Br Amb25277926 [1,0,0,1,0,0|1,0,0]=3 336 B11R1.5 C=CCC1CCCCCC1Cl Amb18185761 [1,0,0,1,0,0|1,0,0]=3 337 B11R1.5 C=CCC1CCCCCC1N Amb18286582 [1,0,0,1,0,0|1,0,0]=3 338 B11R1.5 C=CCC1CCCCCC1O Amb18182944 [1,0,0,1,0,0|0,0,1]=3 339 B11R1.5 C=CCC1OCCCCC1=O Amb25730090 [1,0,0,1,0,0|1,0,0]=3 340 B11R1.5 C=CCC1OCCCCC1Br Amb25857376 [1,0,0,1,0,0|2,0,0]=4 341 B11R1.5 C=CCC1SCCCCC1=O Amb25766897 [1,0,0,1,0,0|1,0,0]=3 342 B11R1.5 C=CC[C@@H]1OCCCC[C@H]1O Amb24520058 [1,0,0,1,0,0|1,0,1]=4 343 B11R1.5 CC1CCCCCC1NC=O Amb25241392 [1,0,0,1,0,0|1,0,1]=4 344 B11R1.5 CCCC1CCCCCC1=O Amb18796794 [1,0,0,1,0,0|0,0,1]=3 345 B11R1.5 CCCC1CCCCNC1=O Amb2229639 [1,0,0,1,0,0|1,0,1]=4 346 B11R1.5 CCOC1CCCCCC1=O Amb25342823 [1,0,0,1,0,0|1,0,1]=4 347 B11R1.5 CCSC1CCCCCC1=O Amb24691772 [1,0,0,1,0,0|1,0,1]=4 348 B11R1.5 COCC1CCCCCC1=O Amb24671812 [1,0,0,1,0,0|1,0,1]=4 349 B11R1.5 N#CCC1CCCCCC1=O Amb25735835 [1,0,0,1,0,0|1,0,1]=4 350 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [1,0,0,1,0,0|1,0,0]=3 351 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [1,0,0,1,0,0|2,0,0]=4 352 B11R1.5 O=C1CCCCCC1CCF Amb24686950 [1,0,0,1,0,0|1,0,0]=3 353 B11R1.5 O=C1CCCCCN1CCS Amb25105854 [1,0,0,1,0,0|2,0,0]=4 354 B11R1.5 O=C1NCCCCC1CCF Amb25841520 [1,0,0,1,0,0|2,0,0]=4 355 B11R1.5 O=CCN1CCCCCC1=O Amb18799577 [1,0,0,1,0,0|2,0,0]=4 356 B11R1.5 OC1CCCCCC1OC=O Amb24734180 [1,0,0,1,0,0|2,0,0]=4 357 B11R1.5 O[C@@H]1CCCCC[C@H]1OC=O Amb25257069 [1,0,0,1,0,0|2,0,0]=4 358 B11R1.17 C#CCCC1CCCCC1=O Amb24385651 [1,0,0,1,0,0|0,0,2]=4 359 B11R1.17 C=C1CCCCC1CCCO Amb25149747 [1,0,0,1,0,0|0,0,1]=3 360 B11R1.17 C=C1CCCCC1OCCO Amb24420737 [1,0,0,1,0,0|1,0,1]=4 361 B11R1.17 C=C1CCCCC1\C=C\C=O Amb24369650 [1,0,0,1,0,0|0,0,2]=4 362 B11R1.17 C=CCCC1CCC=CC1=O Amb25059582 [1,0,0,1,0,0|0,0,2]=4 363 B11R1.17 C=CCCC1CCCCC1Cl Amb24395618 [1,0,0,1,0,0|1,0,0]=3 364 B11R1.17 C=CCCC1CCCCC1N Amb25777121 [1,0,0,1,0,0|1,0,0]=3 365 B11R1.17 C=CCCC1CCCCC1O Amb25227048 [1,0,0,1,0,0|0,0,1]=3 366 B11R1.17 C=CCCC1CCCNC1=O Amb24383137 [1,0,0,1,0,0|1,0,0]=3 367 B11R1.17 C=CCCC1CNCCC1=O Amb24448480 [1,0,0,1,0,0|1,0,0]=3 368 B11R1.17 C=CCCC1CNCCC1O Amb25032401 [1,0,0,1,0,0|1,0,1]=4 369 B11R1.17 C=CCCC1OCCCC1Cl Amb25211268 [1,0,0,1,0,0|2,0,0]=4 370 B11R1.17 C=CCCN1CCCNC1=O Amb24488449 [1,0,0,1,0,0|2,0,0]=4 371 B11R1.17 C=CCC[C@@H]1OCCC[C@H]1Br Amb24519931 [1,0,0,1,0,0|2,0,0]=4 372 B11R1.17 C=CCC[C@H]1OCCC[C@@H]1O Amb25317257 [1,0,0,1,0,0|1,0,1]=4 373 B11R1.17 C=CCNC1CCCCC1Cl Amb24487775 [1,0,0,1,0,0|2,0,0]=4 374 B11R1.17 C=CCNC1CCCNC1=O Amb18295135 [1,0,0,1,0,0|2,0,0]=4 375 B11R1.17 C=CCN[C@@H]1CCCC[C@@H]1O Amb23263428 [1,0,0,1,0,0|1,0,1]=4 376 B11R1.17 C=CCN[C@@H]1CCCC[C@H]1O Amb25774282 [1,0,0,1,0,0|1,0,1]=4 377 B11R1.17 C=CCN[C@H]1CCCC[C@@H]1O Amb24746715 [1,0,0,1,0,0|1,0,1]=4 378 B11R1.17 C=CCOC1CCCCC1=O Amb25151567 [1,0,0,1,0,0|1,0,0]=3 379 B11R1.17 C=CCOC1CCCC[C@H]1Cl Amb24373249 [1,0,0,1,0,0|2,0,0]=4 380 B11R1.17 C=CCO[C@@H]1CCCC[C@H]1O Amb25272012 [1,0,0,1,0,0|1,0,1]=4 381 B11R1.17 C=CCO[C@H]1CCCCC1=O Amb25767715 [1,0,0,1,0,0|1,0,0]=3 382 B11R1.17 C=CCSC1CCCCC1N Amb25742515 [1,0,0,1,0,0|2,0,0]=4 383 B11R1.17 CC1CCCCC1CNC=O Amb24487690 [1,0,0,1,0,0|1,0,1]=4 384 B11R1.17 CC1CCCCC1OCC=O Amb18183071 [1,0,0,1,0,0|1,0,1]=4 385 B11R1.17 CC1CCCCN1CCC=C Amb24732856 [1,0,0,1,0,0|1,0,1]=4 386 B11R1.17 CC1CCCCN1CCC=O Amb18787587 [1,0,0,1,0,0|1,0,1]=4 387 B11R1.17 CCCCC1COCCC1=O Amb25720690 [1,0,0,1,0,0|1,0,1]=4 388 B11R1.17 CCCCC1OCCCC1=O Amb24456613 [1,0,0,1,0,0|1,0,1]=4 389 B11R1.17 CCCCN1CCCCC1=O Amb22394921 [1,0,0,1,0,0|1,0,1]=4 390 B11R1.17 CCCC[C@@H]1CCCNC1=O Amb24509566 [1,0,0,1,0,0|1,0,1]=4 391 B11R1.17 CCCC[C@H]1CCCCC1=O Amb24725293 [1,0,0,1,0,0|0,0,1]=3 392 B11R1.17 CCCOC1CCCCC1=O Amb25723193 [1,0,0,1,0,0|1,0,1]=4 393 B11R1.17 CCCO[C@@H]1CCCCC1=O Amb25053086 [1,0,0,1,0,0|1,0,1]=4 394 B11R1.17 CCCO[C@H]1CCCCC1=O Amb24633429 [1,0,0,1,0,0|1,0,1]=4 395 B11R1.17 CNCCC1CCCCC1=O Amb18125898 [1,0,0,1,0,0|1,0,1]=4 396 B11R1.17 COCCC1CCCCC1=O Amb18787633 [1,0,0,1,0,0|1,0,1]=4 397 B11R1.17 C[C@H]1CCCC[C@@H]1NCC=C Amb25232515 [1,0,0,1,0,0|1,0,1]=4 398 B11R1.17 C\C=C/CC1CCCCC1=O Amb24647880 [1,0,0,1,0,0|0,0,2]=4 399 B11R1.17 C\C=C\CC1CCCCC1=O Amb18177228 [1,0,0,1,0,0|0,0,2]=4 400 B11R1.17 N#CCC[C@@H]1CCCCC1=O Amb24486236 [1,0,0,1,0,0|1,0,1]=4 401 B11R1.17 N#CCC[C@H]1CCCCC1=O Amb24621718 [1,0,0,1,0,0|1,0,1]=4 402 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [1,0,0,1,0,0|1,0,0]=3 403 B11R1.17 O=C1CCCCC1CCCBr Amb25683472 [1,0,0,1,0,0|1,0,0]=3 404 B11R1.17 O=C1CCCCC1CCCCl Amb24651080 [1,0,0,1,0,0|1,0,0]=3 405 B11R1.17 O=C1CCCCC1CCCF Amb24714474 [1,0,0,1,0,0|1,0,0]=3 406 B11R1.17 O=C1CCCCC1CCCI Amb25785639 [1,0,0,1,0,0|1,0,0]=3 407 B11R1.17 O=C1CCCCC1C\C=C\Cl Amb25189138 [1,0,0,1,0,0|1,0,1]=4 408 B11R1.17 O=C1CCCCN1CCCS Amb24533643 [1,0,0,1,0,0|2,0,0]=4 409 B11R1.17 O=C1OCCCC1CCCCl Amb25738330 [1,0,0,1,0,0|2,0,0]=4 410 B11R1.17 O=CCCC1CCCCC1=O Amb18644640 [1,0,0,1,0,0|1,0,0]=3 411 B11R1.17 O=CCCN1CCCCC1=O Amb18177406 [1,0,0,1,0,0|2,0,0]=4 412 B11R1.17 O=CCC[C@@H]1CCCCC1=O Amb24484793 [1,0,0,1,0,0|1,0,0]=3 413 B11R1.17 O=COCC1CCCCC1Cl Amb25758795 [1,0,0,1,0,0|2,0,0]=4 414 B11R1.17 OC1OCCCC1CCC=O Amb25103255 [1,0,0,1,0,0|2,0,0]=4 415 B11R1.17 OCCCC1CCCOC1=O Amb25851451 [1,0,0,1,0,0|2,0,0]=4 416 B11R1.17 