0 B11R1.166 CC(=C)C1CC[C@H](C)CC1=O Amb25282726 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.166 CC(=C)[C@@H]1CCC(C)CC1=O Amb24486412 [0,0,0,0,0,0|0,0,2]=2 2 B11R1.166 CC(=C)[C@H]1CC[C@H](C)CC1=O Amb24577480 [0,0,0,0,0,0|0,0,2]=2 3 B11R1.166 CC(=O)C1CCC(=O)CC1=O Amb25294579 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.166 CC(=O)C1CC[C@@H](C)CC1=O Amb25347474 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.166 CC(=O)C1CC[C@H](C)CC1=O Amb25373132 [0,0,0,0,0,0|1,0,1]=2 6 B11R1.166 CC(C)=C1CCC(=C)CC1O Amb25069631 [0,0,0,0,0,0|0,0,4]=4 7 B11R1.166 CC(C)=C1CCC(=C)C[C@H]1O Amb25806759 [0,0,0,0,0,0|0,0,4]=4 8 B11R1.166 CC(C)=C1CCC(C)CC1Cl Amb25108661 [0,0,0,0,0,0|1,0,1]=2 9 B11R1.166 CC(C)=C1CCC(O)CC1=O Amb25713542 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.166 CC(C)C1=CCC(C)CC1=O Amb24724531 [0,0,0,0,0,0|0,0,2]=2 11 B11R1.166 CC(C)C1=CCC(C)CC1Br Amb25366060 [0,0,0,0,0,0|1,0,3]=4 12 B11R1.166 CC(C)C1=CCC(C)CC1Cl Amb24635735 [0,0,0,0,0,0|1,0,3]=4 13 B11R1.166 CC(C)C1=CC[C@H](C)CC1=O Amb25044289 [0,0,0,0,0,0|0,0,2]=2 14 B11R1.166 CC(C)C1CCC(=C)CC1=O Amb24379682 [0,0,0,0,0,0|0,0,4]=4 15 B11R1.166 CC(C)C1CCC(=O)CC1=O Amb25320087 [0,0,0,0,0,0|1,0,3]=4 16 B11R1.166 CC(C)C1CCC(C)CC1=C Amb25373822 [0,0,0,0,0,0|1,0,2]=3 17 B11R1.166 CC(C)C1CCC(C)CC1F Amb24538225 [0,0,0,0,0,0|1,0,3]=4 18 B11R1.166 CC(C)C1CCC(C)C[C@H]1N Amb24546285 [0,0,0,0,0,0|1,0,3]=4 19 B11R1.166 CC(C)C1CCC(C)C[C@H]1O Amb24630777 [0,0,0,0,0,0|0,0,4]=4 20 B11R1.166 CC(C)C1CC[C@H](C)CC1N Amb25151662 [0,0,0,0,0,0|1,0,3]=4 21 B11R1.166 CC(C)C1CC[C@H](C)C[C@@H]1O Amb25346356 [0,0,0,0,0,0|0,0,4]=4 22 B11R1.166 CC(C)C1NCC(C)NC1=O Amb24509760 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.166 CC(C)N1CCC(=O)CC1=O Amb24585618 [0,0,0,0,0,0|2,0,2]=4 24 B11R1.166 CC(C)N1CCC(N)CC1=O Amb24450076 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.166 CC(C)N1CC[C@H](C)C[C@@H]1C Amb25796793 [0,0,0,0,0,0|2,0,2]=4 26 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)CC1N Amb25264346 [0,0,0,0,0,0|1,0,3]=4 27 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1Br Amb22747262 [0,0,0,0,0,0|1,0,3]=4 28 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1Cl Amb24587450 [0,0,0,0,0,0|1,0,3]=4 29 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1N Amb24514877 [0,0,0,0,0,0|1,0,3]=4 30 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1Cl Amb22337785 [0,0,0,0,0,0|1,0,3]=4 31 B11R1.166 CC(C)[C@@H]1CC[C@H](C)C[C@@H]1Br Amb22747261 [0,0,0,0,0,0|1,0,3]=4 32 B11R1.166 CC(C)[C@@H]1CC[C@H](C)C[C@@H]1N Amb22745157 [0,0,0,0,0,0|1,0,3]=4 33 B11R1.166 CC(C)[C@@H]1CC[C@H](C)C[C@H]1Cl Amb25210511 [0,0,0,0,0,0|1,0,3]=4 34 B11R1.166 CC(C)[C@@H]1CC[C@H](C)C[C@H]1O Amb18511854 [0,0,0,0,0,0|0,0,4]=4 35 B11R1.166 CC(C)[C@@H]1NC[C@H](C)NC1=O Amb24760146 [0,0,0,0,0,0|2,0,2]=4 36 B11R1.166 CC(C)[C@H]1CCC(C)CC1O Amb17836437 [0,0,0,0,0,0|0,0,4]=4 37 B11R1.166 CC(C)[C@H]1CC[C@@H](C)CC1=C Amb25228122 [0,0,0,0,0,0|1,0,2]=3 38 B11R1.166 CC(C)[C@H]1CC[C@@H](C)CC1O Amb25356283 [0,0,0,0,0,0|0,0,4]=4 39 B11R1.166 CC(C)[C@H]1CC[C@@H](C)C[C@H]1N Amb25326345 [0,0,0,0,0,0|1,0,3]=4 40 B11R1.166 CC(C)[C@H]1CC[C@H](C)CC1=O Amb22232056 [0,0,0,0,0,0|0,0,2]=2 41 B11R1.166 CC(C)[C@H]1CC[C@H](C)CC1N Amb24589680 [0,0,0,0,0,0|1,0,3]=4 42 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@@H]1Cl Amb24512119 [0,0,0,0,0,0|1,0,3]=4 43 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@H]1Br Amb24648329 [0,0,0,0,0,0|1,0,3]=4 44 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@H]1Cl Amb24565045 [0,0,0,0,0,0|1,0,3]=4 45 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@H]1N Amb24514878 [0,0,0,0,0,0|1,0,3]=4 46 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@H]1O Amb22232015 [0,0,0,0,0,0|0,0,4]=4 47 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@H]1S Amb25294009 [0,0,0,0,0,0|0,1,3]=4 48 B11R1.166 CC(Cl)=C1CCC(C)CC1=O Amb25834472 [0,0,0,0,0,0|1,0,0]=1 49 B11R1.166 CC(N)=C1CCC(=O)NC1=O Amb24740119 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.166 CC1=CC(=O)C(=C(C)C)CC1 Amb17593737 [0,0,0,0,0,0|0,0,2]=2 51 B11R1.166 CC1=CC(=O)C(CC1)C(C)C Amb17593801 [0,0,0,0,0,0|0,0,4]=4 52 B11R1.166 CC1CC(C)N(CC1)C(C)=N Amb25370901 [0,0,0,0,0,0|3,0,1]=4 53 B11R1.166 CC1CC=C(C(C)O)C(=O)C1 Amb25150282 [0,0,0,0,0,0|1,0,2]=3 54 B11R1.166 CC1CCC(=C(C)C)C(C1)O Amb1110893 [0,0,0,0,0,0|0,0,2]=2 55 B11R1.166 CC1CCC(=C(N)C1)C(O)=O Amb25724865 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.166 CC1CCC(C(=O)C1)C(=C)C Amb17593802 [0,0,0,0,0,0|0,0,2]=2 57 B11R1.166 CC1CCC(C(=O)C1)C(=O)[Na] Amb24486331 [0,0,0,0,0,0|2,0,1]=3 58 B11R1.166 CC1CCC(C(=O)C1)C(C)C Amb2099476 [0,0,0,0,0,0|0,0,2]=2 59 B11R1.166 CC1CCC(C(=O)N1)C(O)=O Amb24694827 [0,0,0,0,0,0|3,0,1]=4 60 B11R1.166 CC1CCC(C(C)=O)N(C)C1 Amb25151493 [0,0,0,0,0,0|3,0,1]=4 61 B11R1.166 CC1CCC(C(C1)N)C(C)C Amb1120445 [0,0,0,0,0,0|1,0,3]=4 62 B11R1.166 CC1CCC(C(C1)O)C(C)C Amb2450917 [0,0,0,0,0,0|0,0,4]=4 63 B11R1.166 CC1CCC(C(O)=O)=C(Br)C1 Amb24486129 [0,0,0,0,0,0|3,0,0]=3 64 B11R1.166 CC=1CC(=O)C(CC1)C(C)=C Amb24625828 [0,0,0,0,0,0|0,0,4]=4 65 B11R1.166 CC=1CC(=O)CCC1C(C)C Amb24646600 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.166 CC=1CC(C)CCC1C(C)=O Amb24722933 [0,0,0,0,0,0|2,0,0]=2 67 B11R1.166 CC=1CCC(C(=O)C1)=C(C)O Amb24740131 [0,0,0,0,0,0|1,0,2]=3 68 B11R1.166 CC=1CC[C@@H](C(C)C)C(=O)C1 Amb22736504 [0,0,0,0,0,0|0,0,4]=4 69 B11R1.166 CC=1CC[C@H](C(C)C)C(=O)C1 Amb25768486 [0,0,0,0,0,0|0,0,4]=4 70 B11R1.166 CC=1CC\C(\C(=O)C1)=C(/C)\O Amb25359787 [0,0,0,0,0,0|1,0,2]=3 71 B11R1.166 CC=1OC(C)CCC1C(C)=O Amb25073382 [0,0,0,0,0,0|3,0,0]=3 72 B11R1.166 CC=1O[C@H](C)CCC1C(O)=O Amb25765653 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.166 CC=1SC(C)CCC1C(O)=O Amb24390319 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.166 CN1CCN(C(C)C)C(=O)C1 Amb25077784 [0,0,0,0,0,0|2,0,1]=3 75 B11R1.166 C[C@@H]1CC=C(C(C)O)C(=O)C1 Amb25092929 [0,0,0,0,0,0|1,0,2]=3 76 B11R1.166 C[C@@H]1CC[C@@H](C(=O)C1)C(C)C Amb2404928 [0,0,0,0,0,0|0,0,2]=2 77 B11R1.166 C[C@@H]1CC[C@H](C(Cl)C1)C(C)=C Amb24590218 [0,0,0,0,0,0|1,0,3]=4 78 B11R1.166 C[C@@H]1CC[C@H](C(O)C1)C(C)=C Amb24534306 [0,0,0,0,0,0|0,0,4]=4 79 B11R1.166 C[C@@H]1CC[C@H]([C@@H](C1)N)C(C)C Amb10844841 [0,0,0,0,0,0|1,0,3]=4 80 B11R1.166 C[C@@H]1CC[C@H]([C@@H](O)C1)C(C)=C Amb24534394 [0,0,0,0,0,0|0,0,4]=4 81 B11R1.166 C[C@@H]1C[C@H](C)N(CC1)C(C)=O Amb25084638 [0,0,0,0,0,0|3,0,1]=4 82 B11R1.166 C[C@H]1CC[C@@H]([C@@H](O)C1)C(C)=C Amb22337878 [0,0,0,0,0,0|0,0,4]=4 83 B11R1.166 C[C@H]1CC[C@H]([C@@H](O)C1)C(C)=C Amb24675532 [0,0,0,0,0,0|0,0,4]=4 84 B11R1.166 C[C@H]1C[C@@H](C)N(CC1)C(C)=O Amb24741211 [0,0,0,0,0,0|3,0,1]=4 85 B11R1.166 C\C(\Cl)=C/1\CC[C@@H](C)CC1=O Amb24647757 [0,0,0,0,0,0|1,0,0]=1 86 B11R1.166 C\C(\O)=C\1/CCC(=O)NC1=O Amb25189123 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.13 CC(=C)C=1CCC(C)CC1 Amb24364313 [1,0,0,0,0,0|0,0,1]=2 88 B10R1.13 CC(=O)C=1CC[C@@H](C)CC1 Amb24570357 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.13 CC(C)=C1CC=C(C)CC1 Amb18511847 [1,0,0,0,0,0|0,0,3]=4 90 B10R1.13 CC(C)=C1CCC(=O)C=C1 Amb25236964 [1,0,0,0,0,0|1,0,2]=4 91 B10R1.13 CC(C)=C1CCC(O)CC1 Amb24482530 [1,0,0,0,0,0|1,0,1]=3 92 B10R1.13 CC(C)C1CCC(C)C=C1 Amb25350290 [1,0,0,0,0,0|0,0,3]=4 93 B10R1.13 CC(C)C1CCC(C)CN1 Amb25338826 [1,0,0,0,0,0|1,0,2]=4 94 B10R1.13 CC(C)C=1CCC(=O)CC1 Amb22357000 [1,0,0,0,0,0|1,0,2]=4 95 B10R1.13 CC(C)C=1CCC(C)CC1 Amb22270224 [1,0,0,0,0,0|0,0,1]=2 96 B10R1.13 CC(C)C=1CCC(N)CC1 Amb25775928 [1,0,0,0,0,0|1,0,1]=3 97 B10R1.13 CC(C)[C@@H]1CC[C@@H](C)C=C1 Amb22352945 [1,0,0,0,0,0|0,0,3]=4 98 B10R1.13 CC(C)[C@@H]1CC[C@@H](C)CC1 Amb22231657 [1,0,0,0,0,0|0,0,3]=4 99 B10R1.13 CC(C)[C@@H]1CC[C@H](C)CC1 Amb22230417 [1,0,0,0,0,0|0,0,3]=4 100 B10R1.13 CC1CC=C(CC1)[N+]([O-])=O Amb24555667 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.13 CC1CC=C(CN1)C(O)=O Amb18831771 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.13 CC1CCC(=CC1)B(O)O Amb10071035 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.13 CC1CCC(=CC1)C(C)O Amb25369334 [1,0,0,0,0,0|1,0,1]=3 104 B10R1.13 CC1CCC(=CC1)C(O)=O Amb18124589 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.13 CC1CCC(=CO1)C(O)=O Amb24746802 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.13 CC1CCC(C=C1)C(C)=O Amb25146653 [1,0,0,0,0,0|1,0,2]=4 107 B10R1.13 CC1CCC(CC1)C(C)=C Amb25340292 [1,0,0,0,0,0|0,0,3]=4 108 B10R1.13 CC1CCC(CC1)C(C)=O Amb24518062 [1,0,0,0,0,0|1,0,2]=4 109 B10R1.13 CC1CCC(CC1)N(C)C Amb10553778 [1,0,0,0,0,0|1,0,2]=4 110 B10R1.13 CC1CCN(CC1)C(C)=S Amb24101091 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.13 CN1CCC(=CC1)C(=O)Cl Amb24099539 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.13 CN1CCC(=CC1)C(=O)O Amb17593569 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.13 CN1CCC(=CC1)C(N)=O Amb24099549 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.13 C[C@@H]1CCC(=CC1)C(O)=O Amb24349868 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.13 C[C@@H]1CC[C@@H](C=C1)C(C)=O Amb24512375 [1,0,0,0,0,0|1,0,2]=4 116 B10R1.13 C[C@@H]1CC[C@H](C=C1)C(C)=C Amb22232036 [1,0,0,0,0,0|0,0,3]=4 117 B10R1.13 C[C@@H]1CC[C@H](C=C1)C(C)=O Amb25319883 [1,0,0,0,0,0|1,0,2]=4 118 B10R1.13 C[C@@H]1CC[C@H](CC1)C(C)=O Amb25093628 [1,0,0,0,0,0|1,0,2]=4 119 B10R1.13 C[C@H]1CC[C@H](CC1)C(C)=O Amb24505101 [1,0,0,0,0,0|1,0,2]=4 120 B10R1.13 NC1CCC(=CC1)C(O)=O Amb24101018 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.13 O=C1CCC(=CC1)C(=O)C Amb17593496 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.13 OC1CCC(=CC1)C(=O)C Amb17593547 [1,0,0,0,0,0|2,0,0]=3 123 B10R1.25 CC1CC(=O)C(CC1)C=O Amb18643582 [1,0,0,0,0,0|1,0,1]=3 124 B10R1.25 CC1CC=C(CO)C(=O)C1 Amb25773383 [1,0,0,0,0,0|1,0,2]=4 125 B10R1.25 CC1CCC(=CN)C(=O)C1 Amb24571005 [1,0,0,0,0,0|1,0,0]=2 126 B10R1.25 CC1CCC(=CO)C(=O)S1 Amb25796275 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.25 CC1CCC(C=O)=C(Cl)C1 Amb18645128 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.25 CC1CCC(CC)C(=O)N1 Amb24619256 [1,0,0,0,0,0|1,0,2]=4 129 B10R1.25 CC1CC\C(=C/O)\C(=O)C1 Amb25853192 [1,0,0,0,0,0|1,0,0]=2 130 B10R1.25 CC1CC\C(=C\C)\C(O)C1 Amb24396535 [1,0,0,0,0,0|0,0,2]=3 131 B10R1.25 CC1CC\C(=C\O)\C(=O)C1 Amb24661725 [1,0,0,0,0,0|1,0,0]=2 132 B10R1.25 CC1CC\C(=C\O)\C(=O)O1 Amb24557390 [1,0,0,0,0,0|2,0,0]=3 133 B10R1.25 CC=1CC(O)CCC1C=O Amb24709147 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.25 CC=1CCC(=CO)C(=O)C1 Amb24575110 [1,0,0,0,0,0|1,0,2]=4 135 B10R1.25 CC=1CC\C(=C\O)\C(=O)C1 Amb25146755 [1,0,0,0,0,0|1,0,2]=4 136 B10R1.25 CCC1=CCC(C)CC1=O Amb24422368 [1,0,0,0,0,0|0,0,2]=3 137 B10R1.25 CN1CCN(CC)C(=O)C1 Amb24718147 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.25 COC1=COC(C)CC1=O Amb25145497 [1,0,0,0,0,0|2,0,1]=4 139 B10R1.25 C[C@H]1CC(=O)C(CC1)CO Amb25145522 [1,0,0,0,0,0|1,0,2]=4 140 B10R1.25 C[C@H]1CC\C(=C\C)\[C@H](O)C1 Amb25226272 [1,0,0,0,0,0|0,0,2]=3 141 B10R1.25 C\C=C/1\CC[C@@H](C)CC1=O Amb24408373 [1,0,0,0,0,0|0,0,0]=1 142 B10R1.25 C\C=C\1/CC[C@@H](C)CC1=O Amb25198006 [1,0,0,0,0,0|0,0,0]=1 143 B10R1.61 C=C1CCCCC1C(=O)C Amb17593515 [1,0,0,0,0,0|2,0,1]=4 144 B10R1.61 CC(=C)C1CCCCC1=O Amb25146856 [1,0,0,0,0,0|0,0,2]=3 145 B10R1.61 CC(=C)C1COCCC1=O Amb24466872 [1,0,0,0,0,0|1,0,2]=4 146 B10R1.61 CC(=O)C1CCCCC1=S Amb24363504 [1,0,0,0,0,0|1,1,1]=4 147 B10R1.61 CC(=O)C1CCCNC1=O Amb22491980 [1,0,0,0,0,0|2,0,1]=4 148 B10R1.61 CC(=O)C1CCCOC1=O Amb24631558 [1,0,0,0,0,0|2,0,1]=4 149 B10R1.61 CC(=O)C1CSCCC1=O Amb24079580 [1,0,0,0,0,0|2,0,1]=4 150 B10R1.61 CC(=O)C=1CCCCC1N Amb22893525 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.61 CC(=O)C=1COCCC1N Amb24564211 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.61 CC(=O)C=1OCCCC1Cl Amb25713702 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.61 CC(=O)N1CCCNC1=O Amb25147266 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.61 CC(=S)C1CCCCC1=O Amb25286669 [1,0,0,0,0,0|1,0,1]=3 155 B10R1.61 CC(C)=C1CCCCC1O Amb24734204 [1,0,0,0,0,0|0,0,2]=3 156 B10R1.61 CC(C)C1=CCCCC1=O Amb24466981 [1,0,0,0,0,0|0,0,2]=3 157 B10R1.61 CC(C)C1CCCCC1=C Amb25172838 [1,0,0,0,0,0|1,0,2]=4 158 B10R1.61 CC(C)C1CCCCC1=O Amb20241147 [1,0,0,0,0,0|0,0,2]=3 159 B10R1.61 CC(C)C1CNCCC1=O Amb18202676 [1,0,0,0,0,0|1,0,2]=4 160 B10R1.61 CC(C)N1CCNCC1=O Amb20671391 [1,0,0,0,0,0|2,0,1]=4 161 B10R1.61 CC(C)N1CCNCC1=O Amb22728333 [1,0,0,0,0,0|2,0,1]=4 162 B10R1.61 CC(Cl)C=1CCCCC1Cl Amb24711759 [1,0,0,0,0,0|2,0,1]=4 163 B10R1.61 CC(N)=C1CCCCC1=O Amb24515111 [1,0,0,0,0,0|1,0,0]=2 164 B10R1.61 CC(N)C1CCCCC1=O Amb25219283 [1,0,0,0,0,0|1,0,2]=4 165 B10R1.61 CC(O)C1CCCCC1=O Amb24646562 [1,0,0,0,0,0|1,0,2]=4 166 B10R1.61 CC(S)=C1CCCCC1=O Amb24548192 [1,0,0,0,0,0|1,0,0]=2 167 B10R1.61 CC=1CCCCC1C(C)=O Amb25288428 [1,0,0,0,0,0|2,0,0]=3 168 B10R1.61 CC=1CCCCC1C(C)C Amb24398303 [1,0,0,0,0,0|1,0,1]=3 169 B10R1.61 CC=1CCCCC1C(N)=O Amb24427374 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.61 CC=1CCCCC1C(O)=O Amb18643592 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.61 CC=1CCOCC1C(C)=O Amb25713007 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.61 CN(C)C1=CCCCC1=O Amb25044343 [1,0,0,0,0,0|1,0,1]=3 173 B10R1.61 CN(C)N1CCCCC1=N Amb24420982 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.61 C[C@@H](O)C1=CCCCC1=O Amb25831515 [1,0,0,0,0,0|1,0,2]=4 175 B10R1.61 C[C@@H](O)[C@H]1CCCCC1=O Amb25236946 [1,0,0,0,0,0|1,0,2]=4 176 B10R1.61 C[C@H](O)[C@@H]1CCCCC1=O Amb24575614 [1,0,0,0,0,0|1,0,2]=4 177 B10R1.61 C[C@H](O)[C@H]1CCCCC1=O Amb24620153 [1,0,0,0,0,0|1,0,2]=4 178 B10R1.61 