0 B11R1.3 C#CC1=CCC(C(C)=O)CC1 Amb24758184 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.3 C=C(C)C1C=CC(CO)CC1 Amb27980592 [0,0,0,0,0,0|0,0,4]=4 2 B11R1.3 C=C(C)C1CC=C(C=O)CC1 Amb2698249 [0,0,0,0,0,0|0,0,0]=0 3 B11R1.3 C=C(C)C1CC=C(CO)CC1 Amb9825863 [0,0,0,0,0,0|0,0,2]=2 4 B11R1.3 C=C(C)C1CCC(CO)CC1 Amb26323067 [0,0,0,0,0,0|0,0,4]=4 5 B11R1.3 C=C(C)[C@@H]1C=CC(CO)CC1 Amb27775817 [0,0,0,0,0,0|0,0,4]=4 6 B11R1.3 C=C(C)[C@@H]1CC=C(C=O)CC1 Amb533148 [0,0,0,0,0,0|0,0,0]=0 7 B11R1.3 C=C(C)[C@@H]1CC=C(CO)CC1 Amb6296716 [0,0,0,0,0,0|0,0,2]=2 8 B11R1.3 C=C(C)[C@H]1CC=C(C=O)CC1 Amb17619206 [0,0,0,0,0,0|0,0,0]=0 9 B11R1.3 C=C(C)[C@H]1CC=C(CBr)CC1 Amb27620277 [0,0,0,0,0,0|1,0,1]=2 10 B11R1.3 C=C(C)[C@H]1CC=C(CN)CC1 Amb27597514 [0,0,0,0,0,0|1,0,1]=2 11 B11R1.3 C=C(C)[C@H]1CC=C(CO)CC1 Amb18511857 [0,0,0,0,0,0|0,0,2]=2 12 B11R1.3 C=C(C)[C@H]1CC[C@H](C=O)CC1 Amb27848126 [0,0,0,0,0,0|0,0,2]=2 13 B11R1.3 C=C(C)c1ccc(C=O)cc1 Amb16232119 [0,0,0,0,0,0|0,0,4]=4 14 B11R1.3 C=C(C)c1ccc(C=O)nc1 Amb25735693 [0,0,0,0,0,0|1,0,3]=4 15 B11R1.3 C=CC1=CCC(C(=C)C)CC1 Amb27849858 [0,0,0,0,0,0|1,0,0]=1 16 B11R1.3 C=CC1=CC[C@@H](C(=C)C)CC1 Amb27799622 [0,0,0,0,0,0|1,0,0]=1 17 B11R1.3 CC(=O)C1CC=C(C#N)CC1 Amb25137258 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.3 CC(=O)N1CCC(C=O)CC1 Amb17080381 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.3 CC(C)C1C=CC(C=O)CC1 Amb28143894 [0,0,0,0,0,0|0,0,4]=4 20 B11R1.3 CC(C)C1CC=C(CBr)CC1 Amb27839739 [0,0,0,0,0,0|1,0,3]=4 21 B11R1.3 CC(C)C1CC=C(CO)CC1 Amb27399674 [0,0,0,0,0,0|0,0,4]=4 22 B11R1.3 CC(C)C1CCC(C=O)CC1 Amb27668003 [0,0,0,0,0,0|0,0,4]=4 23 B11R1.3 CC(C)C1CCN(C=O)CC1 Amb26496228 [0,0,0,0,0,0|1,0,3]=4 24 B11R1.3 CC(C)[C@@H]1C=C[C@@H](C=O)CC1 Amb27788413 [0,0,0,0,0,0|0,0,4]=4 25 B11R1.3 CC(C)[C@@H]1CC=C(C=O)CC1 Amb27176387 [0,0,0,0,0,0|0,0,2]=2 26 B11R1.3 CC(C)[C@@H]1CC=C(CN)CC1 Amb26317725 [0,0,0,0,0,0|1,0,3]=4 27 B11R1.3 CC=C1CCN(C(C)=O)CC1 Amb26346138 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.3 CCC1=CC[C@H](C(C)=O)CC1 Amb27836856 [0,0,0,0,0,0|2,0,1]=3 29 B11R1.3 CN(C)C1CCC(C=O)CC1 Amb28138409 [0,0,0,0,0,0|1,0,3]=4 30 B11R1.3 CN(C)C1CCN(C=O)CC1 Amb27850141 [0,0,0,0,0,0|2,0,2]=4 31 B11R1.3 COC1=CCC(N(C)C)CC1 Amb27751876 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.3 NC(=S)C1CCN(C=O)CC1 