OCCCC1CNCCC1=O Amb25778442 [1,0,0,1,0,0|2,0,0]=4 417 B11R1.17 OCCCC1NCCCC1=O Amb18126066 [1,0,0,1,0,0|2,0,0]=4 418 B11R1.17 O[C@@H]1CCCC[C@H]1CCC=O Amb25245324 [1,0,0,1,0,0|1,0,0]=3 419 B11R1.18 C=CC1CCCC1\C=C\C=O Amb24724054 [1,0,0,1,0,0|0,0,2]=4 420 B11R1.18 C=CC1CCOC1CCC=O Amb25383592 [1,0,0,1,0,0|1,0,0]=3 421 B11R1.18 C=CCCC1CCCC1C=O Amb25385699 [1,0,0,1,0,0|0,0,0]=2 422 B11R1.18 C=CCCC1CCCC1CN Amb24762086 [1,0,0,1,0,0|1,0,0]=3 423 B11R1.18 C=CCCN1CCCC1CF Amb25380563 [1,0,0,1,0,0|2,0,0]=4 424 B11R1.18 C=CCCN1CCC[C@H]1C=O Amb25382181 [1,0,0,1,0,0|1,0,0]=3 425 B11R1.18 C=CCCN1CCC[C@H]1CN Amb24750657 [1,0,0,1,0,0|2,0,0]=4 426 B11R1.18 C=CCC[C@@H]1CCC[C@H]1C=O Amb24765265 [1,0,0,1,0,0|0,0,0]=2 427 B11R1.18 C=CCN[C@H]1CCC[C@H]1CO Amb25384216 [1,0,0,1,0,0|1,0,1]=4 428 B11R1.18 C=C[C@@H]1CCCN1CCCCl Amb25383811 [1,0,0,1,0,0|2,0,0]=4 429 B11R1.18 C=C\C=C\C1CCCC1C=O Amb24583059 [1,0,0,1,0,0|0,0,2]=4 430 B11R1.18 C=C\C=C\[C@@H]1CCC[C@@H]1C=O Amb25324990 [1,0,0,1,0,0|0,0,2]=4 431 B11R1.18 CCC1CCCC1NCC=C Amb25381914 [1,0,0,1,0,0|1,0,1]=4 432 B11R1.18 CCC1CCCN1CCC=O Amb18787589 [1,0,0,1,0,0|1,0,1]=4 433 B11R1.18 CCCCC1OCCC1C=O Amb18644843 [1,0,0,1,0,0|1,0,1]=4 434 B11R1.18 CCCCN1CCCC1C=C Amb25383205 [1,0,0,1,0,0|1,0,1]=4 435 B11R1.18 CCCCN1CCCC1C=O Amb23586328 [1,0,0,1,0,0|1,0,1]=4 436 B11R1.18 CCCCN1CCC[C@@H]1C=O Amb24766697 [1,0,0,1,0,0|1,0,1]=4 437 B11R1.18 CCCC[C@H]1OCCC1C=O Amb25385708 [1,0,0,1,0,0|1,0,1]=4 438 B11R1.18 CCCC[C@H]1OCC[C@@H]1C=O Amb24765269 [1,0,0,1,0,0|1,0,1]=4 439 B11R1.18 CCCC[C@H]1OCC[C@H]1C=O Amb24765268 [1,0,0,1,0,0|1,0,1]=4 440 B11R1.18 OCC1CCCN1CCC=O Amb18177533 [1,0,0,1,0,0|2,0,0]=4 441 B11R1.18 OCCCC1CCCN1C=O Amb18183178 [1,0,0,1,0,0|2,0,0]=4 442 B11R1.26 C#CC1CCCCCCC1=O Amb24690715 [1,0,0,1,0,0|0,0,2]=4 443 B11R1.26 CC=1CCCCCCC1C=O Amb24435308 [1,0,0,1,0,0|0,0,2]=4 444 B11R1.26 CCC1CCCCCNC1=O Amb24757672 [1,0,0,1,0,0|1,0,1]=4 445 B11R1.26 COC1CCCCCCC1=O Amb25767104 [1,0,0,1,0,0|1,0,1]=4 446 B11R1.26 CSC1CCCCCCC1=O Amb24441911 [1,0,0,1,0,0|1,0,1]=4 447 B11R1.26 C\C=C\1/CCCCCCC1=O Amb24736302 [1,0,0,1,0,0|0,0,2]=4 448 B11R1.26 N\C=C/1\CCCCCCC1=O Amb24723926 [1,0,0,1,0,0|1,0,1]=4 449 B11R1.26 O=C/1CCCCCC\C1=C/Cl Amb24532970 [1,0,0,1,0,0|1,0,1]=4 450 B11R1.26 O=C/1CCCCCC\C1=C\Cl Amb24519274 [1,0,0,1,0,0|1,0,1]=4 451 B11R1.26 O=NC1CCCCCCC1Cl Amb24634076 [1,0,0,1,0,0|2,0,0]=4 452 B11R1.26 OCC1CCCCCCC1=O Amb25298435 [1,0,0,1,0,0|1,0,0]=3 453 B11R1.26 OC[C@@H]1CCCCCCC1=O Amb25833647 [1,0,0,1,0,0|1,0,0]=3 454 B11R1.26 O\C=C/1\CCCCCCC1=O Amb24662269 [1,0,0,1,0,0|1,0,1]=4 455 B11R1.26 O\C=C\1/CCCCCCC1=O Amb22520392 [1,0,0,1,0,0|1,0,1]=4 456 B11R1.28 C=CCCCC1CCCCC1 Amb24117204 [1,0,0,1,0,0|0,0,1]=3 457 B11R1.28 C=CCCCC1COCCC1 Amb25380388 [1,0,0,1,0,0|1,0,1]=4 458 B11R1.28 C=CCCCC1CSCCC1 Amb25383771 [1,0,0,1,0,0|1,0,1]=4 459 B11R1.28 C=CCCC[C@@H]1COCCC1 Amb25383939 [1,0,0,1,0,0|1,0,1]=4 460 B11R1.28 C=CCCC[C@@H]1CSCCC1 Amb25383940 [1,0,0,1,0,0|1,0,1]=4 461 B11R1.28 C=CCCC[C@H]1COCCC1 Amb25383786 [1,0,0,1,0,0|1,0,1]=4 462 B11R1.28 C=CCCC[C@H]1CSCCC1 Amb25383944 [1,0,0,1,0,0|1,0,1]=4 463 B11R1.28 C=CCCNC1CCCC=C1 Amb25382343 [1,0,0,1,0,0|1,0,1]=4 464 B11R1.28 C=CCCNC1CCCCC1 Amb10559348 [1,0,0,1,0,0|1,0,1]=4 465 B11R1.28 C=CCCNC=1CCCCC1 Amb25790416 [1,0,0,1,0,0|1,0,1]=4 466 B11R1.28 C=CCNCC1CCCCS1 Amb24754609 [1,0,0,1,0,0|1,1,0]=4 467 B11R1.28 C=CCOCC1CCCCN1 Amb19020497 [1,0,0,1,0,0|2,0,0]=4 468 B11R1.28 C=CCSCC1CCCCC1 Amb25372143 [1,0,0,1,0,0|1,0,1]=4 469 B11R1.28 C=CCSCC1CCCCO1 Amb25372144 [1,0,0,1,0,0|1,0,1]=4 470 B11R1.28 CCCCNC1CCCC=C1 Amb24764722 [1,0,0,1,0,0|1,0,1]=4 471 B11R1.28 ClCCCCC1CCCC=C1 Amb25383945 [1,0,0,1,0,0|1,0,0]=3 472 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [1,0,0,1,0,0|1,0,0]=3 473 B11R1.28 O=CCCCC1OCCCO1 Amb25385749 [1,0,0,1,0,0|2,0,0]=4 474 B11R1.28 O=CCCCC1SCCCS1 Amb25384730 [1,0,0,1,0,0|2,0,0]=4 475 B11R1.28 O=CCCCC=1CCCCC1 Amb18125495 [1,0,0,1,0,0|0,0,1]=3 476 B11R1.28 O=CCCOC1CCCC=C1 Amb24767020 [1,0,0,1,0,0|1,0,0]=3 477 B11R1.28 O=CCCOC1CCCCC1 Amb18787634 [1,0,0,1,0,0|1,0,1]=4 478 B11R1.28 O=CCCSC1CCCCC1 Amb18178028 [1,0,0,1,0,0|1,0,1]=4 479 B11R1.28 O=CCOCC1CCCCC1 Amb18797001 [1,0,0,1,0,0|1,0,1]=4 480 B11R1.28 O=CCOCC1CCCCO1 Amb18799917 [1,0,0,1,0,0|2,0,0]=4 481 B11R1.28 O=CNCCC1CCCCO1 Amb25767203 [1,0,0,1,0,0|2,0,0]=4 482 B11R1.41 C=CC1CNCCC1CCO Amb24696498 [1,0,0,1,0,0|1,0,1]=4 483 B11R1.41 C=CCC1CCCCC1C#N Amb18125028 [1,0,0,1,0,0|1,0,1]=4 484 B11R1.41 C=CCC1CCCCC1C=O Amb18125474 [1,0,0,1,0,0|0,0,0]=2 485 B11R1.41 C=CCC1CCCCC1CN Amb18125613 [1,0,0,1,0,0|1,0,0]=3 486 B11R1.41 C=CCN1CCCCC1C=C Amb25145128 [1,0,0,1,0,0|1,0,1]=4 487 B11R1.41 C=CCN1CCCCC1C=O Amb18181817 [1,0,0,1,0,0|1,0,0]=3 488 B11R1.41 C=CCN1CCCCC1CN Amb18982953 [1,0,0,1,0,0|2,0,0]=4 489 B11R1.41 C=CCN1CCCCC1CO Amb18183002 [1,0,0,1,0,0|1,0,1]=4 490 B11R1.41 C=CCN1CCCC[C@@H]1CO Amb25380682 [1,0,0,1,0,0|1,0,1]=4 491 B11R1.41 C=CC[C@@H]1CCCC[C@H]1C=O Amb24550707 [1,0,0,1,0,0|0,0,0]=2 492 B11R1.41 C=C[C@H]1CNCC[C@H]1CCO Amb24578788 [1,0,0,1,0,0|1,0,1]=4 493 B11R1.41 CCC1CCCCC1CC=O Amb25196472 [1,0,0,1,0,0|0,0,1]=3 494 B11R1.41 CCC1CCCCC1NC=O Amb25117142 [1,0,0,1,0,0|1,0,1]=4 495 B11R1.41 CCC1CCCCN1CC=O Amb18799608 [1,0,0,1,0,0|1,0,1]=4 496 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [1,0,0,1,0,0|1,0,1]=4 