C[S+](C)C1[CH-]CCCC1=O Amb25146741 [1,0,0,0,0,0|1,0,2]=4 179 B10R1.61 C\C(\Cl)=C/1\CCCCC1=O Amb25086315 [1,0,0,0,0,0|1,0,0]=2 180 B10R1.61 C\C(\Cl)=C\1/CCCCC1=O Amb25707018 [1,0,0,0,0,0|1,0,0]=2 181 B10R1.61 C\C(\N)=C\1/CCCCC1=O Amb25133698 [1,0,0,0,0,0|1,0,0]=2 182 B10R1.61 ClC1=C(CCCC1)C(=O)O Amb1157859 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.61 NC(=O)N1CCCCC1=O Amb24333726 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.61 NC=1CCCCC1C(O)=O Amb22228577 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.61 O=C/1CCCC\C1=C(/F)\Cl Amb25859627 [1,0,0,0,0,0|2,0,0]=3 186 B10R1.61 O=C1CCCC=C1C(=O)C Amb17593495 [1,0,0,0,0,0|1,0,1]=3 187 B10R1.61 O=C1CCCCC1=C(F)Cl Amb25319936 [1,0,0,0,0,0|2,0,0]=3 188 B10R1.61 O=C1CCCCC1C(=O)O Amb16230759 [1,0,0,0,0,0|2,0,1]=4 189 B10R1.61 O=C1CCCCC1C(=O)[Na] Amb25066428 [1,0,0,0,0,0|2,0,1]=4 190 B10R1.61 O=C1CCCCC1C(S)=S Amb24753160 [1,0,0,0,0,0|2,0,1]=4 191 B10R1.61 O=C1CCCCN1C(=O)Cl Amb25821917 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.61 OC(=O)C=1CCCCC1Br Amb18130945 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.57 CC(C)=C1CC[C@H](C)CC1=NO Amb25322397 [0,1,0,0,0,0|0,0,1]=2 194 B12R1.57 CC(C)C/1=CCC(C)C\C1=N\O Amb25723773 [0,1,0,0,0,0|0,0,3]=4 195 B12R1.57 CC(C)C1CCC(C)CC1=NN Amb25741968 [0,1,0,0,0,0|1,0,2]=4 196 B12R1.57 CC(C)C1CCC(C)CC1=NO Amb24660809 [0,1,0,0,0,0|0,0,3]=4 197 B12R1.57 CC(C)C=1CCC(C)CC1CO Amb24748472 [0,1,0,0,0,0|0,0,2]=3 198 B12R1.57 CC(C)[C@@H]/1CC[C@@H](C)C\C1=N/N Amb23560179 [0,1,0,0,0,0|1,0,2]=4 199 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C=O Amb24513203 [0,1,0,0,0,0|0,0,3]=4 200 B12R1.57 CC(C)[C@H]1CC[C@H](C)CC1=NN Amb25322522 [0,1,0,0,0,0|1,0,2]=4 201 B12R1.57 CC(C)[C@H]1CC[C@H](C)CC1=NO Amb25257365 [0,1,0,0,0,0|0,0,3]=4 202 B12R1.57 CC(C)[C@H]1CC[C@H](C)C[C@H]1C=O Amb25326691 [0,1,0,0,0,0|0,0,3]=4 203 B12R1.57 CC1CCC(C(C1)C=O)C(C)=C Amb24382859 [0,1,0,0,0,0|0,0,3]=4 204 B12R1.126 CC(C)(C)N1CCC(N)CC1=O Amb24449974 [0,1,0,0,0,0|2,0,1]=4 205 B12R1.126 CC(C)(O)C1=CCC(C)CC1=O Amb25730151 [0,1,0,0,0,0|0,0,2]=3 206 B12R1.126 CC1CCC(C(=O)C1)C(C)(C)O Amb24662393 [0,1,0,0,0,0|0,0,2]=3 207 B12R1.126 C[C@@H]1CCC(C(=O)C1)C(C)(C)C Amb25059617 [0,1,0,0,0,0|0,0,2]=3 208 B12R1.126 C[C@@H]1CCC(C(=O)C1)C(C)(C)O Amb25035012 [0,1,0,0,0,0|0,0,2]=3 209 B12R1.126 C[C@@H]1CC[C@@H](C(=O)C1)C(C)(C)S Amb24758182 [0,1,0,0,0,0|0,0,2]=3 210 B12R1.126 C[C@@H]1CC[C@H](C(=O)C1)C(C)(C)S Amb25823693 [0,1,0,0,0,0|0,0,2]=3 211 B12R1.126 C[C@H]1CC[C@@H](C(=O)C1)C(C)(C)O Amb24551553 [0,1,0,0,0,0|0,0,2]=3 212 B12R1.126 C[C@H]1CC[C@@H](C(=O)C1)C(C)(C)S Amb25308539 [0,1,0,0,0,0|0,0,2]=3 213 B12R1.126 C[C@H]1CC[C@H](C(=O)C1)C(C)(C)C Amb25298344 [0,1,0,0,0,0|0,0,2]=3 214 B12R1.232 CC(C)=C1NC(=O)[C@H](C)NC1=O Amb24448637 [0,1,0,0,0,0|2,0,1]=4 215 B12R1.232 CC(C)C1=CC(O)C(C)CC1=O Amb25689528 [0,1,0,0,0,0|0,0,2]=3 216 B12R1.452 CC(=O)C1CCC(CC1=O)CC Amb25143546 [0,1,0,0,0,0|1,0,1]=3 217 B12R1.452 CC(C)=C1CCC(CC)=CC1=O Amb25735088 [0,1,0,0,0,0|0,0,2]=3 218 B12R1.452 CC(C)C1CCC(CC1=O)CO Amb24590971 [0,1,0,0,0,0|0,0,2]=3 219 B12R1.452 CC=1CC(CCC1C(C)=O)C#N Amb24690605 [0,1,0,0,0,0|2,0,1]=4 220 B12R1.829 CC(=C)C1COC(C)(C)CC1=O Amb25273073 [0,1,0,0,0,0|1,0,2]=4 221 B12R1.829 CC(=C)[C@@H]1CCC(C)(C)CC1=O Amb25729053 [0,1,0,0,0,0|0,0,2]=3 222 B12R1.829 CC(=O)C1=CCC(C)(C)CC1=O Amb24532699 [0,1,0,0,0,0|1,0,1]=3 223 B12R1.829 CC(=O)C1CCC(C)(C)OC1=O Amb25712964 [0,1,0,0,0,0|2,0,1]=4 224 B12R1.829 CC(=O)C1COC(C)(C)CC1=O Amb24722892 [0,1,0,0,0,0|2,0,1]=4 225 B12R1.829 CC(C)=C1CCC(C)(O)CC1=O Amb25821423 [0,1,0,0,0,0|0,0,0]=1 226 B12R1.829 CC(C)=C1CCC(C)(O)CC1O Amb25795597 [0,1,0,0,0,0|0,0,2]=3 227 B12R1.829 CC(C)=C1CC[C@](C)(O)CC1O Amb25788957 [0,1,0,0,0,0|0,0,2]=3 228 B12R1.829 CC(C)=C1CC[C@](C)(O)C[C@@H]1O Amb25175485 [0,1,0,0,0,0|0,0,2]=3 229 B12R1.829 CC(C)C1CC[C@](C)(O)CC1=O Amb24532706 [0,1,0,0,0,0|0,0,2]=3 230 B12R1.829 CC(C)[C@@H]1CC[C@@](C)(O)CC1=O Amb24512566 [0,1,0,0,0,0|0,0,2]=3 231 B12R1.829 CC(C)[C@@H]1CC[C@](C)(O)CC1=O Amb24620048 [0,1,0,0,0,0|0,0,2]=3 232 B12R1.829 CC(C)[C@H]1CCC(C)(O)CC1=O Amb24434598 [0,1,0,0,0,0|0,0,2]=3 233 B12R1.829 CC(N)=C1CCC(C)(C)CC1=O Amb25257392 [0,1,0,0,0,0|1,0,0]=2 234 B12R1.829 CC1(C)CC(=O)C(=CO1)C(C)C Amb24408419 [0,1,0,0,0,0|1,0,2]=4 235 B12R1.829 CC1=C(CCC(C1)(C)C)C(=O)O Amb16204826 [0,1,0,0,0,0|3,0,0]=4 236 B12R1.829 CC=1CC(C)(C)CCC1C(C)=O Amb24722758 [0,1,0,0,0,0|2,0,0]=3 237 B12R1.829 CC=1CC(C)(O)CCC1C(O)=O Amb18647355 [0,1,0,0,0,0|3,0,0]=4 238 B12R1.829 C\C(\N)=C\1/C=CC(C)(C)CC1=O Amb25113497 [0,1,0,0,0,0|1,0,2]=4 239 B12R1.829 C\C(\N)=C\1/CCC(C)(C)CC1=O Amb25087795 [0,1,0,0,0,0|1,0,0]=2 240 B12R1.893 CC(C)=C1CCC(C)C(Br)C1=O Amb24403293 [0,1,0,0,0,0|0,0,0]=1 241 B12R1.893 CC(C)=C1CCC(C)C(O)C1O Amb25680494 [0,1,0,0,0,0|0,0,2]=3 242 B12R1.893 CC(C)=C1CCC(O)=C(C)C1=O Amb25730144 [0,1,0,0,0,0|1,0,2]=4 243 B12R1.893 CC(C)=C1CC[C@@H](C)[C@H](C)C1=O Amb25366390 [0,1,0,0,0,0|0,0,0]=1 244 B12R1.893 CC(C)C1CCC(C)C(=C)C1=O Amb17777878 [0,1,0,0,0,0|0,0,3]=4 245 B12R1.893 CC(C)C1CCC(C)C(C)C1=O Amb25128287 [0,1,0,0,0,0|0,0,2]=3 246 B12R1.893 CC(C)C1CCC(C)C(O)C1=O Amb25773382 [0,1,0,0,0,0|0,0,2]=3 247 B12R1.893 CC(C)C1CC[C@@H](C)C(=C)C1=O Amb25706959 [0,1,0,0,0,0|0,0,3]=4 248 B12R1.893 CC(C)C1CC[C@@H](C)C(C)C1=O Amb24614256 [0,1,0,0,0,0|0,0,2]=3 249 B12R1.893 CC(C)C=1CC[C@@H](C)C(=O)C1O Amb25092925 [0,1,0,0,0,0|0,0,3]=4 250 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)C(=C)C1=O Amb24721639 [0,1,0,0,0,0|0,0,3]=4 251 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@H](C)C1=O Amb24573422 [0,1,0,0,0,0|0,0,2]=3 252 B12R1.893 CC(C)[C@@H]1CC[C@@H](C)[C@H](Cl)C1=O Amb24565741 [0,1,0,0,0,0|0,0,2]=3 253 B12R1.893 CC(C)[C@H]1CC[C@@H](C)[C@H](O)C1=O Amb25205411 [0,1,0,0,0,0|0,0,2]=3 254 B12R1.893 CC(C)[C@H]1CC[C@H](C)[C@H](O)C1=O Amb25179458 [0,1,0,0,0,0|0,0,2]=3 255 B12R1.893 CC1CCC(=C(C)C)C(=O)C1O Amb17594213 [0,1,0,0,0,0|0,0,0]=1 256 B12R1.893 O=C1C(C)CCC(=C1O)C(=C)C Amb17594131 [0,1,0,0,0,0|0,0,3]=4 257 B12R1.911 CC(=C)C1(O)CCC(C)CC1=O Amb25094332 [0,1,0,0,0,0|0,0,2]=3 258 B12R1.911 CC(=C)[C@]1(C)CCC(C)CC1=O Amb24471192 [0,1,0,0,0,0|0,0,2]=3 259 B12R1.911 CC(=O)C1(C)CCC(C)CC1=O Amb25828415 [0,1,0,0,0,0|1,0,1]=3 260 B12R1.911 CC(=O)[C@@]1(C)CC[C@@H](C)CC1=O Amb24626563 [0,1,0,0,0,0|1,0,1]=3 261 B12R1.911 CC(=O)[C@]1(C)CC[C@@H](C)CC1=O Amb24626566 [0,1,0,0,0,0|1,0,1]=3 262 B12R1.911 CC(C)[C@@]1(O)CC[C@@H](C)CC1=O Amb24575951 [0,1,0,0,0,0|0,0,2]=3 263 B12R1.911 CC(C)[C@]1(C)CCC(C)CC1=O Amb24730298 [0,1,0,0,0,0|0,0,2]=3 264 B12R1.911 CC(C)[C@]1(O)CC[C@@H](C)CC1=O Amb25245376 [0,1,0,0,0,0|0,0,2]=3 265 B12R1.1000 CC(=O)C1C(=O)CC(C)CC1=O Amb25149818 [0,1,0,0,0,0|1,0,2]=4 266 B12R1.1000 CC(=O)C1C(C)CC(C)CC1=O Amb25075546 [0,1,0,0,0,0|1,0,1]=3 267 B12R1.1000 CC(=O)C1C(C)CC(C)OC1=O Amb24752499 [0,1,0,0,0,0|2,0,1]=4 268 B12R1.1000 CC(=O)C1C(O)CC(C)NC1=O Amb25714442 [0,1,0,0,0,0|2,0,1]=4 269 B12R1.1000 CC(=O)C=1C(=O)CC(O)CC1O Amb25034798 [0,1,0,0,0,0|2,0,1]=4 270 B12R1.1000 CC(=O)C=1C(=O)OC(C)CC1C Amb25695325 [0,1,0,0,0,0|2,0,1]=4 271 B12R1.1000 CC(=O)C=1C(=O)OC(C)CC1O Amb24653773 [0,1,0,0,0,0|2,0,1]=4 272 B12R1.1000 CC(=O)C=1C(C)OC(C)CC1N Amb25101637 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.1000 CC(C)=C1C(O)C[C@@H](C)CC1=O Amb25298573 [0,1,0,0,0,0|0,0,0]=1 274 B12R1.1000 CC(C)=C1[C@H](O)C[C@@H](C)CC1=O Amb24736283 [0,1,0,0,0,0|0,0,0]=1 275 B12R1.1000 CC(C)C1=C(O)CC(C)CC1=O Amb25774414 [0,1,0,0,0,0|0,0,2]=3 276 B12R1.1000 CC(C)C1C(C)CC(C)CC1=O Amb25838804 [0,1,0,0,0,0|0,0,2]=3 277 B12R1.1000 CC(C)C1C(O)CC(C)CC1=S Amb25815980 [0,1,0,0,0,0|0,1,2]=4 278 B12R1.1000 CC(C)C1[C@H](C)C[C@@H](C)CC1=O Amb24722991 [0,1,0,0,0,0|0,0,2]=3 279 B12R1.1000 CC(C)C=1C(O)CC(C)CC1O Amb24562249 [0,1,0,0,0,0|0,0,2]=3 280 B12R1.1000 CC(C)[C@H]1C(=O)C[C@@H](C)CN1C Amb24398208 [0,1,0,0,0,0|1,0,2]=4 281 B12R1.1000 CC(O)=C1C(=O)CC(C)OC1=O Amb24558331 [0,1,0,0,0,0|2,0,1]=4 282 B12R1.1000 CC1CN(C)C(C(=O)C1)C(C)C Amb2369979 [0,1,0,0,0,0|1,0,2]=4 283 B12R1.1000 C\C(\N)=C/1\C(=O)CC(C)OC1=O Amb24653836 [0,1,0,0,0,0|2,0,1]=4 284 B12R1.1000 C\C(\O)=C/1\C(=O)CC(C)OC1=O Amb24537743 [0,1,0,0,0,0|2,0,1]=4 285 B12R1.1000 C\C(\O)=C\1/C(=O)CC(C)OC1=O Amb25087827 [0,1,0,0,0,0|2,0,1]=4 286 B12R1.1703 CC(=C=C)C1CCC(C)CC1=O Amb25838800 [0,1,0,0,0,0|0,0,2]=3 287 B12R1.1703 CC(C=O)=C1CCC(C)CC1=O Amb24706891 [0,1,0,0,0,0|0,0,1]=2 288 B12R1.1703 CC(CCl)=C1CCC(C)CC1=O Amb25274974 [0,1,0,0,0,0|0,0,0]=1 289 B12R1.1703 CC1CCC(C(=O)N1)C(=O)OC Amb23557004 [0,1,0,0,0,0|2,0,1]=4 290 B12R1.1703 COC(=O)C1CCN(C)CC1=O Amb18198644 [0,1,0,0,0,0|2,0,1]=4 291 B12R1.1703 COC(=O)C=1CCC(C)CC1N Amb24713459 [0,1,0,0,0,0|2,0,0]=3 292 B12R1.1703 COC(=O)C=1CC[C@@H](C)CC1N Amb25784587 [0,1,0,0,0,0|2,0,0]=3 293 B12R1.1703 COC(=O)C=1CC[C@H](C)CC1N Amb24392257 [0,1,0,0,0,0|2,0,0]=3 294 B12R1.1703 C[C@H]1CCC(C(C)CO)C(=O)C1 Amb25094298 [0,1,0,0,0,0|0,0,2]=3 295 B10R0.3 C=C\C=C(\CCC=C(C)C)/C Amb15693445 [0,0,1,0,0,0|1,0,2]=4 296 B10R0.3 CC(C)=CCC=C(C)CC=O Amb25384259 [0,0,1,0,0,0|0,0,2]=3 297 B10R0.3 CC(C)=CCSC(C)=CC=O Amb25385663 [0,0,1,0,0,0|1,0,2]=4 298 B10R0.3 CC(C)=CCS\C(\C)=C\C=O Amb25385809 [0,0,1,0,0,0|1,0,2]=4 299 B10R0.3 CC(C)=CC\C=C(/C)\CC=O Amb25384468 [0,0,1,0,0,0|0,0,2]=3 300 B10R0.3 CC(C)=CC\C=C(\C)/CC=O Amb25384808 [0,0,1,0,0,0|0,0,2]=3 301 B10R0.3 CC(CC#N)NCC=C(C)C Amb24755695 [0,0,1,0,0,0|2,0,1]=4 302 B10R0.3 CC(CC=O)\C=C\C=C(C)C Amb25383574 [0,0,1,0,0,0|0,0,2]=3 303 B10R0.3 CC(CCC=C(C)Cl)=CC=O Amb25385938 [0,0,1,0,0,0|1,0,2]=4 304 B10R0.3 C\C(\CC\C=C(\C)/Cl)=C/C=O Amb25384673 [0,0,1,0,0,0|1,0,2]=4 305 B10R0.3 OCC[C@H](CCC=C(C)C)C Amb17611216 [0,0,1,0,0,0|0,0,2]=3 306 B10R0.13 CC(=O)C(=O)C(=O)OC(C)C Amb24766827 [0,0,1,0,0,0|3,0,0]=4 307 B10R0.13 CC(=O)C(C)C(=O)CC(C)C Amb24765289 [0,0,1,0,0,0|1,0,1]=3 308 B10R0.13 CC(C(=O)C=C(C)C)=C(C)C Amb24736421 [0,0,1,0,0,0|0,0,2]=3 309 B10R0.13 CC(C)=C(C)C(=O)NC(C)C Amb25187622 [0,0,1,0,0,0|1,0,0]=2 310 B10R0.13 CC(C)=C(C)C(=O)OC(C)C Amb24660900 [0,0,1,0,0,0|1,0,0]=2 311 B10R0.13 CC(C)=CC(=O)C(Cl)=C(C)C Amb25094310 [0,0,1,0,0,0|1,0,2]=4 312 B10R0.13 CC(C)C(Cl)C(=O)CC(C)C Amb25383186 [0,0,1,0,0,0|1,0,2]=4 313 B10R0.13 CC(C)C(F)C(=O)CC(C)C Amb25383177 [0,0,1,0,0,0|1,0,2]=4 314 B10R0.13 CC(C)CS(=O)C(C)C(C)=O Amb25382256 [0,0,1,0,0,0|2,0,1]=4 315 B10R0.13 CC(C)N(C)C(=O)CC(C)N Amb18289182 [0,0,1,0,0,0|2,0,1]=4 316 B10R0.13 CC(C)N(C)C(=O)NC(C)C Amb24488234 [0,0,1,0,0,0|2,0,1]=4 317 B10R0.13 CC(C)NC(=O)C(C)N(C)C Amb25808498 [0,0,1,0,0,0|2,0,1]=4 318 B10R0.13 CC(C)NC(=O)[C@H](C)N(C)C Amb24673569 [0,0,1,0,0,0|2,0,1]=4 319 B10R0.13 CC(C)OC(=O)C(=O)N(C)C Amb24095771 [0,0,1,0,0,0|3,0,0]=4 320 B10R0.13 CC(CC(=O)C(C(C)C)C)C Amb17593925 [0,0,1,0,0,0|0,0,2]=3 321 B10R0.13 C\C(=C(\O)/CC(C)C)\C(C)=O Amb25128239 [0,0,1,0,0,0|1,0,1]=3 322 B10R0.17 CC(=O)\C(=N\OCC)\C(C)C Amb24766933 [0,0,1,0,0,0|2,0,1]=4 323 B10R0.17 CC(=O)\C(\CCC=C)=C(/C)\O Amb24766835 [0,0,1,0,0,0|1,0,2]=4 324 B10R0.17 CC(=O)\C(\CCC=O)=C(/C)\O Amb25384549 [0,0,1,0,0,0|2,0,1]=4 325 B10R0.17 CC(C)=C(CCC=O)C(C)=C Amb24765094 [0,0,1,0,0,0|2,0,1]=4 326 B10R0.17 CC(N)=C(CCOC)C(O)=O Amb25382124 [0,0,1,0,0,0|3,0,0]=4 327 B10R0.17 CCCC=C(C(C)=O)C(C)=O Amb24766988 [0,0,1,0,0,0|1,0,1]=3 328 B10R0.17 CCCCC(C(=O)C)C(=O)C Amb1152354 [0,0,1,0,0,0|1,0,1]=3 329 B10R0.17 CCCCC(C(N)=O)N(C)C Amb24116643 [0,0,1,0,0,0|2,0,1]=4 330 B10R0.17 CCCCC(C(O)=O)=C(F)F Amb25384934 [0,0,1,0,0,0|3,0,0]=4 331 B10R0.17 CCCCC(C(O)=O)N(C)C Amb18787861 [0,0,1,0,0,0|2,0,1]=4 332 B10R0.17 CCCC\C(\C(C)=O)=C(/C)\Cl Amb24766915 [0,0,1,0,0,0|1,0,0]=2 333 B10R0.17 CCC\C=C(/C(N)=O)\N(C)C Amb25385256 [0,0,1,0,0,0|2,0,1]=4 334 B10R0.17 CCC\C=C(\C(C)C)/C(N)=O Amb24766272 [0,0,1,0,0,0|1,0,2]=4 335 B10R0.17 CCNC=C(C(=O)C)C(=O)C Amb2386496 [0,0,1,0,0,0|2,0,1]=4 336 B10R0.17 CCSC=C(C(C)=O)C(C)=O Amb24766966 [0,0,1,0,0,0|2,0,1]=4 337 B10R0.44 CC(=O)CC(=O)N[C@@H](C)CC Amb25385720 [0,0,1,0,0,0|2,0,1]=4 338 B10R0.44 CC(=O)CC(=O)N[C@H](C)CC Amb25385719 [0,0,1,0,0,0|2,0,1]=4 339 B10R0.44 CC(C)=CC(=O)CC(=C)CC Amb25380188 [0,0,1,0,0,0|0,0,2]=3 340 B10R0.44 CC(C)=CC(=O)CC(=O)OC Amb24766927 [0,0,1,0,0,0|2,0,1]=4 341 B10R0.44 CC(C)=CC(=O)CC(N)CC Amb24766182 [0,0,1,0,0,0|1,0,0]=2 342 B10R0.44 CC(C)=CC(=O)C[C@@H](C)C=C Amb24766821 [0,0,1,0,0,0|0,0,2]=3 343 B10R0.44 CC(C)=CC(=O)C\C(\C)=C\C Amb25114866 [0,0,1,0,0,0|0,0,2]=3 344 B10R0.44 CC(C)=CC(=O)NC(C)C#N Amb24671572 [0,0,1,0,0,0|2,0,1]=4 345 B10R0.44 CC(C)=CC(=O)NC(C)C=C Amb24501871 [0,0,1,0,0,0|1,0,2]=4 346 B10R0.44 CC(C)=CC(=O)NC(C)CC Amb25150734 [0,0,1,0,0,0|1,0,0]=2 347 B10R0.44 CC(C)=CC(=O)NC(C)CF Amb25220306 [0,0,1,0,0,0|2,0,0]=3 348 B10R0.44 CC(C)=CC(=O)NC(C)CN Amb18251496 [0,0,1,0,0,0|2,0,0]=3 349 B10R0.44 CC(C)=CC(=O)OC(C)C#C Amb24466016 [0,0,1,0,0,0|1,0,2]=4 350 B10R0.44 CC(C)=CC(=O)OC(C)CO Amb24756228 [0,0,1,0,0,0|2,0,0]=3 351 B10R0.44 CC(C)=CC(=O)SC(C)CC Amb24755470 [0,0,1,0,0,0|1,0,0]=2 352 B10R0.44 CC(C)=CC(=O)\C=C(/C)\CC Amb24632250 [0,0,1,0,0,0|0,0,2]=3 353 B10R0.44 CC(C)=CC(=O)\C=C(\C)/CC Amb25714308 [0,0,1,0,0,0|0,0,2]=3 354 B10R0.44 CC(C)=CC(=S)NC(C)CC Amb25068981 [0,0,1,0,0,0|1,1,0]=3 355 B10R0.44 CC(C)NC(=O)CC(C)OC Amb25382794 [0,0,1,0,0,0|2,0,1]=4 356 B10R0.44 CC(C)NC(=O)SC(C)CC Amb24765059 [0,0,1,0,0,0|2,0,1]=4 357 B10R0.44 CC(CC(N)C=C(C)C)CC Amb24750539 [0,0,1,0,0,0|1,0,1]=3 358 B10R0.44 CC(CC(N)C=C(C)C)OC Amb24766121 [0,0,1,0,0,0|2,0,1]=4 359 B10R0.44 CC(CC(O)C=C(C)C)CC Amb24754874 [0,0,1,0,0,0|0,0,2]=3 360 B10R0.44 CCC(C)CC(=O)NC(N)=O Amb24488024 [0,0,1,0,0,0|3,0,0]=4 361 B10R0.44 CCC(C)C\C(\C)=C\C(C)=O Amb24766977 [0,0,1,0,0,0|2,0,0]=3 362 B10R0.44 CCC(C)NC(=O)CN(C)C Amb19978889 [0,0,1,0,0,0|2,0,1]=4 