Amb27241298 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.3 O=CC1=CNC(C(=O)O)CC1 Amb33735075 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.3 O=CN1CCC(C(=O)Cl)CC1 Amb8383631 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.3 O=CN1CCC(C(=O)O)CC1 Amb2688606 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.3 O=C[C@H]1CC[C@H](C(=O)O)CC1 Amb25909662 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.3 C=CC1=CC[C@H](CO)CC1 Amb28050594 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.3 C=CC1CCC(C=C)OC1 Amb4016551 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.3 CCC1CC=C(C#N)CC1 Amb19281003 [1,0,0,0,0,0|1,0,2]=4 40 B10R1.3 CCC1CCC(C=O)CC1 Amb26332847 [1,0,0,0,0,0|0,0,3]=4 41 B10R1.3 CC[C@H]1CC[C@H](C=O)CC1 Amb27617092 [1,0,0,0,0,0|0,0,3]=4 42 B10R1.3 CNC1CCC(C=O)CC1 Amb24366476 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.3 CNC1CCN(C=O)CC1 Amb28315965 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.3 COC1=CCC(C=O)CC1 Amb17593543 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.3 COC1CCC(C=O)CC1 Amb26867918 [1,0,0,0,0,0|1,0,2]=4 46 B10R1.3 COC1CCN(C=O)CC1 Amb25889918 [1,0,0,0,0,0|2,0,1]=4 47 B10R1.3 CSC1CCN(C=O)CC1 Amb27471330 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.3 O=CC1CCC(C=O)CC1 Amb18643570 [1,0,0,0,0,0|1,0,2]=4 49 B10R1.3 O=C[C@H]1CC[C@@H](C=O)CC1 Amb27164550 [1,0,0,0,0,0|1,0,2]=4 50 B10R1.13 C=C(C)C1C=CC(C)CC1 Amb27257923 [1,0,0,0,0,0|0,0,3]=4 51 B10R1.13 C=C(C)C1C=CC(O)CC1 Amb28206090 [1,0,0,0,0,0|0,0,3]=4 52 B10R1.13 C=C(C)C1CC=C(C)CC1 Amb6891970 [1,0,0,0,0,0|0,0,1]=2 53 B10R1.13 C=C(C)C1CCC(O)CC1 Amb27219025 [1,0,0,0,0,0|0,0,3]=4 54 B10R1.13 C=C(C)[C@@H]1C=C[C@@H](O)CC1 Amb28350090 [1,0,0,0,0,0|0,0,3]=4 55 B10R1.13 C=C(C)[C@@H]1C=C[C@H](O)CC1 Amb28127409 [1,0,0,0,0,0|0,0,3]=4 56 B10R1.13 C=C(C)[C@@H]1CC=C(C)CC1 Amb8514270 [1,0,0,0,0,0|0,0,1]=2 57 B10R1.13 C=C(C)[C@H]1C=C[C@H](C)CC1 Amb22232036 [1,0,0,0,0,0|0,0,3]=4 58 B10R1.13 C=C(C)[C@H]1CC=C(C)CC1 Amb533457 [1,0,0,0,0,0|0,0,1]=2 59 B10R1.13 C=C1C=CC(C(C)C)CC1 Amb22001910 [1,0,0,0,0,0|0,0,3]=4 60 B10R1.13 C=C1CCC(C(=C)C)CC1 Amb10845321 [1,0,0,0,0,0|0,0,1]=2 61 B10R1.13 C=C1CCC(C(=O)O)CC1 Amb15695314 [1,0,0,0,0,0|2,0,1]=4 62 B10R1.13 C=C1CCC(C(C)O)CC1 Amb27775442 [1,0,0,0,0,0|1,0,2]=4 63 B10R1.13 CC(=O)C1CC=C(Br)CC1 