497 B11R1.41 CCCN1CCCCC1C=O Amb18796904 [1,0,0,1,0,0|1,0,1]=4 498 B11R1.41 CCOC1CCCCC1C=O Amb25212289 [1,0,0,1,0,0|1,0,1]=4 499 B11R1.41 CNC1CCCCC1CC=C Amb18993613 [1,0,0,1,0,0|1,0,1]=4 500 B11R1.41 C\C=C/1\CCCCC1CC=O Amb25311203 [1,0,0,1,0,0|0,0,2]=4 501 B11R1.41 C\C=C\[C@@H]1CCCC[C@H]1C=O Amb25213102 [1,0,0,1,0,0|0,0,2]=4 502 B11R1.41 C\C=C\[C@H]1CCCC[C@@H]1C=O Amb24536565 [1,0,0,1,0,0|0,0,2]=4 503 B11R1.41 O=CC1CCCCN1CCF Amb24680554 [1,0,0,1,0,0|2,0,0]=4 504 B11R1.41 OCC1CCCCN1CC=O Amb18799800 [1,0,0,1,0,0|2,0,0]=4 505 B11R1.41 OCCC1CCCCN1C=O Amb18179738 [1,0,0,1,0,0|2,0,0]=4 506 B11R1.41 OCCN1CCCCC1C=O Amb18797130 [1,0,0,1,0,0|2,0,0]=4 507 B11R1.47 C=CCNCCCC1CCC1 Amb23570820 [1,0,0,1,0,0|1,0,1]=4 508 B11R1.51 C=CC=1CCCCCC1C=O Amb24434644 [1,0,0,1,0,0|0,0,2]=4 509 B11R1.51 CCC1CCCCCN1C=O Amb24684550 [1,0,0,1,0,0|1,0,1]=4 510 B11R1.85 C=C1CCCCCCCC1=O Amb25092923 [1,0,0,1,0,0|0,0,0]=2 511 B11R1.85 C=C1CCCCCCCC1O Amb25769379 [1,0,0,1,0,0|0,0,1]=3 512 B11R1.85 CC1=CCCCCCCC1=O Amb24722806 [1,0,0,1,0,0|0,0,2]=4 513 B11R1.85 CC1CCCCCCCC1=O Amb25712223 [1,0,0,1,0,0|0,0,1]=3 514 B11R1.85 CC1CCCCCCNC1=O Amb25287543 [1,0,0,1,0,0|1,0,1]=4 515 B11R1.85 N[C@@H]1CCCCCCNC1=O Amb24558722 [1,0,0,1,0,0|2,0,0]=4 516 B11R1.85 O=C1CCCCCCCC1Cl Amb24434022 [1,0,0,1,0,0|1,0,0]=3 517 B11R1.85 O=C1NCCCCCCC1Cl Amb24487901 [1,0,0,1,0,0|2,0,0]=4 518 B11R1.92 C1CCCC=CCCCCN1 Amb24391264 [1,0,0,1,0,0|1,0,1]=4 519 B11R1.99 C=CCCCCCC[C@@H]1CO1 Amb22367014 [1,0,0,1,0,0|0,0,1]=3 520 B11R1.101 NC1CCCCCCCC=C1 Amb24649891 [1,0,0,1,0,0|1,0,0]=3 521 B11R1.101 O=C1CCC=CCCCC=C1 Amb24645378 [1,0,0,1,0,0|0,0,2]=4 522 B11R1.101 O=C1NCCCCCCCO1 Amb24443710 [1,0,0,1,0,0|2,0,0]=4 523 B11R1.109 C=CC[C@H]1CCC[C@@H]1CC=O Amb25385672 [1,0,0,1,0,0|0,0,0]=2 524 B11R1.109 CCNC1CCCC1CC=C Amb19026212 [1,0,0,1,0,0|1,0,1]=4 525 B11R1.109 CNCC1CCCC1CC=C Amb24762103 [1,0,0,1,0,0|1,0,1]=4 526 B11R1.117 C=CCC1C=CCCCCN1 Amb25351506 [1,0,0,1,0,0|1,0,1]=4 527 B11R1.117 C=CC[C@@H]1C=CCCCCN1 Amb24442584 [1,0,0,1,0,0|1,0,1]=4 528 B11R1.117 CCNC1CCCCCC=C1 Amb25141200 [1,0,0,1,0,0|1,0,1]=4 529 B11R1.117 Cl\C=C\C1CCCCCC=C1 Amb24634146 [1,0,0,1,0,0|1,0,1]=4 530 B11R1.117 O=CCC1CCCCCC=C1 Amb25075624 [1,0,0,1,0,0|0,0,0]=2 531 B11R1.117 O=CCC1CCCCCCC1 Amb24382615 [1,0,0,1,0,0|0,0,1]=3 532 B11R1.117 O=CCC=1CCCCCCC1 Amb25236943 [1,0,0,1,0,0|0,0,1]=3 533 B11R1.117 O=CCN1CCCCCCC1 Amb18183003 [1,0,0,1,0,0|1,0,1]=4 534 B11R1.117 O=C\C=C/1\CCCCCC=C1 Amb24512390 [1,0,0,1,0,0|0,0,2]=4 535 B11R1.117 OCCC1CCCCCC=C1 Amb24475566 [1,0,0,1,0,0|0,0,1]=3 536 B11R1.180 C#CCCCC1CCCC1=O Amb24676912 [1,0,0,1,0,0|0,0,2]=4 537 B11R1.180 C=C=CCCC1CCCC1=O Amb25151625 [1,0,0,1,0,0|0,0,2]=4 538 B11R1.180 C=CCCCC1CCCC1O Amb24762973 [1,0,0,1,0,0|0,0,1]=3 539 B11R1.180 C=CCCCC1CCNC1=O Amb25385737 [1,0,0,1,0,0|1,0,0]=3 540 B11R1.180 C=CCCCC1CSCC1=O Amb24755634 [1,0,0,1,0,0|1,0,0]=3 541 B11R1.180 C=CCCCC1CSCC1O Amb24755627 [1,0,0,1,0,0|1,0,1]=4 542 B11R1.180 C=CCCNC1CCCC1O Amb24755944 [1,0,0,1,0,0|1,0,1]=4 543 B11R1.180 C=CCCOC1CCCC1N Amb24761941 [1,0,0,1,0,0|2,0,0]=4 544 B11R1.180 C=CCCSC1CCNC1=O Amb24755982 [1,0,0,1,0,0|2,0,0]=4 545 B11R1.180 C=CCC\C=C/1\CCCC1=O Amb24357317 [1,0,0,1,0,0|0,0,2]=4 546 B11R1.180 C=CCOC[C@@H]1CCCC1=O Amb25382187 [1,0,0,1,0,0|1,0,0]=3 547 B11R1.180 C=COCCC1CCCC1=O Amb24766898 [1,0,0,1,0,0|1,0,0]=3 548 B11R1.180 C=C\C=C\CC1CCCC1=O Amb24633083 [1,0,0,1,0,0|0,0,2]=4 549 B11R1.180 CC1CCCN1CCCC=C Amb24750971 [1,0,0,1,0,0|1,0,1]=4 550 B11R1.180 CCCCCC1CSCC1=O Amb24755633 [1,0,0,1,0,0|1,0,1]=4 551 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [1,0,0,1,0,0|1,0,1]=4 552 B11R1.180 CCCCC[C@@H]1CCCC1=O Amb24766745 [1,0,0,1,0,0|0,0,1]=3 553 B11R1.180 CCCCC[C@H]1CCCC1=O Amb24766930 [1,0,0,1,0,0|0,0,1]=3 554 B11R1.180 CCOCCC1CCCC1=O Amb18177471 [1,0,0,1,0,0|1,0,1]=4 555 B11R1.180 COCCCC1CCCC1=O Amb18787632 [1,0,0,1,0,0|1,0,1]=4 556 B11R1.180 N#CCCCC1CCCC1=O Amb25717939 [1,0,0,1,0,0|1,0,1]=4 557 B11R1.180 O=C1CCCN1CCCCCl Amb18184015 [1,0,0,1,0,0|2,0,0]=4 558 B11R1.180 O=CCCCC1CCCC1=O Amb25383544 [1,0,0,1,0,0|1,0,0]=3 559 B11R1.180 O=CCCCN1CCCC1=O Amb25384628 [1,0,0,1,0,0|2,0,0]=4 560 B11R1.180 OC1CCCC1CCCC=O Amb25383522 [1,0,0,1,0,0|1,0,0]=3 561 B11R1.180 OCCCCC1CSCC1=O Amb24755632 [1,0,0,1,0,0|2,0,0]=4 562 B11R1.203 C=CCCC1CCCCCN1 Amb24418713 [1,0,0,1,0,0|1,0,0]=3 563 B11R1.203 C=COCC1CCCCCC1 Amb25125424 [1,0,0,1,0,0|1,0,1]=4 564 B11R1.203 O=CCCC1CCCCCN1 Amb24710330 [1,0,0,1,0,0|1,0,0]=3 565 B11R1.203 O=CCCC=1CCCCCC1 Amb25277245 [1,0,0,1,0,0|0,0,1]=3 566 B11R1.203 O=CCCN1CCCCCC1 Amb18177425 [1,0,0,1,0,0|1,0,1]=4 567 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [1,0,0,1,0,0|1,0,1]=4 568 B11R1.203 O=CCSC1CCCCC=C1 Amb25188722 [1,0,0,1,0,0|1,0,0]=3 569 B11R1.203 OCCCC1C=CCCCO1 Amb25261765 [1,0,0,1,0,0|1,0,1]=4 570 B11R1.203 OCCCC1CCCCC=C1 Amb24355173 [1,0,0,1,0,0|0,0,1]=3 571 B11R1.203 OCCOC1CCCCC=C1 Amb24577377 [1,0,0,1,0,0|1,0,1]=4 572 B11R1.248 O=CC=1CCCCCCCC1 Amb25172766 [1,0,0,1,0,0|0,0,1]=3 573 B13R1.42 CC(CC=O)C#CC1CCCC=C1 Amb24364128 [0,1,0,1,0,0|0,0,2]=4 574 B13R1.119 O=CCCCCCCC1OCCO1 Amb24490278 [0,1,0,1,0,0|1,0,1]=4 575 B13R1.226 C=CCC1CCC=CCCC(=O)N1 Amb24640373 [0,1,0,1,0,0|0,0,2]=4 576 B13R1.226 OCCC1CCCCCCC(=O)O1 Amb25284567 [0,1,0,1,0,0|1,0,1]=4 577 B13R1.229 