363 B10R0.44 CCC(N)CC(C)=CN(C)C Amb25384172 [0,0,1,0,0,0|3,0,0]=4 364 B10R0.44 CCC(OC(=O)C=C(C)C)C Amb16192098 [0,0,1,0,0,0|1,0,0]=2 365 B10R0.44 CCC(OC(=O)CC(=O)C)C Amb17593953 [0,0,1,0,0,0|2,0,1]=4 366 B10R0.44 CCN(C)CC(=O)NC(C)C Amb24750975 [0,0,1,0,0,0|2,0,1]=4 367 B10R0.44 C\C(=C/C(C)=O)\NC(C)CC Amb25065994 [0,0,1,0,0,0|3,0,0]=4 368 B10R0.44 C\C(\Cl)=C\C(=O)NC(C)CC Amb25289275 [0,0,1,0,0,0|2,0,0]=3 369 B10R0.84 CC(=O)\C(\CCC(C)C)=N\O Amb24766934 [0,0,1,0,0,0|2,0,1]=4 370 B10R0.84 CC(C)=C(C=O)SCC(C)C Amb25385884 [0,0,1,0,0,0|1,0,0]=2 371 B10R0.84 CC(C)=C(CC=C(C)C)C=O Amb18125471 [0,0,1,0,0,0|0,0,2]=3 372 B10R0.84 CC(C)=C(CCC(C)=O)C=C Amb24766889 [0,0,1,0,0,0|2,0,1]=4 373 B10R0.84 CC(C)=CC\C(\C=O)=C(\C)/O Amb25835602 [0,0,1,0,0,0|1,0,2]=4 374 B10R0.84 CC(C)C\C=C(/C=O)\C(C)C Amb18644689 [0,0,1,0,0,0|0,0,2]=3 375 B10R0.84 C\C=C(/CCC(C)C)\C(O)=O Amb25381500 [0,0,1,0,0,0|3,0,0]=4 376 B10R0.84 O=C\C(=C\CC(C)C)\C(C)C Amb10844751 [0,0,1,0,0,0|0,0,2]=3 377 B10R0.101 CC(=O)C(=CC)C(=O)OCC Amb25384077 [0,0,1,0,0,0|2,0,1]=4 378 B10R0.101 CC(=O)\C(=C/C)\C(=O)OCC Amb24758010 [0,0,1,0,0,0|2,0,1]=4 379 B10R0.101 CC(C)=C(C=O)C(=O)OCC Amb25383586 [0,0,1,0,0,0|2,0,1]=4 380 B10R0.101 CC(C)=C(N=C)C(=O)OCC Amb25384076 [0,0,1,0,0,0|2,0,1]=4 381 B10R0.101 CC(C)C(CC)C(=O)NCC Amb25384469 [0,0,1,0,0,0|1,0,2]=4 382 B10R0.101 CC(C)C(CC)C(=O)OCC Amb22499030 [0,0,1,0,0,0|1,0,2]=4 383 B10R0.101 CC(CCC)=C(CC)C(N)=N Amb25384210 [0,0,1,0,0,0|3,0,0]=4 384 B10R0.101 CCCC(=O)\C(=N\O)\C(C)C Amb24764952 [0,0,1,0,0,0|2,0,1]=4 385 B10R0.101 CCOC(=O)\C(=C/C)\C(=O)C Amb17593897 [0,0,1,0,0,0|2,0,1]=4 386 B10R0.101 C\C(\CCC)=C(\CC)/C(N)=N Amb24764582 [0,0,1,0,0,0|3,0,0]=4 387 B10R0.101 C\C(\CCC)=C(\CC)/C(O)=O Amb25381499 [0,0,1,0,0,0|3,0,0]=4 388 B12R2.610 CC1CCC2C(=O)C1C2(C)C Amb24486302 [0,0,0,1,0,0|0,0,2]=3 389 B12R2.612 CC1CC=2CCC(=O)C2CC1 Amb25347588 [0,0,0,1,0,0|2,0,0]=3 390 B12R2.612 CN1CC=2CCC(=O)C2CC1 Amb24084740 [0,0,0,1,0,0|3,0,0]=4 391 B12R2.612 Cc1[nH][n]c2CC(O)CCc21 Amb18201326 [0,0,0,1,0,0|3,0,0]=4 392 B12R2.612 Cc1[n][nH]c2CC(N)CCc21 Amb18201620 [0,0,0,1,0,0|3,0,0]=4 393 B12R2.612 Cc1[n][n]c2CC(C)CC[n]12 Amb25845973 [0,0,0,1,0,0|3,0,0]=4 394 B12R2.612 Cc1[n]oc2CC(N)CCc21 Amb18201378 [0,0,0,1,0,0|2,0,1]=4 395 B12R2.612 Cc1coc2C[C@@H](C)CCc12 Amb22350509 [0,0,0,1,0,0|0,0,2]=3 396 B12R2.612 Cc1o[n]c2CC(C)NCc12 Amb18201317 [0,0,0,1,0,0|3,0,0]=4 397 B12R2.612 Cc1occ2C[C@H](O)CCc21 Amb25333684 [0,0,0,1,0,0|3,0,0]=4 398 B12R2.766 C[C@H]1CC(=O)[C@@H]2C[C@H]1C2(C)C Amb24584476 [0,0,0,1,0,0|0,0,2]=3 399 B12R2.774 CC(C)C12CC1C(C)CC2=O Amb25735193 [0,0,0,1,0,0|0,0,2]=3 400 B12R2.774 CC(C)C12CC1[C@@H](C)CC2=O Amb25830033 [0,0,0,1,0,0|0,0,2]=3 401 B12R2.781 C[C@@H]1CC2C(C(=O)C1)C2(C)C Amb25188733 [0,0,0,1,0,0|0,0,2]=3 402 B12R2.998 CC1(C)CC2CC(=O)N1CC2 Amb24526879 [0,0,0,1,0,0|1,0,1]=3 403 B12R2.1169 CC(C)C12CCC(C)C1C2=O Amb24066250 [0,0,0,1,0,0|0,0,2]=3 404 B12R2.1212 CC1CC(=O)C2(CC1)CC2=C Amb24736346 [0,0,0,1,0,0|0,0,2]=3 405 B12R2.2315 CC1CCC2CC(=O)C1CC2 Amb25094408 [0,0,0,1,0,0|0,0,2]=3 406 B12R2.2427 O=C1CC2CC1(CC2)C(=O)Cl Amb24486255 [0,0,0,1,0,0|2,0,1]=4 407 B12R2.2427 OC(=O)C12CC(CC1=O)CC2 Amb18125690 [0,0,0,1,0,0|2,0,1]=4 408 B12R2.2764 CC12CC(=O)C(CC1)C(=O)N2 Amb24538236 [0,0,0,1,0,0|2,0,1]=4 409 B12R2.2764 C[C@]12CC(=O)[C@H](CC1)[C@H](O)C2 Amb24760825 [0,0,0,1,0,0|1,0,2]=4 410 B12R2.2825 CC1(C)[C@@H]2CC[C@@]1(C)CC2=O Amb25179517 [0,0,0,1,0,0|0,0,2]=3 411 B12R2.2825 CC1(C)[C@H]2CC[C@@]1(C)CC2=O Amb25179715 [0,0,0,1,0,0|0,0,2]=3 412 B12R2.2825 CC1(C)[C@H]2CC[C@]1(C)CC2=O Amb24588867 [0,0,0,1,0,0|0,0,2]=3 413 B10R1.59 CC(=C)C1=CC(O)CC1=O Amb24456550 [0,0,0,0,1,0|1,0,2]=4 414 B10R1.59 CC(=O)C1CC(C)CC1=O Amb25146505 [0,0,0,0,1,0|1,0,1]=3 415 B10R1.59 CC(=O)C1C[C@@H](C)OC1=O Amb25145581 [0,0,0,0,1,0|2,0,1]=4 416 B10R1.59 CC(=O)C1C[C@H](C)OC1=O Amb24378363 [0,0,0,0,1,0|2,0,1]=4 417 B10R1.59 CC(=O)C1SC(C)CC1=O Amb25146707 [0,0,0,0,1,0|2,0,1]=4 418 B10R1.59 CC(=O)N1CC(O)CC1=O Amb25725756 [0,0,0,0,1,0|3,0,0]=4 419 B10R1.59 CC(=O)N1CC(S)CC1=O Amb24476973 [0,0,0,0,1,0|3,0,0]=4 420 B10R1.59 CC(=O)N1C[C@@H](S)CC1=O Amb24502320 [0,0,0,0,1,0|3,0,0]=4 421 B10R1.59 CC(=O)N1C[C@H](S)CC1=O Amb25829426 [0,0,0,0,1,0|3,0,0]=4 422 B10R1.59 CC(C)=C1CC(=O)OC1=O Amb24273356 [0,0,0,0,1,0|2,0,1]=4 423 B10R1.59 CC(C)C1=CC(Br)CC1=O Amb25216210 [0,0,0,0,1,0|1,0,2]=4 424 B10R1.59 CC(C)C1=CC(C)CC1=O Amb25373338 [0,0,0,0,1,0|0,0,2]=3 425 B10R1.59 CC(C)C1=C[C@@H](O)CC1=O Amb25346846 [0,0,0,0,1,0|1,0,2]=4 426 B10R1.59 CC(C)C1=C[C@H](O)CC1=O Amb24534627 [0,0,0,0,1,0|1,0,2]=4 427 B10R1.59 CC(C)C1CC(C)CC1=O Amb25146591 [0,0,0,0,1,0|0,0,2]=3 428 B10R1.59 CC(C)C1CN(C)CC1=O Amb25146880 [0,0,0,0,1,0|1,0,2]=4 429 B10R1.59 CC(C)C1OC(C)CC1=O Amb25768432 [0,0,0,0,1,0|1,0,2]=4 430 B10R1.59 CC(N1CC(CC1=O)N)C Amb13952503 [0,0,0,0,1,0|2,0,1]=4 431 B10R1.59 CC1OC(=O)C(C1)C(=O)C Amb17593583 [0,0,0,0,1,0|2,0,1]=4 432 B10R1.59 CC=1OC(C)CC1C(C)=O Amb24448953 [0,0,0,0,1,0|3,0,0]=4 433 B10R1.194 CC(=O)C1CCC(C)C1=O Amb24676846 [0,0,0,0,1,0|1,0,1]=3 434 B10R1.194 CC(=O)C1SCC(C)C1=O Amb24061573 [0,0,0,0,1,0|2,0,1]=4 435 B10R1.194 CC(C)=C1CC=C(C)C1=O Amb25320103 [0,0,0,0,1,0|0,0,2]=3 436 B10R1.194 CC(C)=C1CSC(C)C1=O Amb24633474 [0,0,0,0,1,0|1,0,0]=2 437 B10R1.194 CC(C)N1CCC(Br)C1=O Amb20623062 [0,0,0,0,1,0|2,0,1]=4 438 B10R1.194 CC(C)N1CCC(N)C1=O Amb18945540 [0,0,0,0,1,0|2,0,1]=4 439 B10R1.194 CC(C)N1CC[C@H](N)C1=O Amb25121106 [0,0,0,0,1,0|2,0,1]=4 440 B10R1.194 CC(C)N1CNC(C)C1=O Amb25777746 [0,0,0,0,1,0|2,0,1]=4 441 B10R1.194 CN(C)N1CCC(N)C1=O Amb24479508 [0,0,0,0,1,0|3,0,0]=4 442 B12R1.233 CC(=O)CN1CCC(C)CC1=O Amb25178934 [0,0,0,0,0,1|2,0,0]=3 443 B12R1.233 CC(=O)OC1CC[C@@H](C)CC1=O Amb24343358 [0,0,0,0,0,1|1,0,1]=3 444 B12R1.233 CC1CC(=O)N(CC(N)=O)CC1 Amb25772424 [0,0,0,0,0,1|3,0,0]=4 445 B12R1.233 CC1CC(=O)N(CC1)CC(=C)Br Amb24505461 [0,0,0,0,0,1|2,0,1]=4 446 B12R1.233 CC1CCN(CC(C)N)C(=O)C1 Amb24505417 [0,0,0,0,0,1|2,0,1]=4 447 B12R1.233 CC1CCN(CC(C)O)C(=O)C1 Amb24412377 [0,0,0,0,0,1|2,0,1]=4 448 B12R1.233 CC1CCN(C[C@H](C)O)C(=O)C1 Amb24711686 [0,0,0,0,0,1|2,0,1]=4 449 B12R1.233 CC=1CN(C)CCC1CC(C)=O Amb25066435 [0,0,0,0,0,1|3,0,0]=4 450 B12R1.878 CC(C)C1=CCCC(O)CC1=O Amb24698892 [0,0,0,0,0,1|1,0,1]=3 451 B12R1.878 CC(C)C1CNCC(C)CS1=O Amb25851375 [0,0,0,0,0,1|1,0,2]=4 452 B12R1.878 CC(C)N1CCNC(C)CC1=O Amb24439486 [0,0,0,0,0,1|1,0,1]=3 453 B12R1.1218 CC(=C)C1CC(=O)CC(C)CC1 Amb25713008 [0,0,0,0,0,1|0,0,2]=3 454 B12R1.1218 CC(=C)[C@@H]1CC(=O)C[C@H](C)CC1 Amb24512346 [0,0,0,0,0,1|0,0,2]=3 455 B12R1.1218 CC(=O)C1CC(=O)OC(C)CC1 Amb25263565 [0,0,0,0,0,1|2,0,1]=4 456 B12R1.1218 CC(C)C1CC(=O)CC(C)CC1 Amb25093774 [0,0,0,0,0,1|0,0,2]=3 457 B12R1.1218 CC(C)C1CC(=O)OC(C)CC1 Amb24488785 [0,0,0,0,0,1|1,0,2]=4 458 B12R1.1218 CC(C)C1CCC(C)CC(=O)O1 Amb24063225 [0,0,0,0,0,1|0,0,2]=3 459 B12R1.1218 CC(C)[C@@H]1CC[C@@H](C)CC(=N)N1 Amb24655030 [0,0,0,0,0,1|1,0,2]=4 460 B12R1.1218 CC(C)[C@@H]1CC[C@@H](C)CC(=O)N1 Amb25271366 [0,0,0,0,0,1|0,0,2]=3 461 B12R1.1218 CC(C)[C@H]1CC[C@H](C)CC(=O)N1 Amb24681999 [0,0,0,0,0,1|0,0,2]=3 462 B12R1.1236 CC(=O)N1CCC(C)CCC1=O Amb25042925 [0,0,0,0,0,1|2,0,0]=3 463 B12R1.1236 CC(C)=C1CCC(O)C=CC1=O Amb25309297 [0,0,0,0,0,1|1,0,1]=3 464 B12R1.1236 CC(C)C1CCC(C)CNC1=N Amb24490252 [0,0,0,0,0,1|1,0,2]=4 465 B12R1.1236 CC(C)C1CC[C@@H](C)CCC1=O Amb25282838 [0,0,0,0,0,1|0,0,2]=3 466 B12R1.1236 CC(C)N1CCC(C)NCC1=O Amb25160027 [0,0,0,0,0,1|1,0,1]=3 467 B12R1.1236 CC(C)N1CCC(N)CCC1=O Amb25127715 [0,0,0,0,0,1|2,0,1]=4 468 B12R1.1236 CC(C)[C@@H]1CC[C@@H](C)C=CC1=O Amb24470345 [0,0,0,0,0,1|0,0,3]=4 469 B12R1.1236 CC(C)[C@H]1CC[C@@H](C)CCC1=O Amb25179725 [0,0,0,0,0,1|0,0,2]=3 470 B9R0.1 CC(C)=CCC=C(C)C=O Amb25327629 [1,0,1,0,0,0|0,0,2]=4 471 B9R0.1 CC(C)=CCCC(Br)C=O Amb18130951 [1,0,1,0,0,0|1,0,0]=3 472 B9R0.1 CC(C)=CCCC(C)NC Amb22055566 [1,0,1,0,0,0|1,0,1]=4 473 B9R0.1 CC(C)=CCCC(O)CCl Amb24505270 [1,0,1,0,0,0|2,0,0]=4 474 B9R0.1 CC(C)=CCCC(O)CO Amb24477029 [1,0,1,0,0,0|1,0,1]=4 475 B9R0.1 CC(C)=CCC[C@@H](O)CO Amb25686569 [1,0,1,0,0,0|1,0,1]=4 476 B9R0.1 CC(C)=CC\C=C(/C)\C=O Amb24505142 [1,0,1,0,0,0|0,0,2]=4 477 B9R0.1 CC(C)CCCC(C)C=O Amb18124610 [1,0,1,0,0,0|0,0,2]=4 478 B9R0.1 CC(C=C)NCC=C(C)C Amb24481095 [1,0,1,0,0,0|1,0,1]=4 479 B9R0.1 CC(C=C)SCC=C(C)C Amb24482832 [1,0,1,0,0,0|1,0,1]=4 480 B9R0.1 CC(C=O)\C=C\C=C(C)C Amb18643328 [1,0,1,0,0,0|0,0,2]=4 481 B9R0.1 CC(CBr)CCC=C(C)C Amb24548827 [1,0,1,0,0,0|1,0,0]=3 482 B9R0.1 CC(CBr)NCC=C(C)C Amb24479618 [1,0,1,0,0,0|2,0,0]=4 483 B9R0.1 CC(CCC=C(C)C)C#N Amb18124499 [1,0,1,0,0,0|1,0,1]=4 484 B9R0.1 CC(CCC=C(C)C)C=C Amb20246803 [1,0,1,0,0,0|0,0,1]=3 485 B9R0.1 CC(CCCC(C)=C)C=O Amb25712471 [1,0,1,0,0,0|0,0,2]=4 486 B9R0.1 CC(CCCC(C)=O)C=O Amb24453385 [1,0,1,0,0,0|1,0,1]=4 487 B9R0.1 CC(CCCN(C)C)C=O Amb25174625 [1,0,1,0,0,0|1,0,1]=4 488 B9R0.1 CC(CC\C=C(\C)/Cl)C=O Amb24382901 [1,0,1,0,0,0|1,0,0]=3 489 B9R0.1 CC(CCl)NCC=C(C)C Amb25131370 [1,0,1,0,0,0|2,0,0]=4 490 B9R0.1 CC(CF)NCC=C(C)C Amb25788633 [1,0,1,0,0,0|2,0,0]=4 491 B9R0.1 CC(CO)C\C=C\C(C)=C Amb24414875 [1,0,1,0,0,0|1,0,1]=4 492 B9R0.1 CC(CO)OCC=C(C)C Amb25356908 [1,0,1,0,0,0|1,0,1]=4 493 B9R0.1 CC(CO)SCC=C(C)C Amb25146977 [1,0,1,0,0,0|1,0,1]=4 494 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [1,0,1,0,0,0|0,0,1]=3 495 B9R0.1 CCC(C)CON=C(C)C Amb24673290 [1,0,1,0,0,0|2,0,0]=4 496 B9R0.1 CCC(C)O\C=C\C(C)=O Amb24690824 [1,0,1,0,0,0|2,0,0]=4 497 B9R0.1 CCC(C)SCC=C(C)C Amb25740029 [1,0,1,0,0,0|1,0,1]=4 498 B9R0.1 CCC(N)C\C=C\N(C)C Amb24558723 [1,0,1,0,0,0|2,0,0]=4 499 B9R0.1 CC[C@@H](O)CC=C=C(C)C Amb24475821 [1,0,1,0,0,0|1,0,1]=4 500 B9R0.1 CNC(CCC=C(C)C)C Amb17593577 [1,0,1,0,0,0|1,0,1]=4 501 B9R0.1 C[C@@H](CBr)CCC=C(C)C Amb25054445 [1,0,1,0,0,0|1,0,0]=3 502 B9R0.1 C[C@@H](CCC=C(C)C)C=C Amb22353105 [1,0,1,0,0,0|0,0,1]=3 503 B9R0.1 C[C@@H](CO)C\C=C\C(C)=C Amb25344958 [1,0,1,0,0,0|1,0,1]=4 504 B9R0.1 C[C@@H](CO)NCC=C(C)C Amb25288762 [1,0,1,0,0,0|1,0,1]=4 505 B9R0.1 C[C@@H](C\C=C\C(C)=C)C=O Amb25838676 [1,0,1,0,0,0|0,0,2]=4 506 B9R0.1 C[C@H](CCC=C(C)C)C=C Amb22353149 [1,0,1,0,0,0|0,0,1]=3 507 B9R0.1 C[C@H](CCC=C(C)C)C=O Amb24710827 [1,0,1,0,0,0|0,0,0]=2 508 B9R0.1 C[C@H](CCCC(C)=O)C=O Amb25119261 [1,0,1,0,0,0|1,0,1]=4 509 B9R0.1 C[C@H](CN)CCC=C(C)C Amb24478120 [1,0,1,0,0,0|1,0,0]=3 510 B9R0.1 C[C@H](CO)C\C=C\C(C)=C Amb25043827 [1,0,1,0,0,0|1,0,1]=4 511 B9R0.2 CC(=C)\C=C\CCCC=O Amb18643329 [1,0,1,0,0,0|0,0,2]=4 512 B9R0.2 CC(=O)CCCCCC=O Amb25290329 [1,0,1,0,0,0|1,0,1]=4 513 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [1,0,1,0,0,0|2,0,0]=4 514 B9R0.2 CC(=O)\C=C\CCCC=O Amb24476998 [1,0,1,0,0,0|1,0,1]=4 515 B9R0.2 CC(C)=CC=CCCC=O Amb24629280 [1,0,1,0,0,0|0,0,2]=4 516 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [1,0,1,0,0,0|0,0,0]=2 517 B9R0.2 CC(C)=CCCCCCBr Amb24524614 [1,0,1,0,0,0|1,0,1]=4 518 B9R0.2 CC(C)=CCCNCC=C Amb25368441 [1,0,1,0,0,0|2,0,0]=4 519 B9R0.2 CC(C)=CCC\C=C\C=O Amb18643301 [1,0,1,0,0,0|0,0,2]=4 520 B9R0.2 CC(C)=CCOCCC=O Amb18643942 [1,0,1,0,0,0|1,0,0]=3 521 B9R0.2 CC(C)CCCCCC=O Amb22233123 [1,0,1,0,0,0|0,0,2]=4 522 B9R0.2 CC(C)\C=C\CCCC=O Amb25742933 [1,0,1,0,0,0|0,0,2]=4 523 B9R0.2 CCCCCCC=C(C)C Amb24539575 [1,0,1,0,0,0|1,0,1]=4 524 B9R0.2 CN(C)CCCCCC=O Amb25743404 [1,0,1,0,0,0|1,0,1]=4 525 B9R0.5 CC#CCC[C@H](C)CC=O Amb24380762 [1,0,1,0,0,0|0,0,2]=4 526 B9R0.5 CC(CC=O)CCCC=C Amb24706963 [1,0,1,0,0,0|0,0,2]=4 527 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,0,1,0,0,0|0,0,2]=4 528 B9R0.5 C\C=C/C=C/C(C)CC=O Amb24696664 [1,0,1,0,0,0|0,0,2]=4 529 B9R0.5 C\C=C\C=C\C(C)CC=O Amb24637637 [1,0,1,0,0,0|0,0,2]=4 530 B9R0.5 C\C=C\CCC(C)CCO Amb25792404 [1,0,1,0,0,0|0,0,2]=4 531 B9R0.5 C\C=C\CC\C(\C)=C\C=O Amb18643316 [1,0,1,0,0,0|0,0,2]=4 532 B9R0.6 CC(C)=C(Br)C(=O)OCC Amb21962889 [1,0,1,0,0,0|2,0,0]=4 533 B9R0.6 CC(C)=C(C)C(=O)CC=C Amb25028153 [1,0,1,0,0,0|0,0,2]=4 534 B9R0.6 CC(C)=C(C)C(=O)NOC Amb25106393 [1,0,1,0,0,0|2,0,0]=4 535 B9R0.6 CC(C)=C(C)C(=O)OCC Amb25187276 [1,0,1,0,0,0|1,0,0]=3 536 B9R0.6 CC(C)=C(C)C(=O)\C=C\C Amb24707035 [1,0,1,0,0,0|0,0,2]=4 537 B9R0.6 CC(C)=C(F)C(=O)OCC Amb25801998 [1,0,1,0,0,0|2,0,0]=4 538 B9R0.6 CC(C)=C(N)C(=O)OCC Amb24480763 [1,0,1,0,0,0|2,0,0]=4 539 B9R0.6 CC(N)=C(Br)C(=O)CCC Amb24574007 [1,0,1,0,0,0|2,0,0]=4 540 B9R0.6 CCCC(=O)C(=O)C(C)C Amb24707010 [1,0,1,0,0,0|1,0,1]=4 541 B9R0.6 CCCC(=O)C(C(=O)C)C Amb17593599 [1,0,1,0,0,0|1,0,1]=4 542 B9R0.6 CCCC(=O)C(C)N(C)C Amb24467246 [1,0,1,0,0,0|1,0,1]=4 543 B9R0.6 CCCC(=O)N(C)C(C)C Amb25291329 [1,0,1,0,0,0|1,0,1]=4 544 B9R0.6 CCC\C(\C)=C(/C)\C(C)=O Amb25318975 [1,0,1,0,0,0|2,0,0]=4 545 B9R0.6 CCOC(=O)\C(=C(/N)\C)\C Amb17608153 [1,0,1,0,0,0|2,0,0]=4 546 B9R0.6 C\C(\N)=C(/Br)\C(=O)CCC Amb25727770 [1,0,1,0,0,0|2,0,0]=4 547 B9R0.7 CC(=C)C(=C)CNC(C)C Amb24680028 [1,0,1,0,0,0|1,0,1]=4 548 B9R0.7 CC(=C)C(=O)CCC(C)C Amb25741534 [1,0,1,0,0,0|0,0,1]=3 549 B9R0.7 CC(=C)C(=O)COC(C)C Amb24435806 [1,0,1,0,0,0|1,0,1]=4 550 B9R0.7 CC(=C)C(=O)NCC(C)C Amb25843280 [1,0,1,0,0,0|1,0,1]=4 551 B9R0.7 CC(=O)C(=C)COC(C)C Amb24546081 [1,0,1,0,0,0|2,0,0]=4 552 B9R0.7 CC(C)=C(Br)CCC(C)N Amb18655208 [1,0,1,0,0,0|2,0,0]=4 553 B9R0.7 CC(C)C(=C)CCC(C)N Amb25073048 [1,0,1,0,0,0|1,0,1]=4 554 B9R0.7 CC(C)C(=O)CCC(C)O Amb24605182 [1,0,1,0,0,0|1,0,1]=4 555 B9R0.7 CC(C)C(=O)CNC(C)C Amb24560238 [1,0,1,0,0,0|1,0,1]=4 556 B9R0.7 CC(C)C(=O)COC(C)C Amb24475221 [1,0,1,0,0,0|1,0,1]=4 557 B9R0.7 CC(C)C(=O)CSC(C)C Amb25103535 [1,0,1,0,0,0|1,0,1]=4 558 B9R0.7 CC(C)CCC(=N)N(C)C Amb24477900 [1,0,1,0,0,0|2,0,0]=4 559 B9R0.7 CC(C)CCC(=O)C(=O)Cl Amb24722777 [1,0,1,0,0,0|2,0,0]=4 560 B9R0.7 CC(C)COC(=O)N(C)C Amb25859536 [1,0,1,0,0,0|2,0,0]=4 561 