Amb25756617 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 CC(=O)C1CC=C(C)CC1 Amb4025836 [1,0,0,0,0,0|1,0,1]=3 65 B10R1.13 CC(=O)C1CCC(=O)CC1 Amb27597007 [1,0,0,0,0,0|1,0,1]=3 66 B10R1.13 CC(=O)N1C=CC(=O)CC1 Amb27470164 [1,0,0,0,0,0|2,0,1]=4 67 B10R1.13 CC(=O)N1CC=C(Br)CC1 Amb24321343 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 CC(=O)N1CC=C(Cl)CC1 Amb24321344 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.13 CC(=O)N1CC=C(I)CC1 Amb24321342 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.13 CC(=O)N1CCC(=O)CC1 Amb2582739 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.13 CC(C)=C1C=CC(=O)CC1 Amb25236964 [1,0,0,0,0,0|0,0,3]=4 72 B10R1.13 CC(C)=C1CC=C(Br)CC1 Amb27226035 [1,0,0,0,0,0|1,0,2]=4 73 B10R1.13 CC(C)=C1CCC(=O)CC1 Amb27217337 [1,0,0,0,0,0|0,0,3]=4 74 B10R1.13 CC(C)C1C=CC(=O)CC1 Amb27228833 [1,0,0,0,0,0|0,0,3]=4 75 B10R1.13 CC(C)C1CCC(=O)CC1 Amb2720781 [1,0,0,0,0,0|0,0,3]=4 76 B10R1.13 CC(C)[C@@H]1C=CC(=O)CC1 Amb24737537 [1,0,0,0,0,0|0,0,3]=4 77 B10R1.13 CC(C)[C@@H]1CCC(=O)OC1 Amb26539699 [1,0,0,0,0,0|1,0,2]=4 78 B10R1.13 CC(N)C1CCC(=O)NC1 Amb27481086 [1,0,0,0,0,0|2,0,1]=4 79 B10R1.13 CC(O)C1CC=C(Cl)CC1 Amb27839240 [1,0,0,0,0,0|2,0,1]=4 80 B10R1.13 CC1=CCC(=C(C)C)CC1 Amb18511847 [1,0,0,0,0,0|0,0,3]=4 81 B10R1.13 CC1=CCC(C(=O)O)CC1 Amb18124574 [1,0,0,0,0,0|2,0,1]=4 82 B10R1.13 CC1=CCC(C(C)C)CC1 Amb22224798 [1,0,0,0,0,0|0,0,3]=4 83 B10R1.13 CC1=CCC(C(C)O)CC1 Amb27604267 [1,0,0,0,0,0|1,0,2]=4 84 B10R1.13 CC1=CC[C@H](C(C)C)CC1 Amb22369396 [1,0,0,0,0,0|0,0,3]=4 85 B10R1.13 CN(C)C1CCC(=O)CC1 Amb33543764 [1,0,0,0,0,0|1,0,2]=4 86 B10R1.13 C[C@@H](N)C1CCC(=O)CC1 Amb28132462 [1,0,0,0,0,0|1,0,2]=4 87 B10R1.13 NC(=O)C1C=CC(=O)CC1 Amb25946225 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.13 NC(=O)C1CC=C(Cl)CC1 Amb27791767 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.13 NC(=O)C1CC=C(O)CC1 Amb27170137 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.13 NC(=O)C1CCC(=O)CC1 Amb21964140 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.13 NC(=O)C1CCC(=O)NC1 Amb20668378 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.13 O=C(Cl)C1CC=C(Cl)CC1 Amb26848807 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.13 O=C(O)C1CC=C(Br)CC1 Amb26015030 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.13 