OCCC1CC=CCCCCCC1 Amb25287105 [0,1,0,1,0,0|0,0,2]=4 578 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [0,1,0,1,0,0|0,0,2]=4 579 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [0,1,0,1,0,0|0,0,2]=4 580 B13R1.279 O=C1NCCCCCCCCCN1 Amb24616274 [0,1,0,1,0,0|1,0,1]=4 581 B13R1.279 OC1C=CCCCCCCCC=C1 Amb25129797 [0,1,0,1,0,0|0,0,2]=4 582 B13R1.279 OC1CC=CC=CCCCCCC1 Amb25346412 [0,1,0,1,0,0|1,0,0]=3 583 B13R1.463 CC(CCC)C1CCCCCC1=O Amb24657103 [0,1,0,1,0,0|0,0,2]=4 584 B13R1.463 CC(CCO)C1CCCCCC1=O Amb24430985 [0,1,0,1,0,0|1,0,1]=4 585 B13R1.567 CC=CC1CCCC(CCC=C)N1 Amb20247581 [0,1,0,1,0,0|1,0,1]=4 586 B13R1.603 C=CC1CCCCCCCCC1=O Amb25287600 [0,1,0,1,0,0|0,0,0]=2 587 B13R1.603 C=C[C@@H]1CCCCCCC=C[C@H]1O Amb24675629 [0,1,0,1,0,0|0,0,2]=4 588 B13R1.603 N#CC1CCCCCCCCC1=O Amb24494980 [0,1,0,1,0,0|0,0,2]=4 589 B13R1.603 O=CC1CCCCCCCCC1=O Amb25287227 [0,1,0,1,0,0|0,0,1]=3 590 B13R1.603 O=CC1CCCCCCCCC1Cl Amb24469324 [0,1,0,1,0,0|0,0,2]=4 591 B13R1.603 O\C=C/1\CCCCCCCCC1=O Amb25346342 [0,1,0,1,0,0|0,0,0]=2 592 B13R1.603 [N-]=[N+]=C1CCCCCCCCC1=O Amb17594627 [0,1,0,1,0,0|1,0,0]=3 593 B13R1.654 CCCCCCCC1CCOC1=O Amb22230225 [0,1,0,1,0,0|0,0,2]=4 594 B13R1.654 CCCCCCCN1CCCC1=O Amb20621393 [0,1,0,1,0,0|0,0,2]=4 595 B13R1.1464 CN(CC=C)C1CCCCCC=C1 Amb25348209 [0,1,0,1,0,0|2,0,0]=4 596 B13R1.2140 C=CC1C(CCCCCC1=O)C=C Amb24492379 [0,1,0,1,0,0|1,0,1]=4 597 B13R1.2140 C=C[C@H]1[C@@H](CCCCCC1=O)C=C Amb24512458 [0,1,0,1,0,0|1,0,1]=4 598 B13R1.2792 CN1CCCCC=CC(=O)NCC1 Amb25041151 [0,1,0,1,0,0|2,0,0]=4 599 B13R1.2792 OC1CCOC(=O)CCCCCC1 Amb24462040 [0,1,0,1,0,0|1,0,1]=4 600 B13R1.3516 C=CCCC1CCCC(O)C1C#N Amb24704482 [0,1,0,1,0,0|1,0,1]=4 601 B13R1.9128 C=CCC1(O)CCC=CCCC1=O Amb25839767 [0,1,0,1,0,0|0,0,2]=4 602 B13R1.9128 C=CCC1(O)CCCCCCC1=O Amb24417193 [0,1,0,1,0,0|0,0,0]=2 603 B13R1.9128 CC1(CC=C)CCCCCCC1=O Amb25350952 [0,1,0,1,0,0|0,0,0]=2 604 B13R1.28 C=CCCCOCC1CNCCC1 Amb21957479 [0,1,0,1,0,0|2,0,0]=4 605 B13R1.34 C=C\C=C\CC1CCCCCC1=O Amb24570376 [0,1,0,1,0,0|0,0,1]=3 606 B13R1.34 C\C=C\CSC1CCCCNC1=O Amb25680412 [0,1,0,1,0,0|2,0,0]=4 607 B13R1.84 C\C=C\C=C\[C@@H]1CCCC[C@@H]1C=O Amb25318942 [0,1,0,1,0,0|0,0,2]=4 608 B13R1.154 C=CCOC1CCC=CCCC1=O Amb25046109 [0,1,0,1,0,0|0,0,2]=4 609 B13R1.154 C=CCOC1CCCCCCC1O Amb25670731 [0,1,0,1,0,0|0,0,2]=4 610 B13R1.154 C=CCO[C@@H]1CCCCCC[C@@H]1O Amb24547043 [0,1,0,1,0,0|0,0,2]=4 611 B13R1.154 CCCC[C@H]1C=CCCCC[C@@H]1O Amb24588248 [0,1,0,1,0,0|1,0,1]=4 612 B13R1.154 CNCCN1CCCCCCC1=O Amb18977649 [0,1,0,1,0,0|1,0,1]=4 613 B13R1.154 O=C1CCCCCCN1CCCS Amb25792227 [0,1,0,1,0,0|1,0,1]=4 614 B13R1.154 O=CCCC1CCCCCCC1=O Amb25190625 [0,1,0,1,0,0|0,0,1]=3 615 B13R1.154 O=CCCN1CCCCCCC1=O Amb19045224 [0,1,0,1,0,0|1,0,0]=3 616 B13R1.154 OCCCC1CCCCCCC1=O Amb24457861 [0,1,0,1,0,0|0,0,2]=4 617 B13R1.203 C=C1CCCCC#CCCCC1=O Amb25373291 [0,1,0,1,0,0|0,0,1]=3 618 B13R1.203 O=C1CCCCCCCCCC1Cl Amb24561040 [0,1,0,1,0,0|0,0,2]=4 619 B13R1.378 NCCN1CCCCCCCC1=O Amb24650951 [0,1,0,1,0,0|1,0,1]=4 620 B13R1.485 C\C=C\C=C/1\CCCCC1CC=O Amb25192681 [0,1,0,1,0,0|0,0,2]=4 621 B13R1.485 N#CCCC1CCCCC1NC=O Amb18128763 [0,1,0,1,0,0|1,0,1]=4 622 B13R1.485 O=CNCC1CCCCC1NC=O Amb25327375 [0,1,0,1,0,0|2,0,0]=4 623 B13R1.489 O=CCCN1CCCCCCCC1 Amb24411095 [0,1,0,1,0,0|0,0,2]=4 624 B13R1.555 CCCCCCC1CCCCC1=O Amb19045128 [0,1,0,1,0,0|0,0,2]=4 625 B13R1.570 C=CCNC1CCCCCC1C#N Amb18300957 [0,1,0,1,0,0|1,0,1]=4 626 B13R1.623 O=CC1CCCCCCCCC=C1 Amb24706997 [0,1,0,1,0,0|0,0,0]=2 627 B13R1.1150 O=CNCCC1CCCCCCC1 Amb25195820 [0,1,0,1,0,0|0,0,2]=4 628 B13R1.486 OCCCC1CCCCCC(=O)N1 Amb18191307 [0,1,0,1,0,0|1,0,1]=4 629 B13R1.486 OCCCC1CCCCCC(=O)O1 Amb24569922 [0,1,0,1,0,0|1,0,1]=4 630 B13R1.1148 C#CCCCC1CC(=O)CCCC1 Amb25137368 [0,1,0,1,0,0|0,0,2]=4 631 B13R1.1627 CCCC[C@@H]1[C@@H](O)CCCCC1=C Amb25212257 [0,1,0,1,0,0|1,0,1]=4 632 B13R1.2457 C=CCC#CC1(O)CCCCC1=O Amb24534288 [0,1,0,1,0,0|0,0,2]=4 633 B13R1.2457 CC1(CCCC#N)CCCCC1=O Amb24676788 [0,1,0,1,0,0|1,0,1]=4 634 B13R1.3803 OC1CCCCNC(=O)CCCC1 Amb24694118 [0,1,0,1,0,0|1,0,1]=4 635 B13R1.7533 CC=1CCCC(=C)C(=O)CCCC1 Amb24357118 [0,1,0,1,0,0|0,0,2]=4 636 B13R1.27 CCCCCCCC1CCC(=O)O1 Amb1154110 [0,1,0,1,0,0|0,0,2]=4 637 B13R1.487 CCCC[C@H]1CCCC[C@H](O)C=C1 Amb25176986 [0,1,0,1,0,0|1,0,1]=4 638 B13R1.656 CC1CC(CCCC#C)C(=O)CC1 Amb25046933 [0,1,0,1,0,0|0,0,2]=4 639 B13R1.674 C=CCNC(=O)C1CCCCC1=O Amb24529743 [0,1,0,1,0,0|1,0,1]=4 640 B13R1.674 C=CCNC(=S)C1CCCCC1=O Amb25701698 [0,1,0,1,0,0|1,0,1]=4 641 B13R1.1944 CC1(CCC#N)CCCCC1C=O Amb25808044 [0,1,0,1,0,0|1,0,1]=4 642 B13R1.1958 CC1(CCC#N)CCCCCC1=O Amb24492416 [0,1,0,1,0,0|1,0,1]=4 643 B13R1.1958 CC1(CCC=O)CCCCCC1=O Amb24432243 [0,1,0,1,0,0|1,0,0]=3 644 B13R1.158 OC(=O)CCCC1CCCCC1=O Amb17594755 [0,1,0,1,0,0|1,0,0]=3 645 B13R1.224 C#CCC1CCCCCC1C(O)=O Amb25369715 [0,1,0,1,0,0|0,0,2]=4 646 B13R1.224 CCCC1CCCCCC1C(O)=O Amb24377494 [0,1,0,1,0,0|0,0,2]=4 647 B13R1.224 OC(=O)C1CCCCCC1NC=O Amb24442240 [0,1,0,1,0,0|2,0,0]=4 648 B13R1.280 C=C(Br)CNC1CCCCNC1=O Amb25287791 [0,1,0,1,0,0|2,0,0]=4 649 B13R1.280 CC(=C)CCC1CCCCCC1Br Amb25274665 [0,1,0,1,0,0|1,0,1]=4 650 B13R1.280 CC(=C)CCC1CCCCCC1Cl Amb24389910 [0,1,0,1,0,0|1,0,1]=4 651 B13R1.280 CC(=C)CSC1CCCCNC1=O Amb25806600 [0,1,0,1,0,0|2,0,0]=4 652 B13R1.280 CC(=O)CCC1CCCCNC1=O Amb24585772 [0,1,0,1,0,0|1,0,1]=4 653 B13R1.280 