B9R0.7 CC(C)C\C=C(\C)/C(C)O Amb24482479 [1,0,1,0,0,0|1,0,1]=4 562 B9R0.7 CC(C)SCC(=O)N(C)C Amb25706434 [1,0,1,0,0,0|2,0,0]=4 563 B9R0.7 CC(CCC(=O)N(C)C)O Amb17334244 [1,0,1,0,0,0|2,0,0]=4 564 B9R0.7 CC(CNC(=O)C(=O)C)C Amb17399879 [1,0,1,0,0,0|2,0,0]=4 565 B9R0.7 CC(N)CCC(=O)N(C)C Amb23536722 [1,0,1,0,0,0|2,0,0]=4 566 B9R0.7 CN(CCC(=O)C(C)C)C Amb15693466 [1,0,1,0,0,0|1,0,1]=4 567 B9R0.7 C\C(=C/CC(C)C)\C(C)=O Amb24478340 [1,0,1,0,0,0|1,0,0]=3 568 B9R0.7 C\C(=C/NC(C)C)\C(C)=O Amb24478365 [1,0,1,0,0,0|2,0,0]=4 569 B9R0.7 C\C(=C\CC(C)O)\C(C)=C Amb25316913 [1,0,1,0,0,0|1,0,1]=4 570 B9R0.7 C\C(=C\NC(C)C)\C(C)=O Amb24463268 [1,0,1,0,0,0|2,0,0]=4 571 B9R0.7 C\C(=N/CC(C)C)\C(C)=O Amb24424901 [1,0,1,0,0,0|2,0,0]=4 572 B9R0.23 CC(=CO)C(=O)OC(C)C Amb25172571 [1,0,1,0,0,0|2,0,0]=4 573 B9R0.23 CC(=O)CC(=O)\C(\C)=C\C Amb25370650 [1,0,1,0,0,0|1,0,1]=4 574 B9R0.23 CC(C)CC(=O)C(C)CC Amb25062926 [1,0,1,0,0,0|0,0,2]=4 575 B9R0.23 CC(C)CC(=O)C(C)OC Amb24379218 [1,0,1,0,0,0|1,0,1]=4 576 B9R0.23 CC(C)CC(=O)[C@@H](C)CC Amb25146655 [1,0,1,0,0,0|0,0,2]=4 577 B9R0.23 CCN(C)C(=O)CC(C)C Amb25105725 [1,0,1,0,0,0|1,0,1]=4 578 B9R0.23 COC(=O)C(=O)CC(C)C Amb17740021 [1,0,1,0,0,0|2,0,0]=4 579 B9R0.23 CON(C)C(=O)CC(C)C Amb20673732 [1,0,1,0,0,0|2,0,0]=4 580 B9R0.23 C\C(=C/C)\C(=O)CC(C)=C Amb25371878 [1,0,1,0,0,0|0,0,2]=4 581 B9R0.23 C\C(=C/C)\C(=O)NC(C)C Amb25836393 [1,0,1,0,0,0|1,0,0]=3 582 B9R0.23 C\C(=C/C)\C(=O)OC(C)C Amb22230776 [1,0,1,0,0,0|1,0,0]=3 583 B9R0.23 C\C(=C/C)\C(=S)NC(C)C Amb25363439 [1,0,1,0,0,0|1,1,0]=4 584 B9R0.23 C\C(=C/O)\C(=O)CC(C)C Amb24584532 [1,0,1,0,0,0|1,0,0]=3 585 B9R0.23 C\C(=C\C)\C(=O)CC(C)=C Amb25314135 [1,0,1,0,0,0|0,0,2]=4 586 B9R0.23 C\C(=C\C)\C(=O)OC(C)C Amb24482854 [1,0,1,0,0,0|1,0,0]=3 587 B9R0.23 C\C(\C=O)=C(/O)\CC(C)C Amb25857392 [1,0,1,0,0,0|1,0,1]=4 588 B9R0.23 C\C=C(/N)\C(=O)OC(C)C Amb24502271 [1,0,1,0,0,0|2,0,0]=4 589 B9R0.53 CC(=C)CC(=O)CC(C)C Amb25827965 [1,0,1,0,0,0|0,0,2]=4 590 B9R0.53 CC(=O)NC(=O)CC(C)C Amb24333719 [1,0,1,0,0,0|2,0,0]=4 591 B9R0.53 CC(=O)\C=C(/O)\CC(C)C Amb24524653 [1,0,1,0,0,0|1,0,1]=4 592 B9R0.53 CC(C)=CC(=O)C=C(C)C Amb19957829 [1,0,1,0,0,0|0,0,2]=4 593 B9R0.53 CC(C)=CC(=O)CC(C)C Amb24581834 [1,0,1,0,0,0|0,0,0]=2 594 B9R0.53 CC(C)=CC(=O)CC(C)O Amb24478185 [1,0,1,0,0,0|1,0,0]=3 595 B9R0.53 CC(C)=CC(=O)NN(C)C Amb24608266 [1,0,1,0,0,0|2,0,0]=4 596 B9R0.53 CC(C)=CC(=O)SC(C)C Amb22231438 [1,0,1,0,0,0|1,0,0]=3 597 B9R0.53 CC(C)C=C(C)CC(C)C Amb22228320 [1,0,1,0,0,0|1,0,1]=4 598 B9R0.53 CC(C)CC(=O)NN(C)C Amb24371767 [1,0,1,0,0,0|2,0,0]=4 599 B9R0.53 CC(C)CC(N)C=C(C)C Amb25822562 [1,0,1,0,0,0|1,0,1]=4 600 B9R0.53 CC(C)CC(O)C=C(C)C Amb25364031 [1,0,1,0,0,0|0,0,2]=4 601 B9R0.53 CC(C)OC(=O)CC(C)C Amb22731225 [1,0,1,0,0,0|1,0,1]=4 602 B9R0.53 CC(C)SC(=O)CC(C)C Amb22641873 [1,0,1,0,0,0|1,0,1]=4 603 B9R0.53 CC(OC(=O)\C=C(\N)/C)C Amb17616219 [1,0,1,0,0,0|2,0,0]=4 604 B9R0.53 C\C(\Cl)=C\C(=O)NC(C)C Amb25063189 [1,0,1,0,0,0|2,0,0]=4 605 B9R0.53 C\C(\N)=C\C(=O)CC(C)O Amb25685573 [1,0,1,0,0,0|2,0,0]=4 606 B9R0.53 C\C(\N)=C\C(=O)NC(C)C Amb24664878 [1,0,1,0,0,0|2,0,0]=4 607 B9R0.53 C\C(\O)=C/C(=O)CC(C)C Amb25146560 [1,0,1,0,0,0|1,0,0]=3 608 B9R0.53 C\C(\O)=C\C(=O)CC(C)C Amb25146659 [1,0,1,0,0,0|1,0,0]=3 609 B9R0.53 C\C(\S)=C\C(=O)CC(C)C Amb24588773 [1,0,1,0,0,0|1,0,0]=3 610 B9R0.53 [13CH3]C([13CH3])CC(=O)CC([13CH3])[13CH3] Amb22055143 [1,0,1,0,0,0|0,0,2]=4 611 B9R0.13 CC(=O)C(CCCC)=C=C Amb24479207 [1,0,1,0,0,0|0,0,2]=4 612 B9R0.13 CC(=O)\C(\CBr)=C/CCC Amb25311206 [1,0,1,0,0,0|2,0,0]=4 613 B9R0.13 CC(=O)\C(\CBr)=C\CCC Amb24349642 [1,0,1,0,0,0|2,0,0]=4 614 B9R0.13 CC(=O)\C(\CC)=C/OCC Amb24478158 [1,0,1,0,0,0|2,0,0]=4 615 B9R0.13 CC(=O)\C(\CCC#N)=C\C Amb25347376 [1,0,1,0,0,0|1,0,1]=4 616 B9R0.13 CC(=O)\C(\CCCC)=N\O Amb25822238 [1,0,1,0,0,0|2,0,0]=4 617 B9R0.13 CC(=O)\C(\CCl)=C\CCC Amb25072752 [1,0,1,0,0,0|2,0,0]=4 618 B9R0.13 CC(C)=C(C=O)SCCC Amb25123855 [1,0,1,0,0,0|1,0,0]=3 619 B9R0.13 CC(C)=C(CCC=O)C=O Amb18643574 [1,0,1,0,0,0|1,0,1]=4 620 B9R0.13 CC(C)=C(CCCC)C=O Amb18643632 [1,0,1,0,0,0|0,0,0]=2 621 B9R0.13 CC(C)=C(CCCC)CC Amb25839850 [1,0,1,0,0,0|0,0,1]=3 622 B9R0.13 CC(C)=C(C\C=C\C)C=O Amb18124523 [1,0,1,0,0,0|0,0,2]=4 623 B9R0.13 CC(C)C(CCCC)C=O Amb18643968 [1,0,1,0,0,0|0,0,2]=4 624 B9R0.13 CC(Cl)=C(CCOC)C=O Amb25233608 [1,0,1,0,0,0|2,0,0]=4 625 B9R0.13 CCCCC(=CBr)C(O)=O Amb25025162 [1,0,1,0,0,0|2,0,0]=4 626 B9R0.13 CCCCC(=CC)[N+]([O-])=O Amb24640767 [1,0,1,0,0,0|2,0,0]=4 627 B9R0.13 CCCCC(C=C)C(C)=O Amb24353218 [1,0,1,0,0,0|0,0,2]=4 628 B9R0.13 CCCCC(C=O)C(C)=O Amb25293767 [1,0,1,0,0,0|1,0,1]=4 629 B9R0.13 CCCCC(CC)C(C)=O Amb25049588 [1,0,1,0,0,0|0,0,2]=4 630 B9R0.13 CCCC[C@H](CC)C(C)=O Amb24478140 [1,0,1,0,0,0|0,0,2]=4 631 B9R0.13 CCCC\C(=C/Br)\C(O)=O Amb24757714 [1,0,1,0,0,0|2,0,0]=4 632 B9R0.13 CCCC\C(=C/C)\C(N)=O Amb25790366 [1,0,1,0,0,0|1,0,0]=3 633 B9R0.13 CCCC\C(=C/C)\[N+]([O-])=O Amb25782473 [1,0,1,0,0,0|2,0,0]=4 634 B9R0.13 CCC\C=C(/CC)\C(O)=O Amb25228438 [1,0,1,0,0,0|2,0,0]=4 635 B9R0.13 CCC\C=C(\CC)/C(N)=O Amb25662913 [1,0,1,0,0,0|2,0,0]=4 636 B9R0.13 CCC\N=C(\C(C)C)/CC Amb10569555 [1,0,1,0,0,0|1,0,1]=4 637 B9R0.13 CC\C(=C\CCC)\C(C)N Amb25174962 [1,0,1,0,0,0|1,0,1]=4 638 B9R0.13 CC\C(=C\CCC)\C(C)O Amb25306631 [1,0,1,0,0,0|1,0,1]=4 639 B9R0.13 CC\C(=C\CCC)\[C@H](C)O Amb24420782 [1,0,1,0,0,0|1,0,1]=4 640 B9R0.13 C\C=C(\CCCCl)/C(O)=O Amb24470501 [1,0,1,0,0,0|2,0,0]=4 641 B9R0.33 CC(=O)C(SCC)=C(C)N Amb25179090 [1,0,1,0,0,0|2,0,0]=4 642 B9R0.33 CC(=O)\C(\SCC)=C(\C)/O Amb24707033 [1,0,1,0,0,0|2,0,0]=4 643 B9R0.33 CC(C)=C(CC=C)C(C)=O Amb24647353 [1,0,1,0,0,0|0,0,2]=4 644 B9R0.33 CC(C)=C(CCBr)C(C)=C Amb25072997 [1,0,1,0,0,0|2,0,0]=4 645 B9R0.33 CC(C)=C(CCO)C(C)=C Amb24429910 [1,0,1,0,0,0|2,0,0]=4 646 B9R0.33 CC(C)=C(OCC)C(O)=O Amb25757544 [1,0,1,0,0,0|2,0,0]=4 647 B9R0.33 CC(C)=C(SCC)C(C)=O Amb25688894 [1,0,1,0,0,0|1,0,0]=3 648 B9R0.33 CC(C)=C(SCC)C(O)=O Amb24482340 [1,0,1,0,0,0|2,0,0]=4 649 B9R0.33 CC(C)C(CCC)C(C)=O Amb24476772 [1,0,1,0,0,0|0,0,2]=4 650 B9R0.33 CCCC(C(C)=O)C(C)=O Amb22734682 [1,0,1,0,0,0|1,0,1]=4 651 B9R0.33 CCC\C(=C(/C)\N)\C(C)=O Amb25101127 [1,0,1,0,0,0|1,0,0]=3 652 B9R0.33 CCC\C(=C(/C)\O)\C(C)=O Amb25833655 [1,0,1,0,0,0|1,0,0]=3 653 B9R0.4 CC(=C)CC(=O)CCCC Amb25303713 [1,0,1,0,0,0|0,0,2]=4 654 B9R0.4 CC(=N)CC(=O)CCCC Amb25090358 [1,0,1,0,0,0|1,0,1]=4 655 B9R0.4 CC(=O)CC(=O)CCCC Amb22347234 [1,0,1,0,0,0|1,0,1]=4 656 B9R0.4 CC(=O)\C=C(/Cl)\CCCC Amb25712728 [1,0,1,0,0,0|2,0,0]=4 657 B9R0.4 CC(=O)\C=C(/N)\CCCC Amb25317904 [1,0,1,0,0,0|2,0,0]=4 658 B9R0.4 CC(=S)NC(=O)CCCC Amb24435382 [1,0,1,0,0,0|2,0,0]=4 659 B9R0.4 CC(C)=CC(=O)CC#CC Amb25221971 [1,0,1,0,0,0|0,0,2]=4 660 B9R0.4 CC(C)=CC(=O)CCC#C Amb24467209 [1,0,1,0,0,0|0,0,2]=4 661 B9R0.4 CC(C)=CC(=O)CCC#N Amb24693963 [1,0,1,0,0,0|1,0,1]=4 662 B9R0.4 CC(C)=CC(=O)CCC=C Amb24478305 [1,0,1,0,0,0|0,0,2]=4 663 B9R0.4 CC(C)=CC(=O)CCC=O Amb18643573 [1,0,1,0,0,0|1,0,1]=4 664 B9R0.4 CC(C)=CC(=O)CCCCl Amb24660480 [1,0,1,0,0,0|1,0,0]=3 665 B9R0.4 CC(C)=CC(=O)CCCN Amb25727125 [1,0,1,0,0,0|1,0,0]=3 666 B9R0.4 CC(C)=CC(=O)CSCC Amb25790794 [1,0,1,0,0,0|1,0,0]=3 667 B9R0.4 CC(C)=CC(=O)NCCF Amb25306986 [1,0,1,0,0,0|2,0,0]=4 668 B9R0.4 CC(C)=CC(=O)NCCN Amb18289755 [1,0,1,0,0,0|2,0,0]=4 669 B9R0.4 CC(C)=CC(=O)OCCC Amb24365275 [1,0,1,0,0,0|1,0,0]=3 670 B9R0.4 CC(C)=CC(=O)OCCCl Amb25723035 [1,0,1,0,0,0|2,0,0]=4 671 B9R0.4 CC(C)=CC(=O)OCCF Amb22641479 [1,0,1,0,0,0|2,0,0]=4 672 B9R0.4 CC(C)=CC(=O)OCCN Amb24761459 [1,0,1,0,0,0|2,0,0]=4 673 B9R0.4 CC(C)=CC(=O)OCOC Amb24509399 [1,0,1,0,0,0|2,0,0]=4 674 B9R0.4 CC(C)=CC(=O)\C=C\CC Amb25094294 [1,0,1,0,0,0|0,0,2]=4 675 B9R0.4 CCCCC(=O)CC(C)C Amb10807381 [1,0,1,0,0,0|0,0,2]=4 676 B9R0.4 CCCCC(=O)NN(C)C Amb25680415 [1,0,1,0,0,0|2,0,0]=4 677 B9R0.4 CCCCC(=O)OC(C)C Amb22733766 [1,0,1,0,0,0|1,0,1]=4 678 B9R0.4 CCCC\C(\C)=C\C(C)=O Amb24698890 [1,0,1,0,0,0|2,0,0]=4 679 B9R0.4 C\C(\N)=C\C(=O)CCCC Amb24608603 [1,0,1,0,0,0|1,0,0]=3 680 B9R0.4 C\C(\N)=C\C(=O)COCC Amb25698060 [1,0,1,0,0,0|2,0,0]=4 681 B9R0.4 C\C(\N)=C\C(=O)OCCC Amb22755773 [1,0,1,0,0,0|2,0,0]=4 682 B9R0.4 C\C(\O)=C/C(=O)CCCC Amb25146869 [1,0,1,0,0,0|1,0,0]=3 683 B9R0.4 C\C(\O)=C\C(=O)CCCC Amb25729180 [1,0,1,0,0,0|1,0,0]=3 684 B9R0.4 C\C(\O)=C\C(=O)OCCC Amb24595160 [1,0,1,0,0,0|2,0,0]=4 685 B9R0.34 CC(CC(=O)NCC)CC Amb24480695 [1,0,1,0,0,0|1,0,1]=4 686 B9R0.34 CCC(C)CC(=O)CC=C Amb25737376 [1,0,1,0,0,0|0,0,2]=4 687 B9R0.34 CCC(C)CC(=O)COC Amb25084947 [1,0,1,0,0,0|1,0,1]=4 688 B9R0.34 CCC(C)CC(=O)CSC Amb18797916 [1,0,1,0,0,0|1,0,1]=4 689 B9R0.34 CCC(C)CC(=O)NOC Amb25347805 [1,0,1,0,0,0|2,0,0]=4 690 B9R0.34 CCC(C)CC(=O)\C=C\Cl Amb24741086 [1,0,1,0,0,0|1,0,0]=3 691 B9R0.34 CCCC(=O)CC(C)CC Amb25806879 [1,0,1,0,0,0|0,0,2]=4 692 B9R0.34 CCOC(=O)CC(CC)C Amb10807395 [1,0,1,0,0,0|1,0,1]=4 693 B9R0.34 CC[C@H](C)CC(=O)\C=C\Cl Amb24482164 [1,0,1,0,0,0|1,0,0]=3 694 B9R0.34 C\C(\CC(=O)\C=C/C)=C\C Amb25707566 [1,0,1,0,0,0|0,0,2]=4 695 B9R0.34 C\C(\CC(=O)\C=C\C)=C\C Amb25768547 [1,0,1,0,0,0|0,0,2]=4 696 B9R0.34 C\C=C/C(=O)CC(C)C=C Amb24737597 [1,0,1,0,0,0|0,0,2]=4 697 B9R0.34 C\C=C\C(=O)CC(=C)CC Amb24471211 [1,0,1,0,0,0|0,0,2]=4 698 B9R0.34 C\C=C\C(=O)CC(=O)CC Amb24645388 [1,0,1,0,0,0|1,0,1]=4 699 B9R0.34 C\C=C\C(=O)CC(C)C#N Amb18643163 [1,0,1,0,0,0|1,0,1]=4 700 B9R0.34 C\C=C\C(=O)CC(C)CO Amb24691750 [1,0,1,0,0,0|1,0,0]=3 701 B9R0.34 C\C=C\C(=O)CC(Cl)CC Amb25101667 [1,0,1,0,0,0|1,0,0]=3 702 B9R0.34 C\C=C\C(=O)CC(O)CC Amb24647753 [1,0,1,0,0,0|1,0,0]=3 703 B9R0.34 C\C=C\C(=O)C[C@@H](O)CC Amb24362834 [1,0,1,0,0,0|1,0,0]=3 704 B9R0.34 C\C=C\C(=O)NC(C)CC Amb24716146 [1,0,1,0,0,0|1,0,0]=3 705 B9R0.34 C\C=C\C(=O)NC(C)CF Amb25735614 [1,0,1,0,0,0|2,0,0]=4 706 B9R0.34 C\C=C\C(=O)NC(C)CN Amb18251239 [1,0,1,0,0,0|2,0,0]=4 707 B9R0.34 C\C=C\C(=O)N[C@H](C)CC Amb24761513 [1,0,1,0,0,0|1,0,0]=3 708 B9R0.34 C\C=C\C(=O)OC(C)CO Amb24406254 [1,0,1,0,0,0|2,0,0]=4 709 B9R0.34 C\C=C\C(=O)OC(CC)C Amb15693451 [1,0,1,0,0,0|1,0,0]=3 710 B9R0.43 CC(=O)CC\C(\C=O)=C\C Amb18643605 [1,0,1,0,0,0|1,0,1]=4 711 B9R0.43 CC(C)=CC\C(\C=O)=C\C Amb18643302 [1,0,1,0,0,0|0,0,2]=4 712 B9R0.43 CC(C)CCC(C=O)OC Amb24496589 [1,0,1,0,0,0|1,0,1]=4 713 B9R0.43 CC\C(\C=O)=C/CC(C)C Amb25371823 [1,0,1,0,0,0|0,0,2]=4 714 B9R0.29 CC(=O)\C(\CC)=C(/Cl)\CC Amb24625835 [1,0,1,0,0,0|2,0,0]=4 715 B9R0.29 CC(=O)\C(\CC)=C(\Cl)/CC Amb25718974 [1,0,1,0,0,0|2,0,0]=4 716 B9R0.29 CC(C)=C(CC)C(=O)CC Amb25146587 [1,0,1,0,0,0|0,0,0]=2 717 B9R0.29 CC(C)=C(OC)C(=O)OC Amb24670976 [1,0,1,0,0,0|2,0,0]=4 718 B9R0.29 CCC(=O)C(C(=O)C)CC Amb17593598 [1,0,1,0,0,0|1,0,1]=4 719 B9R0.29 CN(C)C(CC)C(=O)CC Amb25834435 [1,0,1,0,0,0|1,0,1]=4 720 B9R0.29 C\C(\N)=C(\CC)/C(=O)OC Amb24388135 [1,0,1,0,0,0|2,0,0]=4 721 B9R0.37 CCC(=C=O)C(=O)CCC Amb25146502 [1,0,1,0,0,0|1,0,1]=4 722 B9R0.37 CCC(OC)C(=O)CCC Amb25146734 [1,0,1,0,0,0|1,0,1]=4 723 B9R0.37 CCC(SC)C(=O)CCC Amb25070436 [1,0,1,0,0,0|1,0,1]=4 724 B9R0.37 CCCC(=O)C(CC)=CC Amb25215759 [1,0,1,0,0,0|0,0,0]=2 725 B9R0.37 CCCC(=O)C(CC)=CO Amb24666344 [1,0,1,0,0,0|1,0,0]=3 726 B9R0.37 CCCC(=O)\C(\CC)=C/O Amb25146589 [1,0,1,0,0,0|1,0,0]=3 727 B9R0.37 CCCC(=O)\C(\CC)=C\Cl Amb25783871 [1,0,1,0,0,0|1,0,0]=3 728 B9R0.37 CCCC(=O)\C(\CC)=N/N Amb24646552 [1,0,1,0,0,0|2,0,0]=4 729 B9R0.37 CCCC(=O)\C(\CC)=N/O Amb25768338 [1,0,1,0,0,0|2,0,0]=4 730 B9R0.37 CCCC(Cl)=C(CC)C=O Amb25348347 [1,0,1,0,0,0|2,0,0]=4 731 B9R0.37 CCC\C(\Cl)=C(\CC)/C=O Amb25783758 [1,0,1,0,0,0|2,0,0]=4 732 B9R0.37 CCOC(=O)C(CC)=CO Amb24593864 [1,0,1,0,0,0|2,0,0]=4 733 B9R0.37 CCOC(=O)C(CO)=CC Amb25246211 [1,0,1,0,0,0|2,0,0]=4 734 B9R0.37 CCOC(=O)\C(=C\C)\NC Amb20621542 [1,0,1,0,0,0|2,0,0]=4 735 B9R0.37 CCOC(=O)\C(\CBr)=C\C Amb25082081 [1,0,1,0,0,0|2,0,0]=4 736 B9R0.37 CCOC(=O)\C(\CC)=C\C Amb24523715 [1,0,1,0,0,0|1,0,0]=3 737 B9R0.37 C\C=C\C(=O)\C(\CC)=C\C Amb25146530 [1,0,1,0,0,0|0,0,2]=4 738 B9R1.1 CC1CC=C(CBr)CC1 Amb24480141 [2,0,0,0,0,0|1,0,1]=4 739 B9R1.1 CC1CC=C(CC1)C#N Amb18642016 [2,0,0,0,0,0|1,0,1]=4 740 B9R1.1 CC1CC=C(CS1)C=O Amb18643966 [2,0,0,0,0,0|2,0,0]=4 741 B9R1.1 CC1CCC(CC1)=CBr Amb22227652 [2,0,0,0,0,0|1,0,1]=4 742 B9R1.1 CC=C1CCC(N)CC1 Amb24377389 [2,0,0,0,0,0|1,0,1]=4 743 B9R1.1 CC=C1CCC(O)CC1 Amb24748444 [2,0,0,0,0,0|1,0,1]=4 744 B9R1.1 CN1CC=C(CC1)C=C Amb25233540 [2,0,0,0,0,0|1,0,1]=4 745 B9R1.1 CN1CC=C(CC1)C=O Amb24424850 [2,0,0,0,0,0|2,0,0]=4 746 B9R1.1 COC=1CCC(O)CC1 Amb21858056 [2,0,0,0,0,0|2,0,0]=4 747 B9R1.1 C\C=C\1/CNC(C)CC1 Amb25810529 [2,0,0,0,0,0|1,0,1]=4 748 B9R1.6 CC(=C1CCNCC1)C Amb16187021 [2,0,0,0,0,0|1,0,1]=4 749 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [2,0,0,0,0,0|2,0,0]=4 750 B9R1.6 CC(=O)C1=NCCCC1 Amb17607660 [2,0,0,0,0,0|2,0,0]=4 751 B9R1.6 CC(=O)C=1CCCCN1 Amb22054236 [2,0,0,0,0,0|2,0,0]=4 752 B9R1.6 CC(=O)C=1CNCCC1 Amb24461681 [2,0,0,0,0,0|2,0,0]=4 753 B9R1.6 CC(=O)C=1CSCCC1 Amb25177639 [2,0,0,0,0,0|2,0,0]=4 754 B9R1.6 CC(Br)C=1CCCCC1 Amb24480022 [2,0,0,0,0,0|1,0,1]=4 755 B9R1.6 CC(C)=C1CNCCC1 Amb24738538 [2,0,0,0,0,0|1,0,1]=4 756 B9R1.6 CC(C)=C1NCCCO1 Amb24684099 [2,0,0,0,0,0|2,0,0]=4 757 B9R1.6 CC(C)C1=CCCCN1 Amb24091738 [2,0,0,0,0,0|1,0,1]=4 758 B9R1.6 CC(C)C=1CCCCC1 Amb22227968 [2,0,0,0,0,0|0,0,1]=3 759 B9R1.6 CC(C)C=1CCCCN1 Amb25262298 [2,0,0,0,0,0|1,0,1]=4 760 B9R1.6 CC(C1=CCCCC1)N Amb10607848 [2,0,0,0,0,0|1,0,1]=4 761 B9R1.6 CC(Cl)C=1CCCCC1 Amb24677628 [2,0,0,0,0,0|1,0,1]=4 762 B9R1.6 CC(N)C=1CCCCC1 Amb22587030 [2,0,0,0,0,0|1,0,1]=4 763 B9R1.6 CC(O)C=1CCCCC1 Amb25747240 [2,0,0,0,0,0|1,0,1]=4 764 B9R1.6 CP(C)C=1CCNCC1 Amb25032083 [2,0,0,0,0,0|2,0,0]=4 765 B9R1.6 C[C@@H](O)C=1CCCCC1 Amb25822621 [2,0,0,0,0,0|1,0,1]=4 766 B9R1.6 C[C@H](N)C=1CCCCC1 Amb24641421 [2,0,0,0,0,0|1,0,1]=4 767 B9R1.6 O=C(Cl)C=1CCCCC1 