CC(C)=CCC1CCCCCC1=O Amb18805154 [0,1,0,1,0,0|0,0,2]=4 654 B13R1.280 CC(C)CCC1CCCCCC1=O Amb18324532 [0,1,0,1,0,0|0,0,2]=4 655 B13R1.280 CC(O)CCC1CCCCCC1=O Amb25726182 [0,1,0,1,0,0|0,0,2]=4 656 B13R1.280 CC=1CCCCCC1CCC(O)=O Amb24391509 [0,1,0,1,0,0|0,0,2]=4 657 B13R1.280 CN1CCCCCC1CCC(O)=O Amb18191306 [0,1,0,1,0,0|1,0,1]=4 658 B13R1.280 CS(=O)CCC1CCCCCC1=O Amb24539000 [0,1,0,1,0,0|1,0,1]=4 659 B13R1.280 NC(=O)CCC1CCCCCC1=O Amb24680139 [0,1,0,1,0,0|1,0,0]=3 660 B13R1.280 NC(=O)CCN1CCCCCC1=O Amb18326291 [0,1,0,1,0,0|2,0,0]=4 661 B13R1.280 OC(=O)CCC1CCCCCC1=O Amb18822898 [0,1,0,1,0,0|1,0,0]=3 662 B13R1.280 OC(=O)CCN1CCCCCC1=O Amb1125181 [0,1,0,1,0,0|2,0,0]=4 663 B13R1.283 C=C(Br)CN1CCCCCCC1=O Amb25840541 [0,1,0,1,0,0|1,0,0]=3 664 B13R1.283 CC(=O)CN1CCCCCCC1=O Amb18328182 [0,1,0,1,0,0|1,0,1]=4 665 B13R1.283 NC(=O)CN1CCCCCCC1=O Amb18322825 [0,1,0,1,0,0|2,0,0]=4 666 B13R1.283 OC(=O)CC1CCCCCCC1=O Amb25187867 [0,1,0,1,0,0|1,0,0]=3 667 B13R1.337 OC(=O)CCCCC1CCCCC1 Amb22336378 [0,1,0,1,0,0|0,0,2]=4 668 B13R1.343 OC(=O)CCCCCC1CCSS1 Amb17614989 [0,1,0,1,0,0|2,0,0]=4 669 B13R1.380 C=CCC/1CCCC\C1=C/C(O)=O Amb22339292 [0,1,0,1,0,0|0,0,2]=4 670 B13R1.380 C=CCC/1CCCC\C1=C\C(O)=O Amb24711380 [0,1,0,1,0,0|0,0,2]=4 671 B13R1.380 CC(=O)N[C@@H]1CCCC[C@@H]1CC=C Amb24548262 [0,1,0,1,0,0|1,0,0]=3 672 B13R1.380 CCCC1CCCCC1CC(O)=O Amb22339365 [0,1,0,1,0,0|0,0,2]=4 673 B13R1.380 OC(=O)CC1CCCCC1NC=O Amb24396622 [0,1,0,1,0,0|2,0,0]=4 674 B13R1.380 OC(=O)C[C@@H]1CCCC[C@@H]1NC=O Amb24601097 [0,1,0,1,0,0|2,0,0]=4 675 B13R1.572 C=CCNC1CCCCC1C(O)=O Amb22585760 [0,1,0,1,0,0|1,0,0]=3 676 B13R1.572 OC(=O)C1CCCCC1CNC=O Amb24635051 [0,1,0,1,0,0|2,0,0]=4 677 B13R1.610 CC(=C)CC1CCCCCC1CN Amb24715363 [0,1,0,1,0,0|1,0,1]=4 678 B13R1.610 CC(=C)CC=1CCCCCC1C=O Amb25835649 [0,1,0,1,0,0|0,0,2]=4 679 B13R1.610 CNC1CCCCCC1CC(C)=C Amb24619093 [0,1,0,1,0,0|2,0,0]=4 680 B13R1.610 COC1CCCCCC1CC(O)=O Amb18822015 [0,1,0,1,0,0|1,0,1]=4 681 B13R1.610 OCC1CCCCCC1CC(O)=O Amb25101626 [0,1,0,1,0,0|1,0,1]=4 682 B13R1.614 CCC1CCCCCCC1C(O)=O Amb24710104 [0,1,0,1,0,0|0,0,2]=4 683 B13R1.1009 OC(=O)C1CCCCCCCCC1 Amb25061287 [0,1,0,1,0,0|0,0,2]=4 684 B13R1.1009 OC(=O)C=1C=CCCCCCCC1 Amb24469345 [0,1,0,1,0,0|0,0,2]=4 685 B13R1.1009 OC(=O)C=1CCCCCCCCC1 Amb24711230 [0,1,0,1,0,0|0,0,2]=4 686 B13R1.1022 CC(=O)CCC1CCCCCCC1 Amb25120339 [0,1,0,1,0,0|0,0,2]=4 687 B13R1.1022 OC(=O)CNC1CCCCCC=C1 Amb25277891 [0,1,0,1,0,0|1,0,0]=3 688 B13R1.1022 OC(=O)CSC1CCCCCC=C1 Amb25075314 [0,1,0,1,0,0|1,0,0]=3 689 B13R1.1107 CC(=O)CC1C=CCCCCC=C1 Amb25192357 [0,1,0,1,0,0|0,0,2]=4 690 B13R1.1107 OC(=O)CC1CCCCCCCC1 Amb25279551 [0,1,0,1,0,0|0,0,2]=4 691 B13R1.3816 CN1CCCCCCCC1C(O)=O Amb25365310 [0,1,0,1,0,0|1,0,1]=4 692 B13R1.3816 NC1CCCCCCCC1C(O)=O Amb24436959 [0,1,0,1,0,0|1,0,1]=4 693 B13R1.527 CC(C=C)NC1CCCCNC1=O Amb24635517 [0,1,0,1,0,0|2,0,0]=4 694 B13R1.527 CC(CC1CCCCCC1=O)=CCl Amb25362800 [0,1,0,1,0,0|1,0,1]=4 695 B13R1.527 CC(CC1CCCCCC1=O)CC Amb19074206 [0,1,0,1,0,0|0,0,2]=4 696 B13R1.527 CC(CC1CCCCCC1=O)OC Amb25307759 [0,1,0,1,0,0|1,0,1]=4 697 B13R1.528 CC(CCC1CCCCC1=O)C#N Amb18128519 [0,1,0,1,0,0|1,0,1]=4 698 B13R1.528 N#CC(Cl)CCC1CCCCC1=O Amb18653161 [0,1,0,1,0,0|1,0,1]=4 699 B13R1.546 C=CC(O)C1CCCCCCC1=O Amb24495497 [0,1,0,1,0,0|0,0,0]=2 700 B13R1.546 C=CC(O)C1CCCCCCC1O Amb25346070 [0,1,0,1,0,0|0,0,2]=4 701 B13R1.1689 CCC(O)C1CCCCCCC=C1 Amb24688107 [0,1,0,1,0,0|1,0,1]=4 702 B13R1.1689 CC[C@H](O)[C@H]1CCCCCCC=C1 Amb24592489 [0,1,0,1,0,0|1,0,1]=4 703 B13R1.1870 CC(C=C)NC1CCCCCC=C1 Amb24382893 [0,1,0,1,0,0|2,0,0]=4 704 B13R1.2122 COC1CCCCCCC(O)C1=O Amb24749594 [0,1,0,1,0,0|1,0,1]=4 705 B13R1.3819 C=C1CCCCCCCC(=C)C1=O Amb24492645 [0,1,0,1,0,0|0,0,1]=3 706 B13R1.3819 OC1CCCCCCCC(=O)C1=O Amb25097840 [0,1,0,1,0,0|1,0,0]=3 707 B13R1.3908 C=CC1(O)CCCCCC1CCO Amb25296106 [0,1,0,1,0,0|0,0,2]=4 708 B13R1.3908 C=C[C@]1(O)CCCCC[C@@H]1CCO Amb25206650 [0,1,0,1,0,0|0,0,2]=4 709 B13R1.3908 C=C[C@]1(O)CCCCC[C@H]1CCO Amb25236138 [0,1,0,1,0,0|0,0,2]=4 710 B13R2.1 O=CCC1CCC2CCCC=C12 Amb18646127 [0,0,0,2,0,0|0,0,0]=2 711 B13R2.14 O=C1CCCCC12CCCCN2 Amb25071832 [0,0,0,2,0,0|1,0,1]=4 712 B13R2.14 O=C1CCCC[C@]12CNCCC2 Amb24532504 [0,0,0,2,0,0|1,0,1]=4 713 B13R2.15 O=C1CCCC1C2CCCC=C2 Amb25793020 [0,0,0,2,0,0|0,0,0]=2 714 B13R2.15 O=C1CCCC1C2CCCCC2 Amb18798696 [0,0,0,2,0,0|0,0,2]=4 715 B13R2.15 O=C1CCCC1C2CCCCN2 Amb24602251 [0,0,0,2,0,0|1,0,1]=4 716 B13R2.15 O=C1CCCC1C2CCCCO2 Amb25808120 [0,0,0,2,0,0|1,0,1]=4 717 B13R2.15 O=C1CCCC1C=2CCCOC2 Amb25707019 [0,0,0,2,0,0|1,0,1]=4 718 B13R2.27 O=C1CCC1CC2CCCCC2 Amb25713657 [0,0,0,2,0,0|0,0,2]=4 719 B13R2.733 O=CNC1CCC2C=CCC1O2 Amb24374711 [0,0,0,2,0,0|2,0,0]=4 720 B13R2.733 O=CN[C@@H]1CC[C@@H]2C=CC[C@H]1O2 Amb25238695 [0,0,0,2,0,0|2,0,0]=4 721 B13R2.1613 O=CC1=CCC[C@@H]2CCCC[C@@H]12 Amb25273021 [0,0,0,2,0,0|0,0,2]=4 722 B13R2.1613 O=CC1CC=CC2CCCCC12 Amb25039210 [0,0,0,2,0,0|0,0,2]=4 723 B13R2.1613 O=CC1CCCC2CCCCC21 Amb25044373 [0,0,0,2,0,0|0,0,2]=4 724 B13R2.5252 O=C1C=CCC[C@@H]2CCCC[C@H]12 Amb25179688 [0,0,0,2,0,0|0,0,0]=2 725 B13R2.5252 O=C1CCCCC2C=CCCC12 Amb25370590 [0,0,0,2,0,0|0,0,0]=2 726 B13R2.5252 O=C1CCCCC2CCCC=C12 Amb24416717 [0,0,0,2,0,0|0,0,0]=2 727 B13R2.5252 O=C1CCCCC2CCCCC12 Amb25712919 [0,0,0,2,0,0|0,0,2]=4 728 B13R2.5252 O=C1CCCCC2OCCCC12 Amb25319992 [0,0,0,2,0,0|1,0,1]=4 