Amb21961756 [2,0,0,0,0,0|2,0,0]=4 768 B9R1.6 [13CH3][13C](=O)C=1CCCCN1 Amb22054237 [2,0,0,0,0,0|2,0,0]=4 769 B9R1.15 CC=1CCCCC1C=O Amb18642216 [2,0,0,0,0,0|2,0,0]=4 770 B9R1.15 CCC1=NCCCC1=O Amb24478584 [2,0,0,0,0,0|1,0,1]=4 771 B9R1.15 CCC1CCCCC1=O Amb22002104 [2,0,0,0,0,0|0,0,2]=4 772 B9R1.15 CCN1CCCCC1=O Amb22394930 [2,0,0,0,0,0|1,0,1]=4 773 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [2,0,0,0,0,0|0,0,2]=4 774 B9R1.15 CC[C@H]1CCCCC1=O Amb25093777 [2,0,0,0,0,0|0,0,2]=4 775 B9R1.15 CNC1=CCCCC1=O Amb25743372 [2,0,0,0,0,0|1,0,1]=4 776 B9R1.15 COC1=CCCCC1=O Amb22755964 [2,0,0,0,0,0|1,0,1]=4 777 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [2,0,0,0,0,0|1,0,1]=4 778 B9R1.15 CSC1CCCCC1=O Amb19267090 [2,0,0,0,0,0|1,0,1]=4 779 B9R1.15 C\C=C/1\CCCCC1=O Amb24571944 [2,0,0,0,0,0|0,0,0]=2 780 B9R1.15 C\C=C/1\CCCCC1Br Amb25268720 [2,0,0,0,0,0|1,0,1]=4 781 B9R1.15 C\C=C/1\CCCCC1C Amb25233583 [2,0,0,0,0,0|1,0,1]=4 782 B9R1.15 C\C=C/1\CCCCC1O Amb24423432 [2,0,0,0,0,0|0,0,2]=4 783 B9R1.15 C\C=C/1\CCCC[C@@H]1O Amb25686294 [2,0,0,0,0,0|0,0,2]=4 784 B9R1.15 C\C=C/1\CCCC[C@H]1O Amb25271855 [2,0,0,0,0,0|0,0,2]=4 785 B9R1.15 C\C=C/1\CCOCC1=O Amb24722942 [2,0,0,0,0,0|1,0,0]=3 786 B9R1.15 C\C=C\1/CCC=CC1=O Amb25718019 [2,0,0,0,0,0|0,0,2]=4 787 B9R1.15 C\C=C\1/CCCCC1=O Amb10558348 [2,0,0,0,0,0|0,0,0]=2 788 B9R1.15 C\C=C\1/CCCCC1N Amb24340330 [2,0,0,0,0,0|1,0,1]=4 789 B9R1.15 N\C=C/1\CCCCC1=O Amb25146068 [2,0,0,0,0,0|1,0,0]=3 790 B9R1.15 N\N=C/1\CCCCC1=O Amb24737465 [2,0,0,0,0,0|2,0,0]=4 791 B9R1.15 O=C/1CCCC\C1=C/Cl Amb25725028 [2,0,0,0,0,0|1,0,0]=3 792 B9R1.15 O=C1CCCC=C1C=O Amb18642171 [2,0,0,0,0,0|1,0,1]=4 793 B9R1.15 O=C1CCCCC1=C=O Amb24467734 [2,0,0,0,0,0|1,0,1]=4 794 B9R1.15 O=CC1CCCCC1=O Amb19651323 [2,0,0,0,0,0|1,0,1]=4 795 B9R1.15 O=CC=1CCCCC1Br Amb18522186 [2,0,0,0,0,0|2,0,0]=4 796 B9R1.15 ON=C1CCCCC1=O Amb24740156 [2,0,0,0,0,0|2,0,0]=4 797 B9R1.15 O\C=C/1\CSCCC1=O Amb24736136 [2,0,0,0,0,0|2,0,0]=4 798 B9R1.15 O\N=C\1/CCCCC1=O Amb24360571 [2,0,0,0,0,0|2,0,0]=4 799 B9R1.15 [N-]=[N+]=C1CCCCC1=O Amb25074525 [2,0,0,0,0,0|2,0,0]=4 800 B9R1.15 [O-]C=C1CCCCC1=O Amb19329219 [2,0,0,0,0,0|1,0,0]=3 801 B9R1.15 [O-]\C=C/1\COCCC1=O Amb25740627 [2,0,0,0,0,0|2,0,0]=4 802 B9R1.69 C=C1CC(=O)C(=C)CC1 Amb25759622 [2,0,0,0,0,0|0,0,2]=4 803 B9R1.69 CC1=CCC(O)CC1=O Amb25298400 [2,0,0,0,0,0|1,0,1]=4 804 B9R1.69 CC1=CC[C@@H](C)CC1=O Amb25749539 [2,0,0,0,0,0|0,0,1]=3 805 B9R1.69 CC1CC(=O)C(=O)CC1 Amb25735257 [2,0,0,0,0,0|1,0,0]=3 806 B9R1.69 CC1CC(=O)C(C)CC1 Amb22228357 [2,0,0,0,0,0|0,0,1]=3 807 B9R1.69 CC1CC(=O)C(N)CC1 Amb25291675 [2,0,0,0,0,0|1,0,1]=4 808 B9R1.69 CC1CC(=O)N(O)CC1 Amb25146341 [2,0,0,0,0,0|2,0,0]=4 809 B9R1.69 CC1CC(C)C(=C)CC1 Amb25712253 [2,0,0,0,0,0|1,0,1]=4 810 B9R1.69 CC1CC(Cl)C(=C)CC1 Amb24453376 [2,0,0,0,0,0|1,0,1]=4 811 B9R1.69 CC1CCC(=O)C(=C)C1 Amb25686144 [2,0,0,0,0,0|2,0,0]=4 812 B9R1.69 CC1CCC(=O)C(=O)N1 Amb24745568 [2,0,0,0,0,0|2,0,0]=4 813 B9R1.69 CC1CCC(=O)C(=O)O1 Amb24621712 [2,0,0,0,0,0|2,0,0]=4 814 B9R1.69 CC1CCC(C)NC1=O Amb25692572 [2,0,0,0,0,0|1,0,1]=4 815 B9R1.69 CC1COC(C)CC1=O Amb22750432 [2,0,0,0,0,0|1,0,1]=4 816 B9R1.69 CC=1CC(Br)CCC1C Amb24480291 [2,0,0,0,0,0|2,0,0]=4 817 B9R1.69 CC=1CCC(=C)C(=O)C1 Amb25133380 [2,0,0,0,0,0|0,0,2]=4 818 B9R1.69 CC=1CCN(C)CC1Br Amb25838377 [2,0,0,0,0,0|2,0,0]=4 819 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [2,0,0,0,0,0|2,0,0]=4 820 B9R1.69 C[C@@H]1CC(=O)[C@@H](Br)CC1 Amb23592295 [2,0,0,0,0,0|1,0,1]=4 821 B9R1.69 C[C@@H]1CC(=O)[C@@H](C)CC1 Amb24619935 [2,0,0,0,0,0|0,0,1]=3 822 B9R1.69 C[C@@H]1CC(=O)[C@H](Cl)CC1 Amb24694008 [2,0,0,0,0,0|1,0,1]=4 823 B9R1.69 C[C@@H]1CC[C@@H](O)CC1=O Amb24602949 [2,0,0,0,0,0|1,0,1]=4 824 B9R1.69 C[C@@H]1CC[C@H](O)CC1=O Amb25205775 [2,0,0,0,0,0|1,0,1]=4 825 B9R1.69 C[C@@H]1CN[C@@H](C)CC1=O Amb24612412 [2,0,0,0,0,0|1,0,1]=4 826 B9R1.69 C[C@H]1CC(=C)[C@@H](C)CC1 Amb24603024 [2,0,0,0,0,0|1,0,1]=4 827 B9R1.69 C[C@H]1CC(=O)C(Br)CC1 Amb25774507 [2,0,0,0,0,0|1,0,1]=4 828 B9R1.69 C[C@H]1CC(=O)C(F)CC1 Amb24690818 [2,0,0,0,0,0|1,0,1]=4 829 B9R1.69 C[C@H]1CC(=O)[C@H](Br)CC1 Amb25366783 [2,0,0,0,0,0|1,0,1]=4 830 B9R1.69 C[C@H]1CC(Cl)C(=C)CC1 Amb25116271 [2,0,0,0,0,0|1,0,1]=4 831 B9R1.69 C[C@H]1CC[C@H](O)CC1=O Amb24512547 [2,0,0,0,0,0|1,0,1]=4 832 B9R1.69 C[C@H]1C[C@@H](O)C(=C)CC1 Amb25176540 [2,0,0,0,0,0|0,0,2]=4 833 B11R0.6 CC(=CCC\C(=C\C(=O)C)\C)C Amb17594144 [0,1,1,0,0,0|0,0,2]=4 834 B11R0.6 CC(C)=CCCC(C)CC([O-])=O Amb22641878 [0,1,1,0,0,0|0,0,0]=2 835 B11R0.6 CC(C)=CCCC(C)OC(C)=O Amb22495519 [0,1,1,0,0,0|1,0,0]=3 836 B11R0.6 CC(C)=CCC[C@@H](C)CC(O)=O Amb22338417 [0,1,1,0,0,0|0,0,0]=2 837 B11R0.6 CC(C)=CCC[C@H](C)CC(O)=O Amb22336425 [0,1,1,0,0,0|0,0,0]=2 838 B11R0.45 COC(CC=O)C#CC=C(C)C Amb25066300 [0,1,1,0,0,0|0,0,2]=4 839 B11R0.45 CO[C@H](CC=O)C#CC=C(C)C Amb25053142 [0,1,1,0,0,0|0,0,2]=4 840 B11R0.174 CC(CCO)CC\C=C(\C)/CO Amb22546740 [0,1,1,0,0,0|0,0,2]=4 841 B11R0.92 CC(C)=C(C)C(=O)NC(C)C#N Amb25154605 [0,1,1,0,0,0|1,0,1]=4 842 B11R0.92 CC(C)=C(C)C(=O)NC(C)CC Amb25154630 [0,1,1,0,0,0|1,0,0]=3 843 B11R0.92 CC(C)=C(C)C(=O)NC(C)CO Amb25792109 [0,1,1,0,0,0|1,0,0]=3 844 B11R0.92 CC(C)=C(C)C(=O)N[C@@H](C)C#N Amb24572142 [0,1,1,0,0,0|1,0,1]=4 845 B11R0.92 CC(C)=C(C)C(=O)N[C@H](C)C#N Amb24631735 [0,1,1,0,0,0|1,0,1]=4 846 B11R0.92 CC(C)=C(C)C(=O)N[C@H](C)CN Amb25143105 [0,1,1,0,0,0|1,0,0]=3 847 B11R0.92 CC(C)=C(C)C(=O)OC(C)C#N Amb24465980 [0,1,1,0,0,0|1,0,1]=4 848 B11R0.92 CC(C)=C(F)C(=O)NC(C)CC Amb25154631 [0,1,1,0,0,0|2,0,0]=4 849 B11R0.92 CC(C)=C(F)C(=O)NC(C)CF Amb25284160 [0,1,1,0,0,0|2,0,0]=4 850 B11R0.92 CC(C)=C(F)C(=O)N[C@@H](C)CN Amb24388312 [0,1,1,0,0,0|2,0,0]=4 851 B11R0.206 CC(C)=C(C)C(=O)N(C)C(C)C Amb24354796 [0,1,1,0,0,0|1,0,0]=3 852 B11R0.206 CC(C)=C(F)C(=O)N(C)C(C)C Amb25285450 [0,1,1,0,0,0|2,0,0]=4 853 B11R0.153 CCCCCC(C(C)=O)C(C)=O Amb17674270 [0,1,1,0,0,0|1,0,1]=4 854 B11R0.167 CCCCC(C(=O)OC)N(C)C Amb24116644 [0,1,1,0,0,0|1,0,1]=4 855 B11R0.19 CC(C)=CC(=O)NC(CC)C#C Amb24471770 [0,1,1,0,0,0|1,0,1]=4 856 B11R0.19 CC(C)=CC(=O)NC(CC)C#N Amb24465843 [0,1,1,0,0,0|1,0,1]=4 857 B11R0.19 CC(C)=CC(=O)N[C@H](CC)C#N Amb25711986 [0,1,1,0,0,0|1,0,1]=4 858 B11R0.33 CC(C)=CC(=O)NC(C)C(C)N Amb25177696 [0,1,1,0,0,0|1,0,0]=3 859 B11R0.33 CC(C)=CC(=O)NC(C)C(C)O Amb24672314 [0,1,1,0,0,0|1,0,0]=3 860 B11R0.33 CC(C)=CC(=O)\C=C(/C)\C(C)C Amb24620053 [0,1,1,0,0,0|0,0,2]=4 861 B11R0.33 CC(C)=CC(=O)\C=C(\C)/C(C)C Amb24722756 [0,1,1,0,0,0|0,0,2]=4 862 B11R0.300 CC(C)=CC(=O)NC(C)(C)CC Amb25732866 [0,1,1,0,0,0|1,0,0]=3 863 B11R0.300 CC(C)=CC(=O)NC(C)(C)CN Amb18631657 [0,1,1,0,0,0|2,0,0]=4 864 B11R0.57 CC(C)=C(OCC)C(=O)C#CC Amb25044330 [0,1,1,0,0,0|0,0,2]=4 865 B11R1.3 CC(=O)C=1CCC(CC1)C#N Amb25151470 [1,1,0,0,0,0|1,0,1]=4 866 B11R1.3 CC(=O)C=1CCC(CC1)C=O Amb18125413 [1,1,0,0,0,0|1,0,1]=4 867 B11R1.3 CC(=O)C=1CCN(CC1)CC Amb24581237 [1,1,0,0,0,0|2,0,0]=4 868 B11R1.3 CC(C)=C1CCC(CC1)C=O Amb24737396 [1,1,0,0,0,0|0,0,2]=4 869 B11R1.3 CC(C)C=1CCC(CC1)C=O Amb18125485 [1,1,0,0,0,0|0,0,2]=4 870 B11R1.3 CC(O)C=1CCC(CC1)CN Amb18644758 [1,1,0,0,0,0|1,0,1]=4 871 B11R1.3 NCC1CCC(=CC1)C(=O)O Amb17608157 [1,1,0,0,0,0|2,0,0]=4 872 B11R1.19 CC(C)(C)C=1CCC(N)CC1 Amb24719973 [1,1,0,0,0,0|1,0,1]=4 873 B11R1.19 CC(C)(C)C=1CCC(O)CC1 Amb24593573 [1,1,0,0,0,0|1,0,1]=4 874 B11R1.19 CC1CC=C(CC1)C(C)(C)O Amb24575146 [1,1,0,0,0,0|0,0,1]=3 875 B11R1.19 CC1CCC(=CC1)C(S)(C)C Amb16232214 [1,1,0,0,0,0|0,0,1]=3 876 B11R1.21 CC(=C)C=1CC[C@@H](C)[C@H](O)C1 Amb24618727 [1,1,0,0,0,0|0,0,1]=3 877 B11R1.21 CC(=O)C=1C[C@H](O)[C@@H](O)CC1 Amb25262705 [1,1,0,0,0,0|2,0,0]=4 878 B11R1.21 CC(C)=C1CC(=O)[C@H](C)CC1 Amb24486429 [1,1,0,0,0,0|0,0,2]=4 879 B11R1.21 CC(C)C=1CC(=O)C(C)CC1 Amb24558274 [1,1,0,0,0,0|0,0,2]=4 880 B11R1.21 CC(C)C=1CC(=O)[C@@H](C)CC1 Amb24707699 [1,1,0,0,0,0|0,0,2]=4 881 B11R1.21 CC(C)C=1CC(O)C(C)CC1 Amb24404641 [1,1,0,0,0,0|0,0,1]=3 882 B11R1.21 CC(C)C=1CC[C@@H](C)C(O)C1 Amb24661203 [1,1,0,0,0,0|0,0,1]=3 883 B11R1.21 CC(C)C=1CC[C@@H](C)[C@H](O)C1 Amb25333608 [1,1,0,0,0,0|0,0,1]=3 884 B11R1.21 CC(C)C=1CC[C@H](C)C(=O)C1 Amb25151441 [1,1,0,0,0,0|0,0,2]=4 885 B11R1.21 CC1CCC(=CC1=O)N(C)C Amb24583095 [1,1,0,0,0,0|1,0,1]=4 886 B11R1.21 O=C1C=C(CCC1C)C(C)C Amb17593805 [1,1,0,0,0,0|0,0,2]=4 887 B11R1.22 CC(=NO)C=1CCN(C)CC1 Amb25376021 [1,1,0,0,0,0|2,0,0]=4 888 B11R1.22 CC(C=O)=C1CCC(C)CC1 Amb24640095 [1,1,0,0,0,0|0,0,2]=4 889 B11R1.22 CC(C=O)C=1CCC(C)CC1 Amb24707128 [1,1,0,0,0,0|0,0,2]=4 890 B11R1.22 CC(CC)=C1CCC(N)CC1 Amb25698113 [1,1,0,0,0,0|1,0,1]=4 891 B11R1.22 CC(CC)=C1CNC(C)CC1 Amb24569110 [1,1,0,0,0,0|1,0,1]=4 892 B11R1.22 CC(CO)C=1CCN(C)CC1 Amb25149754 [1,1,0,0,0,0|1,0,1]=4 893 B11R1.22 CC1CCC(CC1)=C(F)CO Amb25188686 [1,1,0,0,0,0|1,0,1]=4 894 B11R1.22 CCC(=O)C=1CCC(C)CC1 Amb24707011 [1,1,0,0,0,0|1,0,0]=3 895 B11R1.22 CN1CCC(=CC1)C(=O)OC Amb24126302 [1,1,0,0,0,0|2,0,0]=4 896 B11R1.22 COC(=O)C1=CCN(CC1)C Amb13952488 [1,1,0,0,0,0|2,0,0]=4 897 B11R1.22 COC(=O)C=1CNC(C)CC1 Amb18125872 [1,1,0,0,0,0|2,0,0]=4 898 B11R1.22 C[C@@H]1CCC(=CC1)[C@@H](C)CO Amb25176968 [1,1,0,0,0,0|0,0,1]=3 899 B11R1.727 CC(=C1CCC(CC1)(C)O)C Amb17593868 [1,1,0,0,0,0|0,0,1]=3 900 B11R1.727 CC(=O)C=1CC[N+](C)(C)CC1 Amb22482000 [1,1,0,0,0,0|2,0,0]=4 901 B11R1.727 CC(C1=CCC(CC1)(C)O)C Amb17593869 [1,1,0,0,0,0|0,0,1]=3 902 B11R1.727 CC(O)C=1CCC(C)(C)CC1 Amb25188565 [1,1,0,0,0,0|1,0,1]=4 903 B11R1.81 CC1CC(=O)N(CC=O)CC1 Amb25766011 [1,1,0,0,0,0|2,0,0]=4 904 B11R1.81 CC1CC(=O)N(CCS)CC1 Amb24741149 [1,1,0,0,0,0|1,0,1]=4 905 B11R1.81 CC1CC(O)C(CC1)=CCO Amb25152080 [1,1,0,0,0,0|0,0,2]=4 906 B11R1.81 CC1CC=C(CC=C)C(=O)C1 Amb24676913 [1,1,0,0,0,0|0,0,2]=4 907 B11R1.81 CC1CCC(CCC)C(=O)C1 Amb25123028 [1,1,0,0,0,0|0,0,2]=4 908 B11R1.81 CC1CCC(COC)C(=O)C1 Amb25188857 [1,1,0,0,0,0|0,0,2]=4 909 B11R1.81 C[C@@H]1CC=C(CC=C)C(=O)C1 Amb24334803 [1,1,0,0,0,0|0,0,2]=4 910 B11R1.81 C[C@H]1CC=C(CC=C)C(=O)C1 Amb25051927 [1,1,0,0,0,0|0,0,2]=4 911 B11R1.81 C[C@H]1C[C@@H](O)C(CC1)=CCO Amb24588402 [1,1,0,0,0,0|0,0,2]=4 912 B11R1.277 CC1CC(=O)\C(\CN1C)=C\O Amb24099485 [1,1,0,0,0,0|2,0,0]=4 913 B11R1.277 CC1CC(C=O)C(=O)CC1C Amb25857404 [1,1,0,0,0,0|1,0,1]=4 914 B11R1.278 CC1C(C)CC\C(=C/O)\C1=O Amb25188751 [1,1,0,0,0,0|1,0,0]=3 915 B11R1.278 CC1CCC(C=O)C(=O)C1C Amb24422437 [1,1,0,0,0,0|1,0,1]=4 916 B11R1.278 CC=1C(O)C(C)CCC1C=C Amb24719684 [1,1,0,0,0,0|1,0,1]=4 917 B11R1.278 C[C@@H]1[C@@H](C)CC\C(=C/O)\C1=O Amb25319911 [1,1,0,0,0,0|1,0,0]=3 918 B11R1.279 CCC1CCC(=CC)C(=O)O1 Amb24693350 [1,1,0,0,0,0|1,0,0]=3 919 B11R1.279 CCC1CC\C(=C\C)\C(=O)O1 Amb24504930 [1,1,0,0,0,0|1,0,0]=3 920 B11R1.279 CCN1CCC(CC1=O)NC Amb25083529 [1,1,0,0,0,0|1,0,1]=4 921 B11R1.279 CCN1CCC(CN)CC1=O Amb23586211 [1,1,0,0,0,0|1,0,1]=4 922 B11R1.279 CC[C@@H]1CC=C(CC)C(=O)C1 Amb25838445 [1,1,0,0,0,0|0,0,2]=4 923 B11R1.279 COC1CC=C(OC)C(=O)C1 Amb25151488 [1,1,0,0,0,0|1,0,1]=4 924 B11R1.390 CC1(C)CC(=O)C(CC1)C=O Amb24664060 [1,1,0,0,0,0|1,0,1]=4 925 B11R1.390 CC1(C)CC(=O)\C(\CO1)=C/[O-] Amb25735803 [1,1,0,0,0,0|2,0,0]=4 926 B11R1.390 CC1(C)CC=C(OC)C(=O)C1 Amb22170425 [1,1,0,0,0,0|1,0,1]=4 927 B11R1.390 CC1(C)CCC(C=O)=C(Cl)C1 Amb24357124 [1,1,0,0,0,0|2,0,0]=4 928 B11R1.390 CC1(C)CC\C(=C\O)\C(=O)C1 Amb25713639 [1,1,0,0,0,0|1,0,0]=3 929 B11R1.390 CC=1CC(C)(C)CCC1C=O Amb18125494 [1,1,0,0,0,0|2,0,0]=4 930 B11R1.390 CC=1CC(C)(O)CCC1C=O Amb18644657 [1,1,0,0,0,0|2,0,0]=4 931 B11R1.464 CC1CC(=O)C(=C[O-])C(=O)C1 Amb25345925 [1,1,0,0,0,0|1,0,1]=4 932 B11R1.464 CC1CC(C)C(=CO)C(=O)O1 Amb24565896 [1,1,0,0,0,0|2,0,0]=4 933 B11R1.464 CC1CC(C)\C(=C/O)\C(=O)O1 Amb24379403 [1,1,0,0,0,0|2,0,0]=4 934 B11R1.464 C[C@@H]1C[C@@H](O)\C(=C/C)\[C@@H](C)C1 Amb24752234 [1,1,0,0,0,0|0,0,2]=4 935 B11R1.1047 CC[C@@]1(C)CC[C@@H](C)CC1=O Amb24642016 [1,1,0,0,0,0|0,0,2]=4 936 B11R1.53 CC(=O)C=1CCCCC1C=C Amb25730183 [1,1,0,0,0,0|2,0,0]=4 937 B11R1.53 CC(=O)C=1CCCCC1NC Amb25027923 [1,1,0,0,0,0|2,0,0]=4 938 B11R1.53 CC(=O)C=1CCCCC1OC Amb25053087 [1,1,0,0,0,0|1,0,1]=4 939 B11R1.53 CC(=O)C=1CCCCC1SC Amb25735111 [1,1,0,0,0,0|1,1,0]=4 940 B11R1.87 CC(C)(C)[C@@H]1CCCCC1=O Amb25203905 [1,1,0,0,0,0|0,0,2]=4 941 B11R1.87 CC(C)(O)C1CCCCC1=O Amb25712921 [1,1,0,0,0,0|0,0,2]=4 942 B11R1.87 C[Si](C)(C)C1=CCCCC1=O Amb25231994 [1,1,0,0,0,0|0,1,1]=4 943 B11R1.87 O=C1CCCCN1[Si](C)(C)C Amb17621076 [1,1,0,0,0,0|1,1,0]=4 944 B11R1.156 CC(=O)C1=C(Cl)CCCC1=O Amb24486214 [1,1,0,0,0,0|1,0,1]=4 945 B11R1.156 CC(=O)C1C(C)CCCC1=O Amb25848681 [1,1,0,0,0,0|1,0,1]=4 946 B11R1.156 CC(=O)C=1C(=O)CCCC1C Amb24486039 [1,1,0,0,0,0|1,0,1]=4 947 B11R1.156 CC(=O)C=1C(C)CCCC1O Amb25355109 [1,1,0,0,0,0|1,0,1]=4 948 B11R1.156 CC(=O)N1C(C)CCCC1=O Amb25361534 [1,1,0,0,0,0|2,0,0]=4 949 B11R1.156 CC(=O)[C@H]1[C@@H](C)CCCC1=O Amb24582476 [1,1,0,0,0,0|1,0,1]=4 950 B11R1.156 CC(C)=C1[C@H](C)CCCC1=O Amb24662344 [1,1,0,0,0,0|0,0,0]=2 951 B11R1.156 CC(C)C1=C(O)CCCC1=O Amb24485836 [1,1,0,0,0,0|0,0,2]=4 952 B11R1.156 CC(C)C1C(C)CCCC1=O Amb25188741 [1,1,0,0,0,0|0,0,2]=4 953 B11R1.156 CC(C)[C@H]1[C@H](C)CCCC1=O Amb24512572 [1,1,0,0,0,0|0,0,2]=4 954 B11R1.156 CC(O)=C1C(C)CCCC1=O Amb25327766 [1,1,0,0,0,0|1,0,0]=3 955 B11R1.156 CC=1CCCC(=O)C1C(C)C Amb25707022 [1,1,0,0,0,0|0,0,2]=4 956 B11R1.156 CC=1CCCC(O)C1C(C)C Amb25808609 [1,1,0,0,0,0|1,0,1]=4 957 B11R1.159 CC(=O)C1CCCC(C)C1=O Amb24486458 [1,1,0,0,0,0|1,0,1]=4 958 B11R1.159 CC(=O)C=1CCCC(Br)C1O Amb24741849 [1,1,0,0,0,0|1,0,1]=4 959 B11R1.159 CC(=O)C=1CCCC(C)C1O Amb24466725 [1,1,0,0,0,0|1,0,1]=4 960 B11R1.159 CC(C)N1CCCC(Br)C1=O Amb20623768 [1,1,0,0,0,0|1,0,1]=4 961 B11R1.159 CC=1C(O)CCCC1C(C)=O Amb24621686 [1,1,0,0,0,0|2,0,0]=4 962 B11R1.159 CN(C)N1CCCC(Br)C1=O Amb25291885 [1,1,0,0,0,0|2,0,0]=4 963 B11R1.159 