729 B13R2.5252 O=C1CCCCC=2CCCCC21 Amb25713669 [0,0,0,2,0,0|0,0,2]=4 730 B13R2.5252 O=C1CCCC[C@@H]2CC=CC[C@H]12 Amb24553544 [0,0,0,2,0,0|0,0,2]=4 731 B13R2.5252 O=C1CCCC[C@@H]2CCCC=C12 Amb25059719 [0,0,0,2,0,0|0,0,0]=2 732 B13R2.5252 O=C1CCCC[C@H]2C=CCC[C@@H]12 Amb24608587 [0,0,0,2,0,0|0,0,0]=2 733 B13R2.5252 O=C1CCCC[C@H]2CCCC[C@H]12 Amb25263095 [0,0,0,2,0,0|0,0,2]=4 734 B13R2.208 O=C1CCCCCC12CCCC2 Amb25202509 [0,0,0,2,0,0|0,0,2]=4 735 B13R2.208 O=C1CCCCCC12CCCO2 Amb25839242 [0,0,0,2,0,0|1,0,1]=4 736 B13R2.208 O=C1CCCCCC12CNCC2 Amb18826928 [0,0,0,2,0,0|1,0,1]=4 737 B13R2.228 O=C1CC[C@H]2CC[C@@H]1CCC2=O Amb25318988 [0,0,0,2,0,0|1,0,0]=3 738 B13R2.344 O=C1CCCC2CC1CCC2=O Amb25751566 [0,0,0,2,0,0|1,0,0]=3 739 B13R2.383 C=C1CCC2C1CCCCC2=O Amb24422463 [0,0,0,2,0,0|0,0,0]=2 740 B13R2.383 C=C1CCC=CC2C1CCC2=O Amb24662376 [0,0,0,2,0,0|0,0,2]=4 741 B13R2.383 CN1CCC2C1CCCCC2=O Amb25767823 [0,0,0,2,0,0|1,0,1]=4 742 B13R2.383 O=C1CCC2C(=O)CCCCN12 Amb25298378 [0,0,0,2,0,0|2,0,0]=4 743 B13R2.383 O=C1CC[C@H]2C(=O)CCCCN12 Amb25282789 [0,0,0,2,0,0|2,0,0]=4 744 B13R2.1421 C=C[C@@H]1C[C@H]2CCCC[C@H]1C2=O Amb24646454 [0,0,0,2,0,0|0,0,0]=2 745 B13R2.2438 CCCCC12CC1CCCC2=O Amb24378373 [0,0,0,2,0,0|0,0,2]=4 746 B13R2.2438 CCCC[C@@]12C[C@@H]1CCCC2=O Amb24551556 [0,0,0,2,0,0|0,0,2]=4 747 B13R2.2442 O=C1C[C@@H]2CCC[C@]12CCCCl Amb25172887 [0,0,0,2,0,0|1,0,1]=4 748 B13R2.2453 CCCC[C@H]1[C@@H]2CCC[C@@H]2C1=O Amb25236971 [0,0,0,2,0,0|0,0,2]=4 749 B13R2.3029 O=C1CCC2CCCC1OC2=O Amb25674401 [0,0,0,2,0,0|2,0,0]=4 750 B13R2.3029 O=C1CC[C@H]2CCC[C@@H]1OC2=O Amb24620156 [0,0,0,2,0,0|2,0,0]=4 751 B13R2.3689 CC1=CCC2CCCCC1C2=O Amb24621278 [0,0,0,2,0,0|0,0,2]=4 752 B13R2.3729 O=C1CCC2CCCCC=C2N1 Amb25774403 [0,0,0,2,0,0|1,0,1]=4 753 B13R2.3729 O=C1CCC2CCCCCC2N1 Amb25672141 [0,0,0,2,0,0|1,0,1]=4 754 B13R2.3729 O=C1CCC=2CCCCCC2N1 Amb25034622 [0,0,0,2,0,0|1,0,1]=4 755 B13R2.3729 O=C1CN2CCCCCC2CC1 Amb24524898 [0,0,0,2,0,0|1,0,1]=4 756 B13R2.3729 O=C1C[C@@H]2CCCCC[C@@H]2CC1 Amb25233750 [0,0,0,2,0,0|0,0,2]=4 757 B13R2.3729 O=C1C[C@H]2CCCCC[C@@H]2CC1 Amb24512411 [0,0,0,2,0,0|0,0,2]=4 758 B13R2.3757 O[C@]12CCCCC[C@@H]1CCC2=O Amb24608604 [0,0,0,2,0,0|1,0,1]=4 759 B13R2.3893 O=C1C2CCCCC1CCCC2 Amb25066455 [0,0,0,2,0,0|0,0,2]=4 760 B13R2.3893 O=C1[C@@H]2CC=CC[C@H]1CCCC2 Amb25066412 [0,0,0,2,0,0|0,0,2]=4 761 B13R2.3893 O=C1[C@@H]2CCCC[C@@H]1CCCC2 Amb25128939 [0,0,0,2,0,0|0,0,2]=4 762 B13R2.3893 O=C1[C@@H]2CCCC[C@H]1CCCC2 Amb25319985 [0,0,0,2,0,0|0,0,2]=4 763 B13R2.4901 O=C1CCCCCC1C2CCC2 Amb24712009 [0,0,0,2,0,0|0,0,2]=4 764 B13R2.5 O=CC1CCCCC12CCCC2 Amb18646650 [0,0,0,2,0,0|0,0,2]=4 765 B13R2.18 O=C1CCCCC1C2CCCC2 Amb18798695 [0,0,0,2,0,0|0,0,2]=4 766 B13R2.18 O=C1CCCCC1C2CCCN2 Amb20667669 [0,0,0,2,0,0|1,0,1]=4 767 B13R2.18 O=C1CCCCC1C2CCCN2 Amb22157204 [0,0,0,2,0,0|1,0,1]=4 768 B13R2.18 O=C1CCCCC1C2CCCO2 Amb25370820 [0,0,0,2,0,0|1,0,1]=4 769 B13R2.18 O=C1CCCCC1C2COCC2 Amb24406247 [0,0,0,2,0,0|1,0,1]=4 770 B13R2.29 O=C1CCCC1CC2CCCC2 Amb18177839 [0,0,0,2,0,0|0,0,2]=4 771 B13R2.29 O=C1CCCC1CC2CCCO2 Amb18799108 [0,0,0,2,0,0|1,0,1]=4 772 B13R2.292 O=CCC1CCCC2CCCN21 Amb25086737 [0,0,0,2,0,0|1,0,1]=4 773 B13R2.628 O=CC1=CC=CCC2CCCC12 Amb25733118 [0,0,0,2,0,0|0,0,2]=4 774 B13R2.628 O=CC1CCCCC2=CCCC21 Amb24497273 [0,0,0,2,0,0|0,0,2]=4 775 B13R2.628 O=CC=1C=CCCC2CCCC12 Amb24680239 [0,0,0,2,0,0|0,0,2]=4 776 B13R2.2520 O=CC#CCC1CC2CC1C=C2 Amb24584469 [0,0,0,2,0,0|0,0,2]=4 777 B13R2.2520 O=CCC\C=C\1/C[C@@H]2C[C@@H]1C=C2 Amb24574694 [0,0,0,2,0,0|0,0,2]=4 778 B13R2.3047 O=C1CCCCCC2CCCN12 Amb22494063 [0,0,0,2,0,0|1,0,1]=4 779 B13R2.3047 O=C1CCCCC[C@H]2C=CC[C@@H]12 Amb25370853 [0,0,0,2,0,0|0,0,0]=2 780 B13R2.9 C\C=C/1\CC[C@H]2[C@@H]1CCCC2=O Amb24520545 [0,0,0,2,0,0|0,0,2]=4 781 B13R2.70 C=CC[C@H]1C[C@@H]2CCC[C@@H]2C1=O Amb25252206 [0,0,0,2,0,0|0,0,0]=2 782 B13R2.70 OCCC1CC2CCCC2C1=O Amb25306796 [0,0,0,2,0,0|1,0,1]=4 783 B13R2.104 C\C=C/1\CCCC12CCCC2=O Amb25179469 [0,0,0,2,0,0|0,0,2]=4 784 B13R2.209 C[C@@H]1[C@H]2CCC[C@@H]2CCCC1=O Amb25263622 [0,0,0,2,0,0|0,0,2]=4 785 B13R2.209 C[C@H]1[C@H]2CCC[C@@H]2CCCC1=O Amb24583050 [0,0,0,2,0,0|0,0,2]=4 786 B13R2.210 O=C1CCC2CCCC2CCC1 Amb25707525 [0,0,0,2,0,0|0,0,2]=4 787 B13R2.210 O=C1CCC2CCCC2CCN1 Amb25324607 [0,0,0,2,0,0|1,0,1]=4 788 B13R2.2093 C=CC1CCC2CCCCNC21 Amb24428241 [0,0,0,2,0,0|2,0,0]=4 789 B13R2.2093 O=CC=1CCC2CCCCCC12 Amb24444378 [0,0,0,2,0,0|0,0,2]=4 790 B13R2.2351 N#C[C@]12CCC[C@@H]1CCCC2=O Amb25373079 [0,0,0,2,0,0|1,0,1]=4 791 B13R2.2488 OC[C@H]1C[C@@H]2C[C@H]1CC[C@@H]2C=O Amb25245404 [0,0,0,2,0,0|1,0,1]=4 792 B13R2.283 C=CCC1C(=O)CC2CCCN21 Amb24662448 [0,0,0,2,0,0|1,0,0]=3 793 B13R2.283 C=CC[C@H]1[C@@H]2CCC[C@H]2NC1=O Amb24597672 [0,0,0,2,0,0|1,0,0]=3 794 B13R2.372 O=C1CCCCCCC1C2CC2 Amb25768528 [0,0,0,2,0,0|0,0,2]=4 795 B13R2.2956 CCC[C@H]1[C@@H]2CCCC[C@@H]2C1=O Amb24612437 [0,0,0,2,0,0|0,0,2]=4 796 B13R2.2956 C\C=C\[C@H]1[C@@H]2CCCC[C@@H]2C1=O Amb25263552 [0,0,0,2,0,0|0,0,2]=4 797 B13R2.3312 OC12CCCCCCC1CC2=O Amb24537748 [0,0,0,2,0,0|1,0,1]=4 798 B13R2.3680 O=C1CCC2CCCC1CCC2 Amb24591402 [0,0,0,2,0,0|0,0,2]=4 799 B13R2.3907 O=C1C2CCCCCC1=CCC2 Amb25667369 [0,0,0,2,0,0|0,0,2]=4 800 B13R2.3907 O=C1C2CCCCCC1CC=C2 Amb25319988 [0,0,0,2,0,0|0,0,0]=2 801 B13R2.4129 C=CC[C@H]1CCC[C@@H]2C[C@@H]2C1=O Amb24690633 [0,0,0,2,0,0|0,0,0]=2 802 B13R2.4688 O=C1C=C2CCCCCCC2O1 Amb25111906 [0,0,0,2,0,0|1,0,0]=3 803 B13R2.4688 O=C1CC2CCC=CCCC2=C1 Amb24736425 [0,0,0,2,0,0|0,0,2]=4 804 B13R2.4688 O=C1CC2CCCCCOC2=C1 Amb24736199 [0,0,0,2,0,0|1,0,0]=3 805 B13R2.4688 OC1CC2CCCCCCC2=C1 Amb25115934 [0,0,0,2,0,0|0,0,2]=4 806 B13R2.7787 C=C[C@@H]1[C@H]2[C@H](O)CCCCC[C@H]21 Amb24515387 [0,0,0,2,0,0|0,0,2]=4 807 B13R2.45 C\C=C/1\CC2CCCCC2C1=O Amb25093788 [0,0,0,2,0,0|0,0,2]=4 808 B13R2.45 OCC1CC2CCCCC2C1=O Amb25347607 [0,0,0,2,0,0|1,0,1]=4 809 B13R2.121 COC1C2CCCC2CCC1=O Amb25094401 [0,0,0,2,0,0|1,0,1]=4 810 B13R2.121 CO[C@H]1[C@@H]2CCC[C@@H]2CCC1=O Amb25298579 [0,0,0,2,0,0|1,0,1]=4 811 B13R2.135 CCC1C2CCCCC2CC1=O Amb25053002 [0,0,0,2,0,0|0,0,2]=4 812 B13R2.135 CO[C@@H]1[C@@H]2CCCC[C@@H]2CC1=O Amb25233760 [0,0,0,2,0,0|1,0,1]=4 813 B13R2.135 CO[C@H]1[C@@H]2CCCC[C@@H]2CC1=O Amb25358989 [0,0,0,2,0,0|1,0,1]=4 814 B13R2.135 C\C=C\1/[C@@H]2CCCC[C@@H]2CC1=O Amb25298374 [0,0,0,2,0,0|0,0,2]=4 815 B13R2.135 N#CC1[C@@H]2CCCC[C@@H]2CC1=O Amb24610144 [0,0,0,2,0,0|1,0,1]=4 816 B13R2.135 N#C[C@@H]1[C@H]2CCCC[C@@H]2CC1=O Amb24631644 [0,0,0,2,0,0|1,0,1]=4 817 B13R2.135 N#C[C@H]1[C@@H]2CCCC[C@@H]2CC1=O Amb25377777 [0,0,0,2,0,0|1,0,1]=4 818 B13R2.386 CC1CCCCC2CCC1C2=O Amb25839284 [0,0,0,2,0,0|0,0,2]=4 819 B13R2.386 O=C1CCCCC2CCC1C2=O Amb25717739 [0,0,0,2,0,0|1,0,0]=3 820 B13R2.386 O[C@H]1CCCC[C@@H]2CC[C@H]1C2=O Amb24512648 [0,0,0,2,0,0|1,0,1]=4 821 B13R2.599 C=CC1=CC2CCCC2CC1=O Amb24691787 [0,0,0,2,0,0|0,0,2]=4 822 B13R2.599 C=CC1=C[C@H]2CCC[C@H]2CC1=O Amb24584386 [0,0,0,2,0,0|0,0,2]=4 823 B13R2.599 COC1CC2CCCC2CC1=O Amb24646681 [0,0,0,2,0,0|1,0,1]=4 824 B13R2.599 COC1C[C@@H]2CCC[C@H]2CC1=O Amb24631656 [0,0,0,2,0,0|1,0,1]=4 825 B13R2.599 CO[C@@H]1C[C@@H]2CCC[C@H]2CC1=O Amb25179407 [0,0,0,2,0,0|1,0,1]=4 826 B13R2.599 O=CC1CC2CCCC2CC1=O Amb24736317 [0,0,0,2,0,0|1,0,0]=3 827 B13R2.2352 C=C1CCC2CCCCC12CO Amb24493581 [0,0,0,2,0,0|0,0,2]=4 828 B13R2.2352 C=CC12CCCCC1=CCC2=O Amb25667365 [0,0,0,2,0,0|0,0,2]=4 829 B13R2.2352 C[C@H]1CC[C@@H]2CCCC[C@@]21C=O Amb25358894 [0,0,0,2,0,0|0,0,2]=4 830 B13R2.2352 N#C[C@]12CCCC[C@H]1CCC2=O Amb24612692 [0,0,0,2,0,0|1,0,1]=4 831 B13R2.2352 O=CC12CCCCC1CCC2=O Amb18646567 [0,0,0,2,0,0|1,0,0]=3 832 B13R2.2352 O=C[C@]12CCCC[C@@H]1CCC2=O Amb24512917 [0,0,0,2,0,0|1,0,0]=3 833 B13R2.2496 O\C=C/1\CCC2CC2CCC1=O Amb24357320 [0,0,0,2,0,0|1,0,1]=4 834 B13R2.2496 O\C=C\1/CC[C@H]2C[C@@H]2CCC1=O Amb24520547 [0,0,0,2,0,0|1,0,1]=4 835 B13R2.4787 O=C1CC2CCCCCCC=C12 Amb25729211 [0,0,0,2,0,0|0,0,0]=2 836 B13R2.4787 O=C1CC2CCCCCCCC12 Amb24434617 [0,0,0,2,0,0|0,0,2]=4 837 B13R2.4787 O=C1NC2CCCCCCC=C12 Amb24410936 [0,0,0,2,0,0|1,0,0]=3 838 B13R2.32 C=C1CCC=2CCCCC2C1=O Amb25792996 [0,0,0,2,0,0|0,0,2]=4 839 B13R2.32 CC1C2CCCCC2CCC1=O Amb24059409 [0,0,0,2,0,0|0,0,2]=4 840 B13R2.32 CC1CC[C@H]2CCCC[C@@H]2C1=O Amb24512415 [0,0,0,2,0,0|0,0,2]=4 841 B13R2.32 CC1[C@@H]2CCCC[C@H]2CCC1=O Amb24736227 [0,0,0,2,0,0|0,0,2]=4 842 B13R2.32 CN1[C@H]2CCCC[C@@H]2CCC1=O Amb24565267 [0,0,0,2,0,0|1,0,1]=4 843 B13R2.32 O=C1C(Cl)CCC2CCCCC12 Amb24426281 [0,0,0,2,0,0|1,0,1]=4 844 B13R2.32 O=C1C(F)CCC2CCCCC12 Amb24736430 [0,0,0,2,0,0|1,0,1]=4 845 B13R2.32 O=C1CCC2C(=C1C)CCCC2 Amb15693446 [0,0,0,2,0,0|0,0,2]=4 846 B13R2.32 O=C1CCC2CCCCC2=C1F Amb24690702 [0,0,0,2,0,0|1,0,1]=4 847 B13R2.32 O=C1CCC2CCCCC2C1F Amb25751548 [0,0,0,2,0,0|1,0,1]=4 848 B13R2.32 O=C1CC[C@H]2CCCC[C@@H]2C1F Amb25245348 [0,0,0,2,0,0|1,0,1]=4 849 B13R2.32 O=C1CC[C@H]2CCCC[C@@H]2[C@@H]1Cl Amb25232965 [0,0,0,2,0,0|1,0,1]=4 850 B13R2.32 O=C1[C@H](Cl)CC[C@H]2CCCC[C@H]12 Amb24550117 [0,0,0,2,0,0|1,0,1]=4 851 B13R2.32 O=C1[C@H](F)CC[C@@H]2CCCCC12 Amb24059957 [0,0,0,2,0,0|1,0,1]=4 852 B13R2.32 OC1CCC2CCCCC2C1=O Amb24647786 [0,0,0,2,0,0|1,0,1]=4 853 B13R2.33 O=C1CCC2CCCCC2CC1 Amb24723947 [0,0,0,2,0,0|0,0,2]=4 854 B13R2.33 O=C1CCC2CCCCN2C=C1 Amb25839298 [0,0,0,2,0,0|1,0,0]=3 855 B13R2.33 O=C1COC2CCCCC2C=C1 Amb24551521 [0,0,0,2,0,0|1,0,0]=3 856 B13R2.33 O=C1COC2CCCCC2CC1 Amb25112633 [0,0,0,2,0,0|1,0,1]=4 857 B13R2.57 O=CC1CC=2CCCCC2CC1 Amb18646128 [0,0,0,2,0,0|0,0,2]=4 858 B13R2.57 O=CC1C[C@H]2CCCC[C@H]2CC1 Amb25216160 [0,0,0,2,0,0|0,0,2]=4 859 B13R2.57 O=CC=1CC2CCCCC2CC1 Amb24467573 [0,0,0,2,0,0|0,0,2]=4 860 B13R2.88 C\C=C\1/CCCCC12CCC2=O Amb24408374 [0,0,0,2,0,0|0,0,2]=4 861 B13R2.571 C=CC1CN2CCC1CC2C=O Amb24551537 [0,0,0,2,0,0|1,0,0]=3 862 B13R2.573 CC[C@H]1CCC[C@H]2[C@@H]1CCC2=O Amb25179745 [0,0,0,2,0,0|0,0,2]=4 863 B13R2.573 OC[C@H]1CCC[C@H]2[C@@H]1CCC2=O Amb25263054 [0,0,0,2,0,0|1,0,1]=4 864 B13R2.667 C\C=C\1/CCC2CC1CCC2=O Amb25735181 [0,0,0,2,0,0|0,0,2]=4 865 B13R2.4048 C=CCC1[C@@H]2C=C[C@H]1C[C@@H]2C=O Amb24550121 [0,0,0,2,0,0|0,0,2]=4 866 B13R2.7258 O=CC12CC=CCC1CCCC2 Amb24662447 [0,0,0,2,0,0|0,0,2]=4 867 B13R2.7258 O=C[C@@]12CCCC[C@@H]1CCCC2 Amb25119298 [0,0,0,2,0,0|0,0,2]=4 868 B13R2.232 CC1=CC[C@@H]2CCC[C@@H]2CC1=O Amb24633563 [0,0,0,2,0,0|0,0,2]=4 869 B13R2.369 CC1C[C@@H]2CCCC[C@H]2CC1=O Amb24736301 [0,0,0,2,0,0|0,0,2]=4 870 B13R2.369 CC1C[C@H]2CCCC[C@@H]2CC1=O Amb24690677 [0,0,0,2,0,0|0,0,2]=4 871 B13R2.369 C[C@@H]1CC2CCCCC2CC1=O Amb25358979 [0,0,0,2,0,0|0,0,2]=4 872 B13R2.369 NC1CC2CCCCC2CC1=O Amb24673684 [0,0,0,2,0,0|1,0,1]=4 873 B13R2.369 N[C@H]1C[C@H]2CCCC[C@H]2CC1=O Amb25245329 [0,0,0,2,0,0|1,0,1]=4 874 B13R2.369 