CN(C)N1CCCC(N)C1=O Amb25302801 [1,1,0,0,0,0|2,0,0]=4 964 B11R1.167 CC(=C)C1CC(C)CCC1=O Amb25151636 [1,1,0,0,0,0|0,0,2]=4 965 B11R1.167 CC(=O)C1CC(C)CCC1=O Amb18796760 [1,1,0,0,0,0|1,0,1]=4 966 B11R1.167 CC(=O)C=1CC(C)CCC1S Amb25373268 [1,1,0,0,0,0|1,1,0]=4 967 B11R1.167 CC(=O)N1CC(C)CCC1=O Amb25053361 [1,1,0,0,0,0|2,0,0]=4 968 B11R1.167 CC(C)C1C[C@@H](C)CCC1=O Amb24486431 [1,1,0,0,0,0|0,0,2]=4 969 B11R1.167 CC(C)N1CC(N)CCC1=O Amb19372914 [1,1,0,0,0,0|1,0,1]=4 970 B11R1.167 CC(C)[C@@H]1C[C@@H](C)CCC1=O Amb24594194 [1,1,0,0,0,0|0,0,2]=4 971 B11R1.167 CC=1CCC(O)CC1C(C)C Amb25807956 [1,1,0,0,0,0|1,0,1]=4 972 B11R1.167 C\C(\Cl)=C\1/CC(Cl)CNC1=O Amb24487794 [1,1,0,0,0,0|2,0,0]=4 973 B11R1.167 C\C(\N)=C\1/CC(C)CNC1=O Amb25108012 [1,1,0,0,0,0|2,0,0]=4 974 B11R1.222 CC(=C=C)C1=CCCCC1=O Amb24416718 [1,1,0,0,0,0|0,0,2]=4 975 B11R1.222 CC(CN)N1CCCCC1=O Amb18251503 [1,1,0,0,0,0|1,0,1]=4 976 B11R1.222 CC(CO)N1CCCCC1=O Amb24486729 [1,1,0,0,0,0|1,0,1]=4 977 B11R1.222 CC(NC)=C1CCCOC1=O Amb24596991 [1,1,0,0,0,0|1,0,0]=3 978 B11R1.222 CC(OC)=C1CCCCC1=O Amb24612705 [1,1,0,0,0,0|0,0,0]=2 979 B11R1.222 CC=1CCCCC1C(=O)CC Amb25713628 [1,1,0,0,0,0|2,0,0]=4 980 B11R1.222 CC=1CCCCC1C(=O)OC Amb24593167 [1,1,0,0,0,0|2,0,0]=4 981 B11R1.222 CCC(=O)C=1CCCCC1Cl Amb25094428 [1,1,0,0,0,0|2,0,0]=4 982 B11R1.222 CCC(=S)C1CCCCC1=O Amb24448972 [1,1,0,0,0,0|1,0,1]=4 983 B11R1.222 CC\C(\S)=C\1/CCCCC1=O Amb24486385 [1,1,0,0,0,0|1,0,0]=3 984 B11R1.222 CNC(=O)C1CCCCC1=O Amb24440934 [1,1,0,0,0,0|1,0,1]=4 985 B11R1.222 CNC(=O)C=1CCCCC1Cl Amb25284120 [1,1,0,0,0,0|2,0,0]=4 986 B11R1.222 CNC(=S)C1CCCCC1=O Amb24728258 [1,1,0,0,0,0|1,0,1]=4 987 B11R1.222 COC(=O)[C@H]1CCCCC1=O Amb24564878 [1,1,0,0,0,0|1,0,1]=4 988 B11R1.222 C[C@@H](CO)N1CCCCC1=O Amb25341831 [1,1,0,0,0,0|1,0,1]=4 989 B11R1.222 C\C(\C#N)=C/1\CCCCC1=O Amb18125004 [1,1,0,0,0,0|0,0,1]=3 990 B11R1.222 C\C(\CC)=C/1\CCCCC1=O Amb25795680 [1,1,0,0,0,0|0,0,0]=2 991 B11R1.222 C\C(\NC)=C\1/CCCCC1=O Amb25044777 [1,1,0,0,0,0|0,0,0]=2 992 B11R1.222 C\C(\OC)=C\1/CCCCC1=O Amb24364085 [1,1,0,0,0,0|0,0,0]=2 993 B11R1.222 C\C(\SC)=C/1\CCC=CC1=O Amb25768436 [1,1,0,0,0,0|0,0,2]=4 994 B11R1.222 C\C(\SC)=C/1\CCCCC1=O Amb24583618 [1,1,0,0,0,0|0,0,0]=2 995 B11R1.222 NCC(=O)N1CCCCC1=O Amb24486473 [1,1,0,0,0,0|2,0,0]=4 996 B11R1.222 OCC(=O)N1CCCCC1=O Amb25152798 [1,1,0,0,0,0|2,0,0]=4 997 B11R1.520 CC(=C)C1(C)CCCCC1=O Amb24467050 [1,1,0,0,0,0|0,0,2]=4 998 B11R1.520 CC(=C)[C@@]1(C)CCCCC1=O Amb24486400 [1,1,0,0,0,0|0,0,2]=4 999 B11R1.520 CC(=O)C1(F)CCCCC1=O Amb25073186 [1,1,0,0,0,0|1,0,1]=4 1000 B11R1.520 CC(=O)C1(O)CCCCC1=O Amb24486413 [1,1,0,0,0,0|1,0,1]=4 1001 B11R1.520 CC(=O)[C@@]1(O)CCCCC1=O Amb25050213 [1,1,0,0,0,0|1,0,1]=4 1002 B11R1.520 O=C1CCCCC1(C)C(=O)C Amb17593849 [1,1,0,0,0,0|1,0,1]=4 1003 B11R1.50 CC(C)=C1CC(CO)OC1=O Amb25220504 [0,1,0,0,1,0|1,0,0]=3 1004 B11R1.50 CC(C)=C1C[C@@H](CO)OC1=O Amb25306621 [0,1,0,0,1,0|1,0,0]=3 1005 B11R1.50 CC(C)=C1OC(CC1=O)C=C Amb25249739 [0,1,0,0,1,0|1,0,1]=4 1006 B11R1.50 CC(C)=C1OC(CC1=O)CC Amb24484581 [0,1,0,0,1,0|1,0,0]=3 1007 B11R1.50 CC(C)=C1O[C@H](CC1=O)CC Amb24485908 [0,1,0,0,1,0|1,0,0]=3 1008 B11R1.50 CC(C)N1CC(CC1=O)NC Amb25848602 [0,1,0,0,1,0|1,0,1]=4 1009 B11R1.50 CN(C)N1CC(CO)CC1=O Amb25369143 [0,1,0,0,1,0|2,0,0]=4 1010 B11R1.225 CC1CC(=O)N(C1)C(=O)CCl Amb24643639 [0,1,0,0,1,0|2,0,0]=4 1011 B11R1.225 CNC(N)=C1CC(C)OC1=O Amb25223784 [0,1,0,0,1,0|2,0,0]=4 1012 B11R1.488 CC(=C)C1CC(C)(C)CC1=O Amb25735778 [0,1,0,0,1,0|0,0,2]=4 1013 B11R1.488 CC(=O)C1CC(C)(C)CC1=O Amb25358988 [0,1,0,0,1,0|1,0,1]=4 1014 B11R1.488 CC(C)=C1CC(C)(C)CC1O Amb24487706 [0,1,0,0,1,0|0,0,2]=4 1015 B11R1.488 CC(C)=C1CC(C)(C)NC1=O Amb25189220 [0,1,0,0,1,0|1,0,0]=3 1016 B11R1.488 CC(C)C1CC(C)(C)CC1=O Amb24662316 [0,1,0,0,1,0|0,0,2]=4 1017 B11R1.488 CC(O)=C1CC(C)(C)OC1=O Amb24747083 [0,1,0,0,1,0|2,0,0]=4 1018 B11R1.490 CC(=C)C1(C)CC(C)CC1=O Amb25717767 [0,1,0,0,1,0|0,0,2]=4 1019 B11R1.490 CC(=C)[C@@]1(C)C[C@H](C)CC1=O Amb24578305 [0,1,0,0,1,0|0,0,2]=4 1020 B11R1.673 CC(=C)[C@H]1[C@@H](C)[C@H](C)CC1=O Amb24676759 [0,1,0,0,1,0|0,0,2]=4 1021 B11R1.673 CC(=O)C=1C(=O)CC(C)C1O Amb24529704 [0,1,0,0,1,0|1,0,1]=4 1022 B11R1.64 CC(=C)C=1CCC(C)C1C=O Amb18125165 [0,1,0,0,1,0|0,0,1]=3 1023 B11R1.64 CC(C)=C1CCC(C)C1C=O Amb24676897 [0,1,0,0,1,0|0,0,1]=3 1024 B11R1.64 CC(C)=C1CC[C@@H](C)C1C=O Amb25830068 [0,1,0,0,1,0|0,0,1]=3 1025 B11R1.64 CC(C)=C1CC[C@@H](C)C1CO Amb25149727 [0,1,0,0,1,0|0,0,2]=4 1026 B11R1.64 CC(C)=C1CC[C@@H](C)[C@@H]1C=O Amb25302255 [0,1,0,0,1,0|0,0,1]=3 1027 B11R1.316 C[Si](C)(C)C1=CCC(C)C1=O Amb24608625 [0,1,0,0,1,0|0,1,1]=4 1028 B11R1.473 CC(C)N1CCC(NC)C1=O Amb18954909 [0,1,0,0,1,0|1,0,1]=4 1029 B11R1.473 CC(C)N1CCC(SC)C1=O Amb24485055 [0,1,0,0,1,0|1,0,1]=4 1030 B11R1.473 CCC1CCC(C(C)=O)=C1C Amb25059589 [0,1,0,0,1,0|2,0,0]=4 1031 B11R1.473 CN(C)N1CCC(NC)C1=O Amb25113699 [0,1,0,0,1,0|2,0,0]=4 1032 B11R1.515 CC(C)=C1C=CC(C)(C)C1=O Amb25151577 [0,1,0,0,1,0|0,0,2]=4 1033 B11R1.515 CC(C)=C1CCC(C)(C)C1=O Amb25773398 [0,1,0,0,1,0|0,0,0]=2 1034 B11R1.515 CC(C)C1CCC(C)(C)C1=O Amb25347530 [0,1,0,0,1,0|0,0,2]=4 1035 B11R1.515 CC1=C(CCC1(C)C)C(C)=O Amb24686408 [0,1,0,0,1,0|2,0,0]=4 1036 B11R1.1270 CC(C)C1(C)CCC(C)C1=O Amb24725284 [0,1,0,0,1,0|0,0,2]=4 1037 B13R1.163 C\C(\C(O)=O)=C\1/CC[C@@H](C)CC1=O Amb24651051 [0,1,0,0,0,1|2,0,0]=4 1038 B13R1.653 CC(C)CN1CCC(CC1=O)CN Amb25819828 [0,1,0,0,0,1|1,0,1]=4 1039 B13R1.2679 CC1CCN(CC(C)CCl)C(=O)C1 Amb24366207 [0,1,0,0,0,1|1,0,1]=4 1040 B13R1.2679 CCC(=O)CN1CCC(C)CC1=O Amb25708721 [0,1,0,0,0,1|2,0,0]=4 1041 B13R1.2808 CC1CC(C)C(CN(C)C)C(=O)C1 Amb25285942 [0,1,0,0,0,1|1,0,1]=4 1042 B13R1.3411 CN(C)\C=C/1\CCC(C)(C)CC1=O Amb25192689 [0,1,0,0,0,1|1,0,0]=3 1043 B13R1.165 CC(=O)C=1CCC(C)CC1C(O)=O Amb24740724 [0,2,0,0,0,0|1,0,0]=3 1044 B13R1.165 CC(C)C=1CCC(C)CC1C(N)=O Amb24490078 [0,2,0,0,0,0|0,0,1]=3 1045 B13R1.356 CC(C)C/1CCC(C)C\C1=C\C=O Amb24440993 [0,2,0,0,0,0|0,0,2]=4 1046 B13R1.356 CC(C)C=1CCC(C)CC1CCO Amb24748331 [0,2,0,0,0,0|0,0,2]=4 1047 B13R1.96 CC(C)(C)N1CCC(CN)CC1=O Amb25848333 [0,2,0,0,0,0|1,0,1]=4 1048 B13R1.3550 CC(C)(O)C1(O)CCC(C)CC1=O Amb25221954 [0,2,0,0,0,0|0,0,2]=4 1049 B13R1.4183 CC1CCC(C(=O)C1)C(C)(C)C#N Amb18648279 [0,2,0,0,0,0|0,0,2]=4 1050 B13R1.4183 CC1CCC(C(=O)C1)C(C)(C)CC Amb25827762 [0,2,0,0,0,0|0,0,2]=4 1051 B13R1.4183 CC1CCC(C(=O)C1)C(C)(C)NC Amb25180842 [0,2,0,0,0,0|0,0,2]=4 1052 B13R1.4183 CC1CCC(C(=O)C1)C(C)(C)NN Amb25377775 [0,2,0,0,0,0|0,0,2]=4 1053 B13R1.4183 CC1CCC(C(=O)C1)C(C)(C)SC Amb25061913 [0,2,0,0,0,0|0,0,2]=4 1054 B13R1.4183 C[C@H]1CC[C@@H](C(=O)C1)C(C)(C)SC Amb25175927 [0,2,0,0,0,0|0,0,2]=4 1055 B13R1.1807 CC1CC(=O)C(CC1C)C(=O)OC Amb24596527 [0,2,0,0,0,0|1,0,1]=4 1056 B13R1.7913 CC(C)C1=C[C@@H](O)C(C)(O)CC1=O Amb24495551 [0,2,0,0,0,0|0,0,2]=4 1057 B13R1.120 CC(C)=C1CCC(CC1=O)C(C)=C Amb25714395 [0,2,0,0,0,0|0,0,0]=2 1058 B13R1.120 CC(C)=C1CC[C@@H](CC1=O)C(C)=C Amb25834477 [0,2,0,0,0,0|0,0,0]=2 1059 B13R1.385 CC(C)=C1CCC(CCC)=CC1=O Amb24492513 [0,2,0,0,0,0|0,0,2]=4 1060 B13R1.3096 CC(C)C1CCC(CO)C(C)C1=O Amb24362866 [0,2,0,0,0,0|0,0,2]=4 1061 B13R1.5951 CC(C)C1CCC(C)(CC1=O)C#N Amb24494922 [0,2,0,0,0,0|0,0,2]=4 1062 B13R1.1782 COC(=O)C1CCC(C)(C)CC1=O Amb23399767 [0,2,0,0,0,0|1,0,1]=4 1063 B13R1.7992 CC(C)C1CCC(C)(O)C(Cl)C1=O Amb24757747 [0,2,0,0,0,0|0,0,2]=4 1064 B13R1.7992 CC(C)[C@@H]1CC[C@](C)(O)[C@H](O)C1=O Amb24733193 [0,2,0,0,0,0|0,0,2]=4 1065 B13R1.7992 CC(C)[C@H]1CC[C@](C)(O)[C@H](O)C1=O Amb25236053 [0,2,0,0,0,0|0,0,2]=4 1066 B13R1.8379 CC(=C1C(=O)CC(CC1=O)(C)C)O Amb2503939 [0,2,0,0,0,0|1,0,1]=4 1067 B13R1.8379 CC(C)=C1C(=O)CC(C)(C)CC1=O Amb22496619 [0,2,0,0,0,0|0,0,1]=3 1068 B13R1.890 CC(C)=C1CCC(C)C(C)(C)C1O Amb25105885 [0,2,0,0,0,0|0,0,2]=4 1069 B13R1.890 CC(C)=C1CC[C@@H](C)C(C)(C)[C@H]1O Amb24618830 [0,2,0,0,0,0|0,0,2]=4 1070 B13R1.3230 CC(C)=C1CCC(C)C(C=O)C1=O Amb25723321 [0,2,0,0,0,0|0,0,0]=2 1071 B13R1.3230 CC(C)=C1CC[C@@H](C)C(=CO)C1=O Amb24531682 [0,2,0,0,0,0|0,0,1]=3 1072 B13R1.3230 CC(C)C1CCC(C)C(C#N)C1=O Amb24690673 [0,2,0,0,0,0|0,0,2]=4 1073 B13R1.3230 CC(C)C1CCC(C)C(C=O)C1=O Amb25190627 [0,2,0,0,0,0|0,0,2]=4 1074 B13R1.3230 CC(C)C1CCC(C)C(CN)C1=O Amb24710269 [0,2,0,0,0,0|0,0,2]=4 1075 B13R1.3230 CC(C)C1CCC(C)C(CO)C1=O Amb17777875 [0,2,0,0,0,0|0,0,2]=4 1076 B13R1.3230 CC(C)[C@@H]1CC[C@@H](C)C(C=O)C1=O Amb24744838 [0,2,0,0,0,0|0,0,2]=4 1077 B13R1.4629 COC(=O)C1(N)CCC(C)CC1=O Amb25797236 [0,2,0,0,0,0|1,0,1]=4 1078 B13R1.5943 CC(C)C1(CCC(C)CC1=O)OO Amb17757184 [0,2,0,0,0,0|0,0,2]=4 1079 B13R1.5943 CC(C)C1(CO)CCC(C)CC1=O Amb24462030 [0,2,0,0,0,0|0,0,2]=4 1080 B13R1.5943 CC(C)[C@]1(CO)CC[C@@H](C)CC1=O Amb24574726 [0,2,0,0,0,0|0,0,2]=4 1081 B13R1.4656 CC=1CC(C)CC(=O)C1C(=O)OC Amb25276874 [0,2,0,0,0,0|1,0,1]=4 1082 B13R1.1511 CC1CC(=O)C(CC1)C(C)CC#N Amb24341394 [0,2,0,0,0,0|0,0,2]=4 1083 B13R1.1511 CC1CCC(C(=O)C1)C(=O)OCC Amb22360675 [0,2,0,0,0,0|1,0,1]=4 1084 B13R1.1511 CCOC(=O)C1=CCC(C)CC1=O Amb24406184 [0,2,0,0,0,0|1,0,1]=4 1085 B13R1.1511 CCOC(=O)C=1CCC(C)CC1N Amb25124055 [0,2,0,0,0,0|2,0,0]=4 1086 B13R1.1511 C[C@@H]1CCC(C(=O)C1)C(=O)OCC Amb24540984 [0,2,0,0,0,0|1,0,1]=4 1087 B11R1.15 CC(CC=O)C1CC(=O)CC1 Amb24724055 [0,0,1,1,0,0|1,0,1]=4 1088 B11R1.124 CC(C)=C1CC(CC=O)CC1 Amb18125479 [0,0,1,1,0,0|0,0,0]=2 1089 B11R1.124 CC(C)C1CC(CC1)CC=O Amb18644690 [0,0,1,1,0,0|0,0,2]=4 1090 B11R1.124 CC(C)C=1CC(CC=O)CC1 Amb25188591 [0,0,1,1,0,0|0,0,2]=4 1091 B11R1.124 CC(C)C=1CCC(CC=O)C1 Amb24486120 [0,0,1,1,0,0|0,0,2]=4 1092 B11R1.124 CC(C)N1CCC(C1)CC=O Amb24653892 [0,0,1,1,0,0|1,0,1]=4 1093 B11R1.157 C[C@@H]1CCO[C@@H](C1)C=C(C)C Amb22350524 [0,0,1,1,0,0|0,0,2]=4 1094 B11R1.157 C[C@@H]1CCO[C@H](C1)C=C(C)C Amb20666004 [0,0,1,1,0,0|0,0,2]=4 1095 B11R1.241 CC(C)=CCCC1OC1C=O Amb25383837 [0,0,1,1,0,0|1,0,0]=3 1096 B11R1.241 CC(C)=CCC[C@@H]1O[C@H]1C=O Amb24765272 [0,0,1,1,0,0|1,0,0]=3 1097 B11R1.342 CC1(C)CC(CC=C1)CC=O Amb18125491 [0,0,1,1,0,0|0,0,2]=4 1098 B11R1.342 CC1(C)CC(CC=O)CCO1 Amb18125996 [0,0,1,1,0,0|1,0,1]=4 1099 B11R1.424 CC1CC=CC(C)(C)C1C=O Amb25844431 [0,0,1,1,0,0|0,0,2]=4 1100 B11R1.424 CC1CCCC(C)(C)C1C=O Amb18125805 [0,0,1,1,0,0|0,0,2]=4 1101 B11R1.424 C[C@@H]1CCCC(C)(C)C1C=O Amb24752477 [0,0,1,1,0,0|0,0,2]=4 1102 B11R1.424 C[C@H]1CCCC(C)(C)[C@H]1C=O Amb24599018 [0,0,1,1,0,0|0,0,2]=4 1103 B11R1.563 C[C@@H]1CC(=O)C[C@H](C)CCC1 Amb25767101 [0,0,1,1,0,0|0,0,2]=4 1104 B11R1.564 C[C@@H]1CC(=O)C(C)(C)CCC1 Amb24340392 [0,0,1,1,0,0|0,0,2]=4 1105 B11R1.645 CC(=O)OC1CC(C)CC1=O Amb24528912 [0,0,1,1,0,0|2,0,0]=4 1106 B11R1.645 CC(C)CC1CC(C)CC1=O Amb25032525 [0,0,1,1,0,0|0,0,2]=4 1107 B11R1.645 CC(C)C[C@@H]1C[C@@H](C)CC1=O Amb25373293 [0,0,1,1,0,0|0,0,2]=4 1108 B11R1.765 CC(C)=C[C@H]1C[C@@]1(C)CCO Amb25237494 [0,0,1,1,0,0|0,0,2]=4 1109 B11R1.770 CC(=C)C1CCC1(C)CC=O Amb25150308 [0,0,1,1,0,0|0,0,2]=4 1110 B11R1.770 CC(=C)[C@@H]1CC[C@@]1(C)CC=O Amb24513214 [0,0,1,1,0,0|0,0,2]=4 1111 B11R1.770 CC(=C)[C@H]1CC[C@@]1(C)CC=O Amb25254208 [0,0,1,1,0,0|0,0,2]=4 1112 B11R1.770 CC(=O)C1CCC1(C)CC=O Amb24357228 [0,0,1,1,0,0|1,0,1]=4 1113 B11R1.1241 CC1(C)C=CCC1(C)CC=O Amb24486080 [0,0,1,1,0,0|0,0,2]=4 1114 B11R1.1241 CC1(C)CCCC1(C)CC=O Amb24456544 [0,0,1,1,0,0|0,0,2]=4 1115 B11R1.1251 CC1(CC=O)CC(=O)OCC1 Amb24422433 [0,0,1,1,0,0|2,0,0]=4 1116 B11R1.1251 C[C@]1(CC=O)CC(=O)OCC1 Amb24553570 [0,0,1,1,0,0|2,0,0]=4 1117 B11R1.149 CC(C)C(C)C(=O)C1CC1C Amb24694287 [0,0,1,1,0,0|0,0,2]=4 1118 B11R1.149 CC(C)N(C)C(=O)[C@@H]1C[C@H]1C Amb24473814 [0,0,1,1,0,0|1,0,1]=4 1119 B11R1.149 CC(C)N(C)C(=O)[C@H]1C[C@@H]1C Amb25688365 [0,0,1,1,0,0|1,0,1]=4 1120 B11R1.313 CC=1C(=O)CCC1CC(C)C Amb24614818 [0,0,1,1,0,0|2,0,0]=4 1121 B11R1.313 Cc1c(CC(C)C)o[n]c1C Amb25233266 [0,0,1,1,0,0|1,0,1]=4 1122 B11R1.325 CC1CC(=O)C(=C)C(C)(C)C1 Amb25115705 [0,0,1,1,0,0|0,0,2]=4 1123 B11R1.325 CC1CC(=O)C(C)C(C)(C)C1 Amb25373378 [0,0,1,1,0,0|0,0,2]=4 1124 B11R1.503 CC(C)=C(F)C(=O)NC1CC1 Amb25112166 [0,0,1,1,0,0|2,0,0]=4 1125 B11R1.503 CC(C)N(C)C(=O)CC1CC1 Amb24756061 [0,0,1,1,0,0|1,0,1]=4 1126 B11R1.519 CC(C)=C1CC(=C(C)C)C1=O Amb17844062 [0,0,1,1,0,0|0,0,2]=4 1127 B11R1.519 CC(C)=C1CC(C(C)C)C1=O Amb25128238 [0,0,1,1,0,0|0,0,0]=2 1128 B11R1.1263 CC(C)CC(=O)C1CC1(C)C Amb25219835 [0,0,1,1,0,0|0,0,2]=4 1129 B11R1.1361 CC1(C)CC(=O)C(=C)C(=O)C1 Amb25233578 [0,0,1,1,0,0|1,0,1]=4 1130 B11R1.1361 CC1(C)CC(=O)C(=O)C(=O)C1 Amb25807617 [0,0,1,1,0,0|2,0,0]=4 1131 B11R1.1361 CC1(C)CC(O)=C(Cl)C(=O)C1 Amb25151459 [0,0,1,1,0,0|2,0,0]=4 1132 B11R1.1361 CC1(C)CC(O)=C(F)C(=O)C1 Amb24486019 [0,0,1,1,0,0|2,0,0]=4 1133 B11R1.1361 CC1(C)CC(O)=C(O)C(=O)C1 Amb25318976 [0,0,1,1,0,0|2,0,0]=4 1134 B11R1.1361 CC1(C)CC(O)=C(S)C(=O)C1 Amb25706939 [0,0,1,1,0,0|2,0,0]=4 1135 B11R1.1361 CC1(C)CC([O-])=C(I)C(=O)C1 Amb22475903 [0,0,1,1,0,0|2,0,0]=4 1136 B11R1.1361 CC1=C(O)C(=O)CC(C)(C)C1 Amb17844351 [0,0,1,1,0,0|1,0,0]=3 1137 B11R1.1361 CC1C(=C)CC(C)(C)CC1=O Amb25298505 [0,0,1,1,0,0|0,0,2]=4 1138 B11R1.1361 CC1C(=O)CC(C)(C)CC1=O Amb24567141 [0,0,1,1,0,0|1,0,1]=4 1139 B11R1.1361 CC1CC(C)(C)CC(=O)C1C Amb25281384 [0,0,1,1,0,0|0,0,2]=4 1140 B11R1.1361 CC=1C(=O)CC(C)(C)CC1O Amb25351269 [0,0,1,1,0,0|1,0,0]=3 1141 B11R1.1361 CC=1C(=O)CC(C)(C)OC1C Amb25713537 [0,0,1,1,0,0|1,0,0]=3 1142 B11R1.1361 CC=1CC(C)(C)CC(=O)C1F Amb25808006 [0,0,1,1,0,0|1,0,0]=3 1143 B11R1.1361 CC=1CC(C)(C)CC(=O)C1N Amb24486624 [0,0,1,1,0,0|1,0,0]=3 1144 B11R1.1361 CC=1CC(C)(C)CC(=O)C1S Amb25347531 [0,0,1,1,0,0|1,0,0]=3 1145 B11R1.1361 CC=1OC(C)(C)OC(=O)C1C Amb22228220 [0,0,1,1,0,0|2,0,0]=4 1146 B11R1.1361 OC1=C(Br)C(=O)CC(C1)(C)C Amb2429351 [0,0,1,1,0,0|2,0,0]=4 1147 B11R1.143 CC(=C)C1CCCCCC1=O Amb24545434 [0,0,1,1,0,0|0,0,2]=4 1148 B11R1.143 CC(=O)C1=CCCCCC1=O