O=C1CC2CCCCC2CC1=O Amb25808040 [0,0,0,2,0,0|1,0,0]=3 875 B13R2.369 O=C1C[C@@H]2CCCC[C@@H]2CC1=O Amb25035009 [0,0,0,2,0,0|1,0,0]=3 876 B13R2.369 O=C1C[C@H]2CCCC[C@@H]2CC1F Amb24604786 [0,0,0,2,0,0|1,0,1]=4 877 B13R2.4745 O=C1CC2CCCCCN2C1=O Amb24514492 [0,0,0,2,0,0|2,0,0]=4 878 B13R2.4821 CC12CCCCC1CCCC2=O Amb25077647 [0,0,0,2,0,0|0,0,2]=4 879 B13R2.4821 C[C@@]12CCCC[C@@H]1CCCC2=O Amb25262768 [0,0,0,2,0,0|0,0,2]=4 880 B13R2.4821 C[C@@]12CCCC[C@H]1CCCC2=O Amb24714916 [0,0,0,2,0,0|0,0,2]=4 881 B13R2.4821 C[C@]12CCCC[C@@H]1CCCC2=O Amb25179516 [0,0,0,2,0,0|0,0,2]=4 882 B13R2.4821 C[C@]12CCCC[C@H]1CCCC2=O Amb24706902 [0,0,0,2,0,0|0,0,2]=4 883 B13R2.4821 O=C1CCCC2CCCCC12F Amb24378960 [0,0,0,2,0,0|1,0,1]=4 884 B13R2.4821 O[C@@]12CCCC[C@@H]1CCCC2=O Amb24697735 [0,0,0,2,0,0|1,0,1]=4 885 B13R2.5254 CC12CCCC1CCCCC2=O Amb24724075 [0,0,0,2,0,0|0,0,2]=4 886 B13R2.5254 C[C@]12CCC[C@H]1CCCCC2=O Amb24655093 [0,0,0,2,0,0|0,0,2]=4 887 B13R2.5254 O[C@]12CCC[C@@H]1CCCCC2=O Amb24512689 [0,0,0,2,0,0|1,0,1]=4 888 B13R2.163 O=C1CC2CCCCC2CCN1 Amb25159400 [0,0,0,2,0,0|1,0,1]=4 889 B13R2.163 O=C1CCCC2CCCCC2N1 Amb25123830 [0,0,0,2,0,0|1,0,1]=4 890 B13R2.163 O=C1CCCC=2CCCCC2N1 Amb25844335 [0,0,0,2,0,0|1,0,1]=4 891 B13R2.9743 C=CCC12CCCC1CCCN2 Amb24399197 [0,0,0,2,0,0|1,0,1]=4 892 B13R2.9743 C=CCC12CCCCC1CCN2 Amb25731870 [0,0,0,2,0,0|1,0,1]=4 893 B13R2.9743 C=CC[C@@]12CCC[C@@H]1CCCN2 Amb24642014 [0,0,0,2,0,0|1,0,1]=4 894 B13R2.26 O=CCC1CC2CCCCC2O1 Amb24707015 [0,0,0,2,0,0|1,0,1]=4 895 B13R2.4106 O=C=NC1C2C=CCCCCC12 Amb25691419 [0,0,0,2,0,0|1,0,1]=4 896 B13R2.9439 O=CC1C2C=CCCCCCC21 Amb25735239 [0,0,0,2,0,0|0,0,0]=2 897 B13R2.9439 OCC1C2C=CCCCCCC21 Amb25680534 [0,0,0,2,0,0|0,0,2]=4 898 B13R2.9439 OCC1[C@@H]2C=CCCCCC[C@@H]21 Amb24515447 [0,0,0,2,0,0|0,0,2]=4 899 B13R2.218 O=C1CCCCC2CCCC2=C1 Amb24364204 [0,0,0,2,0,0|0,0,0]=2 900 B13R2.218 O=C1CCCCC2CCCC2N1 Amb24682761 [0,0,0,2,0,0|1,0,1]=4 901 B13R2.218 O=C1CCCC[C@@H]2CCC[C@@H]2N1 Amb25256754 [0,0,0,2,0,0|1,0,1]=4 902 B13R2.3342 O=C1CC2CC2CCCCCC1 Amb24706951 [0,0,0,2,0,0|0,0,2]=4 903 B13R2.3672 O=C1C=CC2CCCCCCC12 Amb25735813 [0,0,0,2,0,0|0,0,0]=2 904 B13R2.3672 O=C1C=C[C@@H]2CCCCCC[C@@H]12 Amb24706770 [0,0,0,2,0,0|0,0,0]=2 905 B13R2.3672 O=C1CCC=2CCCCCCC21 Amb25767737 [0,0,0,2,0,0|0,0,2]=4 906 B13R2.3672 O=C1CC[C@H]2CC=CCCC[C@H]12 Amb24512473 [0,0,0,2,0,0|0,0,2]=4 907 B13R2.3672 O=C1CC[C@H]2CCCCC=C[C@H]12 Amb25179621 [0,0,0,2,0,0|0,0,2]=4 908 B13R2.4820 O=C1CCCC2CCCCCC12 Amb25370732 [0,0,0,2,0,0|0,0,2]=4 909 B13R2.4820 O=C1CCCC2CCCCCN12 Amb24596906 [0,0,0,2,0,0|1,0,1]=4 910 B13R2.4820 O=C1CCCC=2CCCCNC21 Amb25771825 [0,0,0,2,0,0|1,0,1]=4 911 B13R2.4820 O=C1CCC[C@@H]2CCCCC[C@H]12 Amb24698878 [0,0,0,2,0,0|0,0,2]=4 912 B13R2.168 C=C1CCCC12CCC=CC2=O Amb25294453 [0,0,0,2,0,0|0,0,2]=4 913 B13R2.168 C=C1CCCCC12CCCC2=O Amb25092954 [0,0,0,2,0,0|0,0,0]=2 914 B13R2.168 CC1CCCC12CCCCC2=O Amb17594143 [0,0,0,2,0,0|0,0,2]=4 915 B13R2.168 CN1CCCC12CCCCC2=O Amb24078319 [0,0,0,2,0,0|1,0,1]=4 916 B13R2.168 C[C@@H]1CCCCC12CCCC2=O Amb24551494 [0,0,0,2,0,0|0,0,2]=4 917 B13R2.168 C[C@H]1CCCC12CCCCC2=O Amb25347423 [0,0,0,2,0,0|0,0,2]=4 918 B13R2.168 C[C@H]1CCCCC12CCCC2=O Amb25713056 [0,0,0,2,0,0|0,0,2]=4 919 B13R2.168 O=C1CCCCC12CCNC2=O Amb24559511 [0,0,0,2,0,0|2,0,0]=4 920 B13R2.168 O=C1CCCCC12CCOC2=O Amb25036421 [0,0,0,2,0,0|2,0,0]=4 921 B13R2.168 OC1CCCC12CCCCC2=O Amb25730128 [0,0,0,2,0,0|1,0,1]=4 922 B13R2.168 O[C@@H]1CCC[C@@]12CCCCC2=O Amb25371896 [0,0,0,2,0,0|1,0,1]=4 923 B13R2.168 O[C@H]1CCC[C@@]12CCCCC2=O Amb24590950 [0,0,0,2,0,0|1,0,1]=4 924 B13R2.305 C\C=C\C1CC12CCCCC2=O Amb25735757 [0,0,0,2,0,0|0,0,2]=4 925 B13R2.342 O=C1CCC[C@@H]2[C@@H]1CCCC2=O Amb25202710 [0,0,0,2,0,0|1,0,0]=3 926 B13R2.342 O=C1CCC[C@@H]2[C@H]1CCCC2=O Amb24551485 [0,0,0,2,0,0|1,0,0]=3 927 B13R2.342 OC1CCCC2C1CCCC2=O Amb24408312 [0,0,0,2,0,0|1,0,1]=4 928 B13R2.342 OC1CCC[C@H]2[C@H]1CCCC2=O Amb25322859 [0,0,0,2,0,0|1,0,1]=4 929 B13R2.342 O[C@@H]1CCC[C@@H]2[C@@H]1CCCC2=O Amb24512567 [0,0,0,2,0,0|1,0,1]=4 930 B13R2.567 CN1CCCCC1C2CC2C=O Amb25136264 [0,0,0,2,0,0|1,0,1]=4 931 B13R2.908 CN1CCCC2C1C2CCC=O Amb24745803 [0,0,0,2,0,0|1,0,1]=4 932 B13R2.2411 OCCC1CC2CCCC1C2=O Amb25332767 [0,0,0,2,0,0|1,0,1]=4 933 B13R2.179 C=C1CC1CCC2CCCC2O Amb24430011 [0,0,0,2,0,0|0,0,2]=4 934 B13R2.179 C=C1C[C@H]1CC[C@@H]2CCCC2=O Amb25245293 [0,0,0,2,0,0|0,0,0]=2 935 B13R2.3152 O=C1CCCC1CCC2CCC2 Amb24542953 [0,0,0,2,0,0|0,0,2]=4 936 B13R2.251 COC[C@@H]1CC[C@H]2[C@@H]1CCC2=O Amb24628799 [0,0,0,2,0,0|1,0,1]=4 937 B13R2.8173 O=CCCC12C=CCC1CC=C2 Amb18645714 [0,0,0,2,0,0|0,0,2]=4 938 B13R2.506 OCCCC1CC2C1CCC2=O Amb25751569 [0,0,0,2,0,0|1,0,1]=4 939 B13R2.911 O=CCCC1[C@H]2CCCCC[C@H]21 Amb24610734 [0,0,0,2,0,0|0,0,2]=4 940 B13R2.181 O=C1CCCC1C2CCCC2=O Amb25313247 [0,0,0,2,0,0|1,0,0]=3 941 B13R2.181 O=C1CCC[C@@H]1[C@H]2CCOC2=O Amb25205793 [0,0,0,2,0,0|2,0,0]=4 942 B13R2.181 O=C1CCC[C@H]1[C@@H]2CCCC2=O Amb24617853 [0,0,0,2,0,0|1,0,0]=3 943 B13R2.181 O=C1CCC[C@H]1[C@H]2CCCC2=O Amb25751559 [0,0,0,2,0,0|1,0,0]=3 944 B13R2.181 OC1CCCC1C2CCCC2=O Amb25127075 [0,0,0,2,0,0|1,0,1]=4 945 B13R2.550 O=CC1CC1CC2CCCC2=O Amb24722895 [0,0,0,2,0,0|1,0,0]=3 946 B13R2.550 O=C[C@H]1C[C@H]1CC2CCCC2=O Amb25179511 [0,0,0,2,0,0|1,0,0]=3 947 B13R2.653 N#CC1CCC1C2CCCC2=O Amb24706911 [0,0,0,2,0,0|1,0,1]=4