Amb25244207 [0,0,1,1,0,0|1,0,1]=4 1149 B11R1.143 CC(=O)C1CCCCCC1=C Amb25767027 [0,0,1,1,0,0|0,0,2]=4 1150 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,0,1,1,0,0|1,0,1]=4 1151 B11R1.143 CC(=O)C=1SCCCCC1O Amb24551540 [0,0,1,1,0,0|2,0,0]=4 1152 B11R1.143 CC(C)C1CCCCCC1=O Amb18181912 [0,0,1,1,0,0|0,0,2]=4 1153 B11R1.143 CC(Cl)=C1CCCCCC1=O Amb24582921 [0,0,1,1,0,0|1,0,0]=3 1154 B11R1.143 CC1CCCCCN1C(C)=O Amb25323036 [0,0,1,1,0,0|1,0,1]=4 1155 B11R1.143 CN(C)C1CCCCCC1=O Amb18179607 [0,0,1,1,0,0|1,0,1]=4 1156 B11R1.143 CS(C)=C1CCCCCC1=O Amb25263072 [0,0,1,1,0,0|1,0,0]=3 1157 B11R1.143 NC(=O)C=1CCCCCC1Br Amb25113983 [0,0,1,1,0,0|2,0,0]=4 1158 B11R1.143 NC=1CCCCCC1C(O)=O Amb24620224 [0,0,1,1,0,0|2,0,0]=4 1159 B11R1.143 OC(=O)C=1CCCCCC1Br Amb25790609 [0,0,1,1,0,0|2,0,0]=4 1160 B11R1.420 CC(=O)C(CCCC)=C1CC1 Amb24766826 [0,0,1,1,0,0|0,0,0]=2 1161 B11R1.465 CC=1C=CC(=O)C1CCCC Amb24364086 [0,0,1,1,0,0|0,0,2]=4 1162 B11R1.465 CC=1CCC(=O)C1CCC=O Amb18125433 [0,0,1,1,0,0|1,0,1]=4 1163 B11R1.465 CC=1CCC(=O)C1CCOC Amb25084963 [0,0,1,1,0,0|1,0,0]=3 1164 B11R1.465 CC=1CCC(=O)C1C\C=C\C Amb22168353 [0,0,1,1,0,0|0,0,2]=4 1165 B11R1.465 CC=1CCC(=O)C1\C=C\CC Amb24533504 [0,0,1,1,0,0|0,0,2]=4 1166 B11R1.465 CC=1N=NC(=O)C1CCCC Amb24061992 [0,0,1,1,0,0|2,0,0]=4 1167 B11R1.465 CC=1NCC(=O)C1CCCC Amb24382486 [0,0,1,1,0,0|1,0,0]=3 1168 B11R1.465 CC=1NOC(=O)C1CCCC Amb24725267 [0,0,1,1,0,0|2,0,0]=4 1169 B11R1.465 CC=1ONC(=O)C1CCCC Amb22491246 [0,0,1,1,0,0|2,0,0]=4 1170 B11R1.465 CCCCC1=C(O)CCC1=O Amb25053333 [0,0,1,1,0,0|1,0,0]=3 1171 B11R1.465 CCCCC1C(=O)CCC1=O Amb25373329 [0,0,1,1,0,0|1,0,1]=4 1172 B11R1.465 CCCCC=1C(=O)CCC1Cl Amb25712995 [0,0,1,1,0,0|1,0,0]=3 1173 B11R1.465 CCCCN1C(C)CCC1=O Amb22330634 [0,0,1,1,0,0|1,0,1]=4 1174 B11R1.465 CCCCc1c(C)[nH][n]c1C Amb25792078 [0,0,1,1,0,0|2,0,0]=4 1175 B11R1.465 C\C=C/CC1=C(C)CCC1=O Amb15692779 [0,0,1,1,0,0|0,0,2]=4 1176 B11R1.475 CC(C)=C1C(CC1=O)OCC Amb24551563 [0,0,1,1,0,0|1,0,0]=3 1177 B11R1.669 CC1CCC1(C(C)=O)C(C)=O Amb25347411 [0,0,1,1,0,0|1,0,1]=4 1178 B11R1.721 CC(C)N(C1CCC1)C(C)=O Amb25822799 [0,0,1,1,0,0|1,0,1]=4 1179 B11R1.39 CC[C@@H](C)CC=1CCC(=O)C1 Amb25093623 [0,0,1,1,0,0|2,0,0]=4 1180 B11R1.43 CC(=O)C=C1CC(CC1)CC Amb24487001 [0,0,1,1,0,0|2,0,0]=4 1181 B11R1.43 CC(=O)\C=C\1/CC(CO1)CC Amb24653002 [0,0,1,1,0,0|1,0,1]=4 1182 B11R1.80 CC(=O)\C=C/1\C[C@H](C)[C@H](C)O1 Amb24551484 [0,0,1,1,0,0|1,0,1]=4 1183 B11R1.106 CC(C)NC(=O)CC1CC1C Amb25832560 [0,0,1,1,0,0|1,0,1]=4 1184 B11R1.257 CC(=C)CC(=O)C1CC1CC Amb24765653 [0,0,1,1,0,0|0,0,2]=4 1185 B11R1.257 CC(=C)CC(=O)[C@@H]1C[C@H]1CC Amb24765690 [0,0,1,1,0,0|0,0,2]=4 1186 B11R1.257 CC(C)CC(=O)C1CC1CC Amb24765670 [0,0,1,1,0,0|0,0,2]=4 1187 B11R1.257 CC(C)CC(=O)[C@@H]1C[C@H]1CC Amb24765691 [0,0,1,1,0,0|0,0,2]=4 1188 B11R1.257 CC(C)OC(=O)C1CC1CC Amb24765722 [0,0,1,1,0,0|1,0,1]=4 1189 B11R1.257 CC(C)OC(=O)[C@@H]1C[C@H]1CC Amb24765723 [0,0,1,1,0,0|1,0,1]=4 1190 B11R1.257 CC[C@@H]1C[C@H]1C(O)C=C(C)C Amb24649104 [0,0,1,1,0,0|0,0,2]=4 1191 B11R1.484 CC(C)=CC(=O)CC1CCC1 Amb25766273 [0,0,1,1,0,0|0,0,0]=2 1192 B11R1.484 CC(C)=CC(=O)CC1CNC1 Amb24334638 [0,0,1,1,0,0|1,0,0]=3 1193 B11R1.484 CC(C)=CC(=O)NC1CNC1 Amb25827868 [0,0,1,1,0,0|2,0,0]=4 1194 B11R1.484 CC(C)CC(=O)CC1CCC1 Amb25380473 [0,0,1,1,0,0|0,0,2]=4 1195 B11R1.484 CC(N)=CC(=O)OC1CCC1 Amb24538284 [0,0,1,1,0,0|2,0,0]=4 1196 B11R1.484 C\C(\N)=C\C(=O)CC1CCC1 Amb24586329 [0,0,1,1,0,0|1,0,0]=3 1197 B11R1.512 CC1CC(=O)CC(C)(C)CC1 Amb25723220 [0,0,1,1,0,0|0,0,2]=4 1198 B11R1.512 CC1CC(=O)NC(C)(C)CC1 Amb25702427 [0,0,1,1,0,0|1,0,1]=4 1199 B11R1.728 CC(C)=CC(=O)CC1(C)CC1 Amb25198031 [0,0,1,1,0,0|0,0,0]=2 1200 B11R1.728 CC(C)=CC(N)CC1(C)CC1 Amb25244251 [0,0,1,1,0,0|1,0,1]=4 1201 B11R1.728 CC(C)=CC(O)CC1(C)CC1 Amb24597913 [0,0,1,1,0,0|0,0,2]=4 1202 B11R1.815 CCC(C)CC(=O)C1CC1C Amb25382390 [0,0,1,1,0,0|0,0,2]=4 1203 B11R1.1053 CC(C)=C1C(=O)CC1(C)C=C Amb24486197 [0,0,1,1,0,0|0,0,2]=4 1204 B11R1.1180 CC1=CC(=O)CC(C)(O1)OC Amb25718272 [0,0,1,1,0,0|2,0,0]=4 1205 B11R1.1180 CC=1CC(C)(CCl)OC(=O)C1 Amb24558569 [0,0,1,1,0,0|2,0,0]=4 1206 B11R1.1180 CCC1(C)CC(=O)NC(=O)C1 Amb1154607 [0,0,1,1,0,0|2,0,0]=4 1207 B11R1.1180 CCC1(C)CC(C)CC(=O)C1 Amb25723254 [0,0,1,1,0,0|0,0,2]=4 1208 B11R1.1180 CCC1(C)CC(O)C=C(C)C1 Amb25045475 [0,0,1,1,0,0|0,0,2]=4 1209 B11R1.175 CC(=O)C=1CC(CC1)C(C)C Amb24485808 [0,0,1,1,0,0|2,0,0]=4 1210 B11R1.391 CC1CCC(C=O)=C(Cl)CC1 Amb24682673 [0,0,1,1,0,0|1,0,0]=3 1211 B11R1.66 CC1CCCCC(=O)C1CC Amb25713013 [0,0,1,1,0,0|0,0,2]=4 1212 B11R1.66 CCC1C(=O)CCCCC1=O Amb24405026 [0,0,1,1,0,0|1,0,1]=4 1213 B11R1.66 CCC1C(=O)CCCCN1C Amb25151616 [0,0,1,1,0,0|1,0,1]=4 1214 B11R1.123 Cc1[nH]cc(CCC)c1CC Amb25363367 [0,0,1,1,0,0|2,0,0]=4 1215 B11R1.199 CC1CCCC1C(=O)CCC Amb25729243 [0,0,1,1,0,0|0,0,2]=4 1216 B11R1.199 CC=1CCCC1C(=O)CCC Amb24662331 [0,0,1,1,0,0|0,0,0]=2 1217 B11R1.199 CC=1CCCC1C(=O)NOC Amb24706446 [0,0,1,1,0,0|2,0,0]=4 1218 B11R1.199 CC=1CCCC1C(=O)OCC Amb25120486 [0,0,1,1,0,0|1,0,0]=3 1219 B11R1.199 CC=1CCCC1C(=O)\C=C\C Amb24633312 [0,0,1,1,0,0|0,0,2]=4 1220 B11R1.199 CC=1NCCC1C(=O)OCC Amb24366082 [0,0,1,1,0,0|2,0,0]=4 1221 B11R1.199 CCCC(=O)C1CCCC1=O Amb17940809 [0,0,1,1,0,0|1,0,1]=4 1222 B11R1.199 CCC\C(\N)=C/1\CCCC1=O Amb25282730 [0,0,1,1,0,0|2,0,0]=4 1223 B11R1.199 CCOC(=O)C1=C(N)CCC1 Amb1993725 [0,0,1,1,0,0|2,0,0]=4 1224 B11R1.199 CCOC(=O)C=1CCCC1F Amb25837558 [0,0,1,1,0,0|2,0,0]=4 1225 B11R1.463 CC1CC(=O)C(CC)C1(C)C Amb25748971 [0,0,1,1,0,0|0,0,2]=4 1226 B11R1.463 C[C@@H]1CC(=O)[C@@H](CC)C1(C)C Amb24691736 [0,0,1,1,0,0|0,0,2]=4 1227 B11R1.463 C[C@H]1CC(=O)[C@@H](CC)C1(C)C Amb25205883 [0,0,1,1,0,0|0,0,2]=4 1228 B11R1.827 CCCC(=O)N1C(C)CC1C Amb25163098 [0,0,1,1,0,0|1,0,1]=4 1229 B11R1.978 CC=1CC(CC)C(=O)C1OC Amb24409722 [0,0,1,1,0,0|1,0,0]=3 1230 B11R1.1021 CC(C)=C(C#N)C(=O)C1CC1 Amb25334889 [0,0,1,1,0,0|1,0,1]=4 1231 B11R1.1021 CC(C)N(CC)C(=O)C1CC1 Amb25379437 [0,0,1,1,0,0|1,0,1]=4 1232 B11R2.34 NC1CCC(CC1)=C2CC2 Amb23599018 [1,0,0,1,0,0|1,0,1]=4 1233 B11R2.363 CC1CC=2NC(=O)C2CC1 Amb25122646 [1,0,0,1,0,0|2,0,0]=4 1234 B11R2.48 O=C1CC2CC=CC1CC2 Amb24478150 [1,0,0,1,0,0|0,0,2]=4 1235 B11R2.118 CC1=C[C@H]2CC(=O)[C@@H]1CC2 Amb24512762 [1,0,0,1,0,0|0,0,2]=4 1236 B11R2.118 C[C@@H]1C[C@@H]2CC(=O)[C@H]1CC2 Amb25377882 [1,0,0,1,0,0|0,0,2]=4 1237 B11R2.118 O=C1CC2CC(=O)C1CC2 Amb23453248 [1,0,0,1,0,0|1,0,1]=4 1238 B11R2.118 O=C1C[C@H]2CC(=O)[C@@H]1CC2 Amb25720661 [1,0,0,1,0,0|1,0,1]=4 1239 B11R2.125 CC1CC(=O)C2(CC1)CC2 Amb25347556 [1,0,0,1,0,0|0,0,2]=4 1240 B11R2.201 CC1CC(=O)C2CC1CC2 Amb25146657 [1,0,0,1,0,0|0,0,2]=4 1241 B11R2.201 CC1CC(=O)[C@H]2C[C@@H]1CC2 Amb24633361 [1,0,0,1,0,0|0,0,2]=4 1242 B11R2.201 C[C@@H]1CC(=O)[C@@H]2C[C@H]1CC2 Amb24725277 [1,0,0,1,0,0|0,0,2]=4 1243 B11R2.201 C[C@H]1CC(=O)[C@@H]2C[C@H]1CC2 Amb24724070 [1,0,0,1,0,0|0,0,2]=4 1244 B11R2.222 C=CC12CC(CC1=O)CC2 Amb25767774 [1,0,0,1,0,0|0,0,2]=4 1245 B11R2.222 CC[C@]12C[C@@H](CC1=O)CC2 Amb24584401 [1,0,0,1,0,0|0,0,2]=4 1246 B11R2.222 CC[C@]12C[C@H](CC1=O)CC2 Amb25238638 [1,0,0,1,0,0|0,0,2]=4 1247 B11R2.264 CCC1CCC2CC2C1=O Amb23594430 [1,0,0,1,0,0|0,0,2]=4 1248 B11R2.1 Cc1[nH]cc2CCCCc21 Amb21964112 [1,0,0,1,0,0|2,0,0]=4 1249 B11R2.1 Cc1[s]cc2CCCCc21 Amb25204266 [1,0,0,1,0,0|2,0,0]=4 1250 B11R2.1 Cc1c[nH]c2CCCCc21 Amb24437042 [1,0,0,1,0,0|1,0,1]=4 1251 B11R2.1 Cc1n[nH]c2c1CCCC2 Amb2522943 [1,0,0,1,0,0|2,0,0]=4 1252 B11R2.1 O=C1COC=2CCCCC21 Amb25087790 [1,0,0,1,0,0|1,0,1]=4 1253 B11R2.38 CC1CC12CCCCC2=O Amb25128273 [1,0,0,1,0,0|0,0,2]=4 1254 B11R2.38 C[C@@H]1CC12CCCCC2=O Amb25371899 [1,0,0,1,0,0|0,0,2]=4 1255 B11R2.38 C[C@H]1CC12CCCCC2=O Amb24690822 [1,0,0,1,0,0|0,0,2]=4 1256 B11R2.55 O=C1CCCCC1=C2CC2 Amb25730185 [1,0,0,1,0,0|0,0,0]=2 1257 B11R2.55 O=C1CCCCC1C2CC2 Amb24271138 [1,0,0,1,0,0|0,0,2]=4 1258 B11R2.116 CC1CC2CC1C(=O)CC2 Amb24736292 [1,0,0,1,0,0|0,0,2]=4 1259 B11R2.116 O=C1CC2CC1C(=O)CC2 Amb23452863 [1,0,0,1,0,0|1,0,1]=4 1260 B11R2.120 CC1CC2CCCC1C2=O Amb25372853 [1,0,0,1,0,0|0,0,2]=4 1261 B11R2.468 CC1CC2CCCC(=O)C21 Amb24614689 [1,0,0,1,0,0|0,0,2]=4 1262 B11R2.468 CC1C[C@H]2CCCC(=O)[C@H]21 Amb24600397 [1,0,0,1,0,0|0,0,2]=4 1263 B11R2.468 O=C1CC2CCCC(=O)C12 Amb24524374 [1,0,0,1,0,0|1,0,1]=4 1264 B11R2.608 CC(=O)C1=CC2CC2C1=O Amb25717927 [1,0,0,1,0,0|1,0,1]=4 1265 B11R2.732 CC1(C)C2CCC1CC2=O Amb24555284 [1,0,0,1,0,0|0,0,2]=4 1266 B11R2.732 CC1(C)[C@@H]2CC[C@@H]1CC2=O Amb24686482 [1,0,0,1,0,0|0,0,2]=4 1267 B11R2.732 CC1(C)[C@@H]2CC[C@H]1CC2=O Amb24736681 [1,0,0,1,0,0|0,0,2]=4 1268 B11R2.732 CC1(C)[C@H]2CC[C@H]1CC2=O Amb24512540 [1,0,0,1,0,0|0,0,2]=4 1269 B11R2.845 CC(C)=C1CC2CC1CC2 Amb22228862 [1,0,0,1,0,0|1,0,1]=4 1270 B11R2.1045 CC1(C)C2CCCC1C2=O Amb25725534 [1,0,0,1,0,0|0,0,2]=4 1271 B11R2.1044 CC1(C)CC2CCC1C2=O Amb24736859 [0,0,0,1,1,0|0,0,2]=4 1272 B11R2.1595 CC1CC2C(C1=O)C2(C)C Amb25373067 [0,0,0,1,1,0|0,0,2]=4 1273 B11R2.1595 CC1C[C@@H]2[C@H](C1=O)C2(C)C Amb24575942 [0,0,0,1,1,0|0,0,2]=4 1274 B11R2.1734 CC1(C)C2CCC1(C)C2=O Amb25146535 [0,0,0,1,1,0|0,0,2]=4 1275 B13R2.3683 CC1CCc2c(C1)ncc(c2)C Amb17334541 [0,0,0,1,0,1|1,0,1]=4 1276 B13R2.3683 Cc1ccc2CC(C)CCc2c1 Amb25314392 [0,0,0,1,0,1|1,0,1]=4 1277 B13R2.4670 CC(=O)C1CC2CC(=O)C1CC2 Amb25143411 [0,0,0,1,0,1|1,0,1]=4 1278 B13R2.4670 CN(C)C1CC2CC(=O)C1CC2 Amb25759576 [0,0,0,1,0,1|1,0,1]=4 1279 B13R2.5070 CC1(C)OC12CCC(C)CC2=O Amb25799476 [0,0,0,1,0,1|0,0,2]=4 1280 B13R2.5070 C[C@@H]1CCC2(C(=O)C1)OC2(C)C Amb17619652 [0,0,0,1,0,1|0,0,2]=4 1281 B13R2.5397 CC=1CC2CC(C)CC(=O)C2C1 Amb24357310 [0,0,0,1,0,1|0,0,1]=3 1282 B13R2.5397 Cc1cc2C(=O)CC(C)Cc2o1 Amb25736307 [0,0,0,1,0,1|1,0,1]=4 1283 B13R2.10744 CC(=C)C[C@H]1CC[C@@H]2C[C@@H]2C1=O Amb24633596 [0,0,0,1,0,1|0,0,2]=4 1284 B13R2.10744 CC(=O)CN1CCC2CC2C1=O Amb25178675 [0,0,0,1,0,1|2,0,0]=4 1285 B13R2.10744 CC(=O)OC1CCC2CC2C1=O Amb25093787 [0,0,0,1,0,1|1,0,1]=4 1286 B13R2.10744 CC(=O)O[C@H]1CC[C@@H]2C[C@@H]2C1=O Amb24656090 [0,0,0,1,0,1|1,0,1]=4 1287 B13R2.10744 CC(C)CC1CCC2CC2C1=O Amb23515399 [0,0,0,1,0,1|0,0,2]=4 1288 B13R2.10744 CN(C)CC1CCC2CC2C1=O Amb25358826 [0,0,0,1,0,1|1,0,1]=4 1289 B13R2.5173 C[C@@H]1CC[C@@H]2[C@H](C(=O)C1)C2(C)C Amb24737495 [0,0,0,1,0,1|0,0,2]=4 1290 B13R2.5173 C[C@@H]1CC[C@H]2[C@@H](C(=O)C1)C2(C)C Amb24760752 [0,0,0,1,0,1|0,0,2]=4 1291 B13R2.229 O=C1CC2CCC(C1)CCC2=O Amb24551473 [0,0,0,1,0,1|1,0,1]=4 1292 B13R2.4918 CC1CCC2CC(=O)C1C2(C)C Amb25667378 [0,0,0,1,0,1|0,0,2]=4 1293 B13R2.5238 CC1CC2C(CC(=O)C1)C2(C)C Amb24364217 [0,0,0,1,0,1|0,0,2]=4 1294 B13R2.10846 CC1(C)[C@@H]2CC(=O)C[C@@]1(C)CC2 Amb25179737 [0,0,0,1,0,1|0,0,2]=4 1295 B13R2.10846 CC1(C)[C@H]2CCC1(C)CC(=O)N2 Amb24752169 [0,0,0,1,0,1|0,0,2]=4 1296 B13R2.12850 CC(C)C1CCC2(C)CC(=O)C21 Amb24467530 [0,0,0,1,0,1|0,0,2]=4 1297 B13R2.5055 CC1(C)C2CCC1(C)CNC2=O Amb24642546 [0,0,0,1,0,1|0,0,2]=4 1298 B13R2.5055 CC1(C)C2CCC1(C)COC2=O Amb24558632 [0,0,0,1,0,1|0,0,2]=4 1299 B13R2.5055 CC1(C)[C@@H]2CC[C@@]1(C)CCC2=O Amb24604760 [0,0,0,1,0,1|0,0,2]=4 1300 B13R2.5055 CC1(C)[C@@H]2CC[C@@]1(C)CNC2=O Amb24670418 [0,0,0,1,0,1|0,0,2]=4 1301 B13R2.5193 CC1CC[C@H]2C(=O)[C@@H](O1)C2(C)C Amb25263659 [0,0,0,1,0,1|0,0,2]=4 1302 B13R2.5193 C[C@H]1CC[C@H]2C(=O)[C@@H](O1)C2(C)C Amb25179763 [0,0,0,1,0,1|0,0,2]=4 1303 B13R2.10746 CC(=C)[C@H]1CC[C@]2(C)O[C@@H]2C1=O Amb25179596 [0,0,0,1,0,1|0,0,2]=4 1304 B13R2.10746 CC(C)=C1CC[C@]2(C)O[C@@H]2C1=O Amb24582561 [0,0,0,1,0,1|0,0,0]=2 1305 B13R2.10746 CC(C)C1CCC2(C)CC2C1=O Amb25231666 [0,0,0,1,0,1|0,0,2]=4 1306 B13R2.10746 CC(C)[C@@H]1CC[C@]2(C)O[C@@H]2C1=O Amb25373236 [0,0,0,1,0,1|0,0,2]=4 1307 B13R2.10746 CC(C)[C@H]1CC[C@@]2(C)O[C@H]2C1=O Amb25205773 [0,0,0,1,0,1|0,0,2]=4 1308 B13R2.5187 CC1CC=2C(C)CC(=O)C2CC1 Amb25347631 [0,1,0,1,0,0|2,0,0]=4 1309 B13R2.5187 CC1CCC=2C(C)CC(=O)C2O1 Amb24647824 [0,1,0,1,0,0|1,0,1]=4 1310 B13R2.5187 C[C@@H]1CCC=2[C@H](C)CC(=O)C2O1 Amb25373308 [0,1,0,1,0,0|1,0,1]=4 1311 B13R2.9615 CC1(C)C2CC1C(=O)CC2CO Amb25768438 [0,1,0,1,0,0|0,0,2]=4 1312 B13R2.12702 CC1(C)CC2(C)CC(=O)C1CC2 Amb25735761 [0,1,0,1,0,0|0,0,2]=4 1313 B13R2.12702 CC1(C)NC2(C)CC(=O)C1CC2 Amb24682857 [0,1,0,1,0,0|0,0,2]=4 1314 B13R2.12702 C[C@@]12CC[C@@H](C(=O)C1)[C@](C)(O)C2 Amb24567916 [0,1,0,1,0,0|0,0,2]=4 1315 B13R2.3696 C[C@@H]1CCC2CC1C(=O)C[C@H]2C Amb24620071 [0,1,0,1,0,0|0,0,2]=4 1316 B13R2.13409 CC1(C)C2CC(Cl)C1(C)CC2=O Amb25138765 [0,1,0,1,0,0|0,0,2]=4 1317 B13R2.13409 CC1(C)C2C[C@@H](O)C1(C)CC2=O Amb25318896 [0,1,0,1,0,0|0,0,2]=4 1318 B13R2.13409 CC1(C)[C@@H]2C[C@H](O)[C@@]1(C)CC2=O Amb25273138 [0,1,0,1,0,0|0,0,2]=4 1319 B13R2.13409 CC1(C)[C@H]2CC(O)[C@]1(C)CC2=O Amb24580086 [0,1,0,1,0,0|0,0,2]=4 1320 B13R2.13409 CC1(C)[C@H]2C[C@H](O)[C@@]1(C)CC2=O Amb24620136 [0,1,0,1,0,0|0,0,2]=4 1321 B13R2.13409 O=C1CC2(C(C1CC2O)(C)C)C Amb2537050 [0,1,0,1,0,0|0,0,2]=4 1322 B13R2.2130 Cc1coc2CC(CO)CCc21 Amb18827709 [0,1,0,1,0,0|0,0,2]=4 1323 B13R2.2170 CNC1CC(=O)N(CC1)C2CC2 Amb25160089 [0,1,0,1,0,0|1,0,1]=4 1324 B13R2.12018 CC1(C)C2C(=O)C1CCC2(C)O Amb25128911 [0,1,0,1,0,0|0,0,2]=4 1325 B13R2.12104 CC1(C)CC(=O)[C@H]2C[C@@H]1C2(C)C Amb25245362 [0,1,0,1,0,0|0,0,2]=4 1326 B13R2.12908 CC12CCC(O1)(C(C)C)C(=O)C2 Amb24691774 [0,1,0,1,0,0|0,0,2]=4 1327 B13R2.5182 CC1CCC2C(C)COC1C2=O Amb25284824 [0,1,0,1,0,0|0,0,2]=4 1328 B13R2.5182 C[C@@H]1CC[C@@H]2[C@@H](C)CO[C@H]1C2=O Amb24540897 [0,1,0,1,0,0|0,0,2]=4 1329 B13R2.12701 CC1C(=O)C2CCC1(C)CC2=O Amb25116494 [0,1,0,1,0,0|1,0,1]=4 1330 B13R2.16542 CC1(C)C2CCC1(C)C(C)C2=O Amb24545676 [0,1,0,1,0,0|0,0,2]=4 1331 B13R2.16542 CC1(C)C2CCC1(C)C(O)C2=O Amb23589713 [0,1,0,1,0,0|0,0,2]=4 1332 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)C(O)C2=O Amb25339680 [0,1,0,1,0,0|0,0,2]=4 1333 B13R2.16542 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](O)C2=O Amb25179668 [0,1,0,1,0,0|0,0,2]=4 1334 B13R2.16542 CC1(C)[C@@H]2CC[C@]1(C)C(O)C2=O Amb25202694 [0,1,0,1,0,0|0,0,2]=4 1335 B13R2.16542 CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2=O Amb24512574 [0,1,0,1,0,0|0,0,2]=4 1336 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)C(C)C2=O Amb24512643 [0,1,0,1,0,0|0,0,2]=4 1337 B13R2.16542 CC1(C)[C@H]2CC[C@]1(C)[C@H](O)C2=O Amb25228276 [0,1,0,1,0,0|0,0,2]=4 1338 B13R2.20911 CC1C2CC(C(=O)C1C)C2(C)C Amb24456728 [0,1,0,1,0,0|0,0,2]=4 1339 B13R2.20911 C[C@@H]1[C@H]2C[C@@H](C(=O)[C@H]1C)C2(C)C Amb24580363 [0,1,0,1,0,0|0,0,2]=4 1340 B13R2.20911 C[C@H]1[C@@H](O)C(=O)[C@H]2C[C@@H]1C2(C)C Amb24550550 [0,1,0,1,0,0|0,0,2]=4 1341 B13R2.20911 C[C@H]1[C@@H]2C[C@H](C(=O)[C@H]1C)C2(C)C Amb24631201 [0,1,0,1,0,0|0,0,2]=4 1342 B13R2.10186 CC1=CC2C(C)CCC1(C)C2=O Amb24408952 [0,1,0,1,0,0|0,0,2]=4 1343 B13R2.10186 CC1=C[C@@H]2[C@H](C)CC[C@@]1(C)C2=O Amb25203900 [0,1,0,1,0,0|0,0,2]=4 1344 B13R2.13207 CC1(C)C2C(C)CCC1(C)C2=O Amb25059704 [0,1,0,1,0,0|0,0,2]=4 1345 B13R2.13207 CC1(C)[C@@H]2[C@H](C)CC[C@@]1(C)C2=O Amb24578304 [0,1,0,1,0,0|0,0,2]=4 1346 B13R2.22580 CC1(C)C2(O)CCC1(C)CC2=O Amb25370859 [0,1,0,1,0,0|0,0,2]=4 1347 B13R2.22580 CC1(C)[C@]2(C)CC[C@@]1(C)CC2=O Amb24606862 [0,1,0,1,0,0|0,0,2]=4 1348 B13R2.11642 CC1=NOC2CC(C)CC(=O)C12 Amb25718428 [0,1,0,1,0,0|1,0,1]=4 1349 B13R2.11642 CC1CC(=O)c2c(C1)[nH]nc2C Amb2190408 [0,1,0,1,0,0|1,0,1]=4 1350 B13R2.11642 CC1CC(C)CC=2CCC(=O)C21 Amb25320166 [0,1,0,1,0,0|2,0,0]=4 1351 B13R2.11642 CC1CC=2OCC(=C)C2C(=O)C1 Amb25093687 [0,1,0,1,0,0|0,0,2]=4 1352 B13R2.11642 CC1COC=2C[C@H](C)CC(=O)C21 Amb24721777 [0,1,0,1,0,0|0,0,2]=4 1353 B13R2.11642 Cc1[n][nH]c2CC(C)CC(Cl)c12 Amb24122472 [0,1,0,1,0,0|2,0,0]=4 1354 B13R2.11642 Cc1[n][nH]c2CC(C)CC(N)c12 Amb24122466 [0,1,0,1,0,0|2,0,0]=4 1355 B13R2.11642 Cc1[n][nH]c2CC(C)CC(O)c12 Amb24112895 [0,1,0,1,0,0|2,0,0]=4 1356 B13R2.11642 Cc1c[nH]c2CC(C)CC(=O)c12 Amb25083249 [0,1,0,1,0,0|0,0,2]=4 1357 B13R2.11642 Cc1c[s]c2CC(C)CC(N)c12 Amb18150623 [0,1,0,1,0,0|0,1,1]=4 1358 B13R2.11642 Cc1coc2CC(C)CC(=O)c12 Amb25295384 [0,1,0,1,0,0|0,0,2]=4 1359 B13R2.11642 Cc1coc2C[C@@H](C)CC(O)c12 Amb25045100 [0,1,0,1,0,0|0,0,2]=4 1360 B13R2.662 NCc1csc2c1CCC(C2)C Amb17093931 [0,1,0,1,0,0|0,1,1]=4 1361 B13R2.5190 Cc1c(C)[n]c2CC(C)CC[n]12 Amb25156529 [0,1,0,1,0,0|2,0,0]=4 1362 B13R2.5190 Cc1c2CCC(C)Cc2[nH]c1C Amb25772921 [0,1,0,1,0,0|1,0,0]=3 1363 B13R2.5190 Cc1c2CCC(N)Cc2[n][n]1C Amb24536112 [0,1,0,1,0,0|2,0,0]=4 1364 B13R2.5190 Cc1c2CCN(C)Cc2oc1C Amb24101494 [0,1,0,1,0,0|1,0,1]=4 1365 B13R2.8737 C[C@@]12CC[C@@H](C(=O)C1)C2(C)CO Amb25328917 [0,1,0,1,0,0|0,0,2]=4 1366 B13R3.23479 CC1(C)[C@@H]2C[C@H]3C(C2=O)C13C Amb24736381 [0,0,0,2,0,0|0,0,2]=4 1367 B13R3.23479 CC1(C)[C@@H]2C[C@H]3[C@@H](C2=O)[C@@]13C Amb25179462 [0,0,0,2,0,0|0,0,2]=4 1368 B13R3.11991 CC1(C)C2CC1C3CC3C2=O Amb25053100 [0,0,0,2,0,0|0,0,2]=4 1369 B13R3.2060 CC12CCC3C(=C)C1C2C3=O Amb25085420 [0,0,0,2,0,0|0,0,2]=4 1370 B13R3.2060 CC12CCC3C(=O)C1C2C3=O Amb24591925 [0,0,0,2,0,0|1,0,1]=4 1371 B13R3.16034 CC12CC3C(=O)C1CCC23C Amb25094394 [0,0,0,2,0,0|0,0,2]=4 1372 B13R3.23912 CC12CC(=O)C3C(C1)CC3C2 Amb24456581 [0,0,0,2,0,0|0,0,2]=4 1373 B9R0.48 CC(C)=CCN(C)CC=C Amb24363933 [0,0,1,0,1,0|2,0,0]=4 1374 B9R0.48 CC(C)=CC\C(\C)=C/C=O Amb24443697 [0,0,1,0,1,0|0,0,2]=4 1375 B9R0.48 CC(C)CCC(C)CC=O Amb24366723 [0,0,1,0,1,0|0,0,1]=3 1376 B9R0.48 CC(C)CCC(C)NC=O Amb25095296 [0,0,1,0,1,0|1,0,1]=4 1377 B9R0.48 CC(C)CCN(C)CC=O Amb24529242 [0,0,1,0,1,0|1,0,1]=4 1378 B9R0.48 CC(CC=C(C)C)CC=O Amb18643637 [0,0,1,0,1,0|0,0,0]=2 1379 B9R0.48 CC(CC=O)CCN(C)C Amb25174646 [0,0,1,0,1,0|1,0,0]=3 1380 B9R0.48 CC(CC=O)COC(C)=O Amb18644137 [0,0,1,0,1,0|2,0,0]=4 1381 B9R0.48 CC(CCO)CC=C(C)C Amb24397049 [0,0,1,0,1,0|0,0,2]=4 1382 B9R0.48 CN(C)CCN(C)CC=O Amb24069139 [0,0,1,0,1,0|2,0,0]=4 1383 B9R0.48 C[C@@H](CC=C(C)C)CC=O Amb25707441 [0,0,1,0,1,0|0,0,0]=2 1384 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [0,0,1,0,1,0|2,0,0]=4 1385 B9R0.79 CC(=C)C(C)C(=O)C(C)C Amb25729817 [0,0,1,0,1,0|0,0,2]=4 1386 B9R0.79 CC(=S)C(C)C(=O)C(C)C Amb25146597 [0,0,1,0,1,0|1,0,1]=4 1387 B9R0.79 CC(C(C)C)C(=O)C(C)C Amb25138858 [0,0,1,0,1,0|0,0,2]=4 1388 B9R0.79 CC(C)=C(C)C(=O)C(C)C Amb25369756 [0,0,1,0,1,0|0,0,0]=2 1389 B9R0.79 CC(C)=C(C)C(C)=C(C)C Amb22365162 [0,0,1,0,1,0|1,0,1]=4 1390 B9R0.79 CC(C)=C(C)[C@H](O)C(C)C Amb24481268 [0,0,1,0,1,0|0,0,2]=4 1391 B9R0.79 CC(C)C(=O)C(=O)C(C)C Amb25147237 [0,0,1,0,1,0|1,0,1]=4 1392 B9R0.79 CC(C)C(=O)C(=O)N(C)C Amb25146867 [0,0,1,0,1,0|2,0,0]=4 1393 B9R0.79 CC(C)C(=O)C(C)C(C)=O Amb17778960 [0,0,1,0,1,0|1,0,1]=4 1394 B9R0.79 CC(N)=C(Br)C(=O)C(C)C Amb25218863 [0,0,1,0,1,0|2,0,0]=4 1395 B9R0.79 CN(C(C)C)C(=O)C(C)C Amb24678640 [0,0,1,0,1,0|1,0,1]=4 1396 B9R0.79 CN(C)C(=S)C(=O)C(C)C Amb24721793 [0,0,1,0,1,0|2,0,0]=4 1397 B9R0.79 C\C(=C(\O)/C(C)C)\C(C)=O Amb25059742 [0,0,1,0,1,0|1,0,1]=4 1398 B9R0.42 CC(=C)C(=O)CC(C)CC Amb25064630 [0,0,1,0,1,0|0,0,1]=3 1399 B9R0.42 CC(=C)C(=O)CC(C)CN Amb25791372 [0,0,1,0,1,0|1,0,1]=4 1400 B9R0.42 CC(=C)C(=O)NC(C)CC Amb24763709 [0,0,1,0,1,0|1,0,1]=4 1401 B9R0.42 CC(=C)C(=O)N[C@@H](C)CC Amb25216553 [0,0,1,0,1,0|1,0,1]=4 1402 B9R0.42 CC(=C)C(=O)OC(C)CC Amb22231432 [0,0,1,0,1,0|1,0,1]=4 1403 B9R0.42 CC(=O)C(=O)CC(C)CC Amb24707036 [0,0,1,0,1,0|1,0,0]=3 1404 B9R0.42 CC(C)=C(C)CC(Br)CC Amb24741756 [0,0,1,0,1,0|2,0,0]=4 1405 B9R0.42 CC(C)C(=O)CC(C)CC Amb24410930 [0,0,1,0,1,0|0,0,1]=3 1406 B9R0.42 CC(C)C(=O)CC(C)CN Amb25118154 [0,0,1,0,1,0|1,0,1]=4 1407 B9R0.42 CC(C)C(=O)CC(O)CC Amb25146716 [0,0,1,0,1,0|1,0,1]=4 1408 B9R0.42 CCC(C)CC(=O)N(C)C Amb24666262 [0,0,1,0,1,0|1,0,0]=3 1409 B9R0.42 CCC(N)CC(=O)N(C)C Amb25145594 [0,0,1,0,1,0|2,0,0]=4 1410 B9R0.42 CCC(NC(=O)C(=O)C)C Amb17399880 [0,0,1,0,1,0|2,0,0]=4 1411 B9R0.42 CNC(C)CC(=O)N(C)C Amb24481002 [0,0,1,0,1,0|2,0,0]=4 1412 B9R0.42 COC(C)CC(=O)N(C)C Amb24752132 [0,0,1,0,1,0|2,0,0]=4 1413 B9R0.42 COC(CC(=O)C(=C)C)C Amb17593596 [0,0,1,0,1,0|1,0,1]=4 1414 B9R0.42 C[C@H](CO)CC(=O)N(C)C Amb24448005 [0,0,1,0,1,0|2,0,0]=4 1415 B9R0.39 CC(=O)C(CC(C)C)=CO Amb24676877 [0,0,1,0,1,0|1,0,1]=4 1416 B9R0.39 CC(C)=C(C=O)C=C(C)C Amb25767710 [0,0,1,0,1,0|0,0,2]=4 1417 B9R0.39 CC(C)=C(C=O)SC(C)C Amb25856790 [0,0,1,0,1,0|1,0,0]=3 1418 B9R0.39 CC(C)=C(CC(C)=C)C=O Amb18124525 [0,0,1,0,1,0|0,0,2]=4 1419 B9R0.39 CC(C)C(CC(C)C)C=O Amb25827192 [0,0,1,0,1,0|0,0,2]=4 1420 B9R0.39 C\C(\Cl)=C(/CC(C)C)\C=O Amb24478384 [0,0,1,0,1,0|1,0,0]=3 1421 B9R1.35 CC(=O)C=1CC(O)CC1 Amb25134091 [1,0,0,0,1,0|2,0,0]=4 1422 B9R1.35 CC(=O)C=1CCC(Br)C1 Amb25299441 [1,0,0,0,1,0|2,0,0]=4 1423 B9R1.35 CC(=O)C=1CC[C@H](C)C1 Amb24689488 [1,0,0,0,1,0|1,0,0]=3 1424 B9R1.35 CC(C)=C1CC(=O)CC1 Amb25370822 [1,0,0,0,1,0|1,0,1]=4 1425 B9R1.35 CC(C)C1CC(C)CC1 Amb24729232 [1,0,0,0,1,0|0,0,2]=4 1426 B9R1.35 CC(C)C=1CCC(N)C1 Amb25147090 [1,0,0,0,1,0|1,0,1]=4 1427 B9R1.35 CC1CC(=CC1)C(O)=O Amb18642398 [1,0,0,0,1,0|2,0,0]=4 1428 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [1,0,0,0,1,0|2,0,0]=4 1429 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [1,0,0,0,1,0|1,0,1]=4 1430 B9R1.35 CC1CCC(C1)N(C)C Amb24706502 [1,0,0,0,1,0|1,0,1]=4 1431 B9R1.35 CC1CN(CC1)C(C)=N Amb25055962 [1,0,0,0,1,0|2,0,0]=4 1432 B9R1.22 CC1CC(=NO)C(=O)C1 Amb24706920 [1,0,0,0,1,0|2,0,0]=4 1433 B9R1.22 CC1CC(C=O)=C(Cl)C1 Amb18644177 [1,0,0,0,1,0|2,0,0]=4 1434 B9R1.22 CC1CC(CC)C(=O)C1 Amb24736143 [1,0,0,0,1,0|0,0,2]=4 1435 B9R1.22 CC=1C\C(=C\C)\C(=O)C1 Amb24714919 [1,0,0,0,1,0|0,0,2]=4 1436 B9R1.22 C\C=C/1\CC(C)OC1=O Amb25344017 [1,0,0,0,1,0|1,0,0]=3 1437 B9R1.132 CC1=CC\C(=C\C)\C1=O Amb25273066 [1,0,0,0,1,0|0,0,2]=4 1438 B9R1.132 CC1CCC(=NO)C1=O Amb25025003 [1,0,0,0,1,0|2,0,0]=4 1439 B9R1.132 CC1CCC(C=O)=C1Cl Amb25044242 [1,0,0,0,1,0|2,0,0]=4 1440 B9R1.132 CC1CCC(C=O)C1=O Amb25798363 [1,0,0,0,1,0|1,0,1]=4 1441 B9R1.132 CC1CC\C(=C/O)\C1=O Amb25714042 [1,0,0,0,1,0|1,0,0]=3 1442 B9R1.132 CC1CC\C(=N/O)\C1=O Amb25759623 [1,0,0,0,1,0|2,0,0]=4 1443 B9R1.132 CC=1C(C)CCC1C=O Amb25835693 [1,0,0,0,1,0|2,0,0]=4 1444 B9R1.132 CN1CCC(=CO)C1=O Amb24398086 [1,0,0,0,1,0|2,0,0]=4 1445 B9R1.132 CN1CC\C(=C\Cl)\C1=O Amb24692898 [1,0,0,0,1,0|2,0,0]=4 1446 B9R1.41 CC(=C)C1CCCC1=O Amb25032164 [1,0,0,0,1,0|0,0,2]=4 1447 B9R1.41 CC(=N)C1CCCC1=O Amb25728897 [1,0,0,0,1,0|1,0,1]=4 1448 B9R1.41 CC(=O)C1=CCCC1=O Amb25735738 [1,0,0,0,1,0|1,0,1]=4 1449 B9R1.41 CC(C)=C1C=CCC1=O Amb24519726 [1,0,0,0,1,0|0,0,2]=4 1450 B9R1.41 CC(C)=C1CCNC1=O Amb24561005 [1,0,0,0,1,0|1,0,0]=3 1451 B9R1.41 CC(C)=C1CCOC1=O Amb25249368 [1,0,0,0,1,0|1,0,0]=3 1452 B9R1.41 CC(C)C1CCCC1=O Amb22059120 [1,0,0,0,1,0|0,0,2]=4 1453 B9R1.41 CC(C)N1CCCC1=O Amb22731565 [1,0,0,0,1,0|1,0,1]=4 1454 B9R1.41 CC(N)=C1CCCC1=O Amb24514883 [1,0,0,0,1,0|1,0,0]=3 1455 B9R1.41 CC(O)=C1CSCC1=O Amb24518336 [1,0,0,0,1,0|2,0,0]=4 1456 B9R1.41 CN(C)C1=CCCC1=O Amb25093632 [1,0,0,0,1,0|1,0,1]=4 1457 B9R1.41 C\C(\Cl)=C\1/CCCC1=O Amb24686528 [1,0,0,0,1,0|1,0,0]=3 1458 B9R1.41 C\C(\N)=C\1/CCCC1=O Amb25844128 [1,0,0,0,1,0|1,0,0]=3 1459 B9R1.41 C\C(\N)=C\1/CCOC1=O Amb25067531 [1,0,0,0,1,0|2,0,0]=4 1460 B9R1.41 C\C(\O)=C\1/SCCC1=O Amb25759528 [1,0,0,0,1,0|2,0,0]=4 1461 B9R1.41 ClC(=C1CCCC1=O)Cl Amb17594090 [1,0,0,0,1,0|2,0,0]=4 1462 B11R0.173 CC(C)=C(C)C(=O)NCC(C)C Amb25154647 [0,0,1,0,0,1|0,0,0]=2 1463 B11R0.173 CC(C)=C(C)C(=O)NCC(F)F Amb25091846 [0,0,1,0,0,1|2,0,0]=4 1464 B11R0.173 CC(C)=C(F)C(=O)NCC(C)C Amb24660907 [0,0,1,0,0,1|1,0,0]=3 1465 B11R0.173 CC(C)=C(F)C(=O)NCC(C)O Amb25355866 [0,0,1,0,0,1|2,0,0]=4 1466 B11R0.160 CCCCC(NC(C)=O)C(C)=O Amb21961247 [0,0,1,0,0,1|1,0,1]=4 1467 B11R0.160 CCC\C=C(\NC(C)=O)/C(C)=O Amb24621682 [0,0,1,0,0,1|1,0,1]=4 1468 B11R0.107 CC(C)=CC(=O)NCC(C)C#N Amb25179925 [0,0,1,0,0,1|1,0,1]=4 1469 B11R0.107 CC(C)CC(=O)OCC(C)CC Amb22351383 [0,0,1,0,0,1|0,0,2]=4 1470 B11R1.20 CC(=O)CC=1CCN(C)CC1 Amb25359049 [1,0,0,0,0,1|2,0,0]=4 1471 B11R1.20 CC(=O)OC=1CCC(C)CC1 Amb22009475 [1,0,0,0,0,1|1,0,0]=3 1472 B11R1.20 CC(=O)\C=C\1/CCC(C)C=C1 Amb25094352 [1,0,0,0,0,1|1,0,1]=4 1473 B11R1.20 CC(C)=CC=1CCC(N)CC1 Amb24413057 [1,0,0,0,0,1|1,0,0]=3 1474 B11R1.20 CC(C)CC=1CCC(N)CC1 Amb25028211 [1,0,0,0,0,1|1,0,1]=4 1475 B11R1.20 CC1CC=C(CC1)CC(N)=O Amb24415324 [1,0,0,0,0,1|2,0,0]=4 1476 B11R1.20 CC1CCC(CC(C)N)=CC1 Amb25273882 [1,0,0,0,0,1|1,0,1]=4 1477 B11R1.949 CC1CC(=O)N(CCC1)C=C Amb25699886 [1,0,0,0,0,1|1,0,1]=4 1478 B11R1.949 CC1CCCC(C=O)=C(Cl)C1 Amb24682672 [1,0,0,0,0,1|2,0,0]=4 1479 B11R1.86 CC(=C)CC1CCCCC1=O Amb18177227 [1,0,0,0,0,1|0,0,2]=4 1480 B11R1.86 CC(=C)C[C@@H]1CCCCC1=O Amb24434610 [1,0,0,0,0,1|0,0,2]=4 1481 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [1,0,0,0,0,1|2,0,0]=4 1482 B11R1.86 CC(=O)CC1=CCCCC1=O Amb25373055 [1,0,0,0,0,1|1,0,1]=4 1483 B11R1.86 CC(=O)CC1CCCCC1=O Amb17593853 [1,0,0,0,0,1|1,0,1]=4 1484 B11R1.86 CC(=O)CN1CCCCC1=O Amb18799578 [1,0,0,0,0,1|2,0,0]=4 1485 B11R1.86 CC(=O)C[C@@H]1CCCCC1=O Amb25066340 [1,0,0,0,0,1|1,0,1]=4 1486 B11R1.86 CC(=O)C[C@H]1CCCCC1=O Amb24690701 [1,0,0,0,0,1|1,0,1]=4 1487 B11R1.86 CC(=O)NC1=C(C)CCCC1 Amb17845068 [1,0,0,0,0,1|2,0,0]=4 1488 B11R1.86 CC(=O)NC1=CCCCC1=O Amb25756181 [1,0,0,0,0,1|1,0,1]=4 1489 B11R1.86 CC(=O)NC1CCCCC1=O Amb25075488 [1,0,0,0,0,1|1,0,1]=4 1490 B11R1.86 CC(=O)NN1CCCCC1=O Amb25189546 [1,0,0,0,0,1|2,0,0]=4 1491 B11R1.86 CC(=O)OC1CCCCC1=O Amb10576141 [1,0,0,0,0,1|1,0,1]=4 1492 B11R1.86 CC(=O)O[C@@H]1CCCCC1=O Amb24686407 [1,0,0,0,0,1|1,0,1]=4 1493 B11R1.86 CC(=O)\C=C/1\CCCCC1=O Amb24416702 [1,0,0,0,0,1|1,0,0]=3 1494 B11R1.86 CC(=O)\C=C/1\CCCOC1=O Amb24577829 [1,0,0,0,0,1|2,0,0]=4 1495 B11R1.86 CC(C)=CC1=CCCCC1=O Amb24647886 [1,0,0,0,0,1|0,0,1]=3 1496 B11R1.86 CC(C)=CC1CCCCC1=O Amb24380873 [1,0,0,0,0,1|0,0,1]=3 1497 B11R1.86 CC(C)=NC1CCCNC1=O Amb24585729 [1,0,0,0,0,1|1,0,1]=4 1498 B11R1.86 CC(C)=N[C@H]1CCCNC1=O Amb24513612 [1,0,0,0,0,1|1,0,1]=4 1499 B11R1.86 CC(C)CC1CCCCC1=O Amb18177374 [1,0,0,0,0,1|0,0,2]=4 1500 B11R1.86 CC(C)CN1CCCCC1=O Amb22394918 [1,0,0,0,0,1|1,0,1]=4 1501 B11R1.86 CC(C)C[C@H]1CCCCC1=O Amb25139928 [1,0,0,0,0,1|0,0,2]=4 1502 B11R1.86 CC(C)OC1=CCCCC1=O Amb24544629 [1,0,0,0,0,1|0,0,2]=4 1503 B11R1.86 CC(C)OC1CCCCC1=O Amb25370637 [1,0,0,0,0,1|0,0,2]=4 1504 B11R1.86 CC(C)SC1CCCCC1=O Amb18180370 [1,0,0,0,0,1|0,0,2]=4 1505 B11R1.86 CC(C)\C=C\1/CCCCC1=O Amb22823238 [1,0,0,0,0,1|0,0,1]=3 1506 B11R1.86 CC(C)\C=C\1/CCCNC1=O Amb25324596 [1,0,0,0,0,1|1,0,1]=4 1507 B11R1.86 CN(C)\C=C\1/CCCCC1=O Amb21961651 [1,0,0,0,0,1|1,0,0]=3 1508 B11R1.86 CN(C)\C=C\1/CCCCC1=O Amb22505737 [1,0,0,0,0,1|1,0,0]=3 1509 B11R1.86 CN(C)\C=C\1/COCCC1=O Amb22756108 [1,0,0,0,0,1|2,0,0]=4 1510 B11R1.86 CN(CC1CCCCC1=O)C Amb1146042 [1,0,0,0,0,1|1,0,1]=4 1511 B11R1.86 CN(\C=C\1/COCCC1=O)C Amb16186963 [1,0,0,0,0,1|2,0,0]=4 1512 B11R1.86 OC(=O)\C=C\1/CCCCC1=O Amb25701737 [1,0,0,0,0,1|2,0,0]=4 1513 B11R1.497 CC(=C)[C@@H]1CC(=O)CCCC1 Amb25370775 [1,0,0,0,0,1|0,0,2]=4 1514 B11R1.497 CC(C)C1CC(=O)CCCC1 Amb25303571 [1,0,0,0,0,1|0,0,2]=4 1515 B11R1.497 CC(C)C1CCCCC(=O)N1 Amb25679153 [1,0,0,0,0,1|0,0,2]=4 1516 B11R1.497 CC(C)C1CCCCC(=O)O1 Amb24366072 [1,0,0,0,0,1|0,0,2]=4 1517 B11R1.497 CC(C)N1CC(=O)CCCC1 Amb24707089 [1,0,0,0,0,1|1,0,1]=4 1518 B11R1.74 CC(=O)N1C[C@@H](C)CC(=O)C1 Amb25130594 [0,0,0,0,1,1|2,0,0]=4 1519 B11R1.74 CC(C)C1C[C@H](C)CC(=O)C1 Amb25282798 [0,0,0,0,1,1|0,0,2]=4 1520 B11R1.74 CC(C)C=1CC(C)CC(=O)C1 Amb25282739 [0,0,0,0,1,1|0,0,1]=3 1521 B11R1.74 CC(C)C=1C[C@@H](C)CC(=O)C1 Amb25707006 [0,0,0,0,1,1|0,0,1]=3 1522 B11R1.74 CC(C)[C@H]1C[C@@H](C)CC(=O)C1 Amb24540871 [0,0,0,0,1,1|0,0,2]=4 1523 B11R1.74 CC1CC(=O)CN(C1)C(C)C Amb2370003 [0,0,0,0,1,1|1,0,1]=4