O=C(O)C1CC=C(F)CC1 Amb27628828 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.13 O=C1CCC(C(=O)Cl)CC1 Amb10071440 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.13 O=C1CCC(C(=O)O)CC1 Amb5719059 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb8503400 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb9721708 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Amb26878933 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Amb26515676 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.5 C=C(C=O)[C@H]1CC=C(C=O)CC1 Amb28243943 [0,1,0,0,0,0|0,0,1]=2 102 B12R1.5 C=C(CO)[C@@H]1CC=C(CO)CC1 Amb27426726 [0,1,0,0,0,0|0,0,2]=3 103 B12R1.5 CNC(=O)C1CC=C(OC)CC1 Amb28240434 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.5 COC(=O)C1CCC(C=O)CC1 Amb18647354 [0,1,0,0,0,0|1,0,2]=4 105 B12R1.5 COC(=O)[C@H]1CC[C@H](C=O)CC1 Amb22745125 [0,1,0,0,0,0|1,0,2]=4 106 B12R1.6 C=CC1=CCC(C(C)(C)C)CC1 Amb27442409 [0,1,0,0,0,0|1,0,2]=4 107 B12R1.48 C=C(C)C1CCC(C=O)C(=O)C1 Amb28243870 [0,1,0,0,0,0|0,0,1]=2 108 B12R1.48 C=C(C)[C@@H]1CC=C(CO)[C@@H](O)C1 Amb27484801 [0,1,0,0,0,0|0,0,2]=3 109 B12R1.48 C=C(C)[C@@H]1CC=C(CO)[C@H](O)C1 Amb27207766 [0,1,0,0,0,0|0,0,2]=3 110 B12R1.48 C=C(C)[C@H]1CC=C(CO)[C@H](O)C1 Amb27662444 [0,1,0,0,0,0|0,0,2]=3 111 B12R1.48 CC(C)C1CC=C(C=O)C(=O)C1 Amb27250571 [0,1,0,0,0,0|0,0,3]=4 112 B12R1.113 C=C(C)C1CC=C(CC#N)CC1 Amb28251090 [0,1,0,0,0,0|1,0,1]=3 113 B12R1.113 C=C(C)C1CC=C(CCO)CC1 Amb28342613 [0,1,0,0,0,0|0,0,2]=3 114 B12R1.113 C=C(C)C1CC=C(\C=N\O)CC1 Amb27798690 [0,1,0,0,0,0|0,0,1]=2 115 B12R1.113 C=C(C)C1CCC(=CC=O)CC1 Amb28042886 [0,1,0,0,0,0|0,0,1]=2 116 B12R1.113 C=C(C)[C@@H]1CC=C(CCO)CC1 Amb28350035 [0,1,0,0,0,0|0,0,2]=3 117 B12R1.113 C=CCC1=CCC(C(C)=O)CC1 Amb28076572 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.256 C=C(C)C1CC=C(C(=N)N)CC1 Amb28397375 [0,1,0,0,0,0|1,0,0]=2 119 B12R1.256 C=C(C)C1CC=C(C(=O)Cl)CC1 Amb26317826 [0,1,0,0,0,0|0,0,0]=1 120 B12R1.256 C=C(C)C1CC=C(C(=O)O)CC1 Amb22735114 [0,1,0,0,0,0|0,0,0]=1 121 B12R1.256 C=C(C)C1CCC(C(=O)O)CC1 Amb24390282 [0,1,0,0,0,0|0,0,2]=3 122 B12R1.256 C=C(C)[C@@H]1CC=C(C(C)O)CC1 Amb27588932 [0,1,0,0,0,0|0,0,2]=3 123 B12R1.256 C=C(C)[C@H]1CC=C(C(=O)O)CC1 Amb8399680 [0,1,0,0,0,0|0,0,0]=1 124 B12R1.256 CC(=O)C1CCC(C(=O)O)CC1 Amb26336159 [0,1,0,0,0,0|1,0,2]=4 125 B12R1.256 CC(=O)C1CCC(C(C)=O)CC1 Amb20620885 [0,1,0,0,0,0|1,0,2]=4 126 B12R1.256 CC(=O)C1CCN(C(=O)Cl)CC1 Amb25669460 [0,1,0,0,0,0|2,0,1]=4 127 B12R1.256 CC(=O)C1CCN(C(C)=O)CC1 Amb2724241 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.256 CC(=O)N1CC=C(C(=O)O)CC1 Amb35710877 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.256 CC(C)C1CC=C(C(=O)Cl)CC1 Amb25689759 [0,1,0,0,0,0|0,0,2]=3 130 B12R1.256 CC(C)[C@@H]1CC=C(C(=O)O)CC1 Amb27980844 [0,1,0,0,0,0|0,0,2]=3 131 B12R1.256 CS(=O)N1CC=C(C(=O)O)CC1 Amb35704209 [0,1,0,0,0,0|3,0,0]=4 132 B12R1.256 NC(=O)C1=CCC(C(N)=O)CC1 Amb27878648 [0,1,0,0,0,0|2,0,0]=3 133 B12R1.256 NC(=O)N1CC=C(C(=O)O)CC1 Amb29851808 [0,1,0,0,0,0|3,0,0]=4 134 B12R1.256 O=C(Cl)C1=CCC(C(=O)Cl)CC1 Amb27642030 [0,1,0,0,0,0|2,0,0]=3 135 B12R1.256 O=C(O)C1=CCC(C(=O)O)CC1 Amb17594250 [0,1,0,0,0,0|2,0,0]=3 136 B12R1.256 O=C(O)C1=CCC(C(=O)O)NC1 Amb27864177 [0,1,0,0,0,0|3,0,0]=4 137 B12R1.256 O=C(O)C1=CC[C@@H](C(=O)O)NC1 Amb27195903 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.256 O=C(O)C1=COC(C(=O)O)CC1 Amb27875089 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.452 C=C(C)C1CCC(C=O)=CC1=O Amb27175957 [0,1,0,0,0,0|0,0,1]=2 140 B12R1.452 C=C(C)[C@@H]1CCC(C=O)=C[C@H]1O Amb28131925 [0,1,0,0,0,0|0,0,0]=1 141 B12R1.452 C=C(C)[C@H]1CCC(C=O)=C[C@@H]1O Amb28422705 [0,1,0,0,0,0|0,0,0]=1 142 B12R1.452 C=C(C)[C@H]1CCC(CO)=CC1=O Amb27175934 [0,1,0,0,0,0|0,0,3]=4 143 B12R1.452 CC(C)C1CCC(C=O)=CC1=O Amb25347390 [0,1,0,0,0,0|0,0,3]=4 144 B12R1.452 CC(C)C1CCC(C=O)=CC1O Amb18647039 [0,1,0,0,0,0|0,0,2]=3 145 B12R1.452 CC(C)[C@@H]1CCC(C=O)=C[C@H]1O Amb25956495 [0,1,0,0,0,0|0,0,2]=3 146 B12R1.452 CC(C)[C@H]1CCC(C=O)=C[C@@H]1O Amb25327508 [0,1,0,0,0,0|0,0,2]=3 147 B12R1.452 CC(C)[C@H]1CCC(C=O)=C[C@H]1O Amb25912095 [0,1,0,0,0,0|0,0,2]=3 148 B12R1.529 CC(C)C1(O)CC=C(C=O)CC1 Amb28070916 [0,1,0,0,0,0|0,0,2]=3 149 B12R1.529 CC(C)[C@]1(O)CC=C(C=O)CC1 Amb25794090 [0,1,0,0,0,0|0,0,2]=3 150 B10R0.77 C\C=C(\C=O)CCC=C(C)C Amb27673691 [0,0,1,0,0,0|0,0,2]=3 151 B10R0.82 C=C(C)C(Cl)\C=C\C(C)=C/C Amb27965024 [0,0,1,0,0,0|2,0,1]=4 152 B10R0.82 C=CC(=C)CCC(=O)C(=C)C Amb33299423 [0,0,1,0,0,0|2,0,1]=4 153 B10R0.82 C=C\C(C)=C\CC(Cl)C(=C)C Amb27990029 [0,0,1,0,0,0|2,0,0]=3 154 B10R0.82 C=C\C(C)=C\CC(O)C(=C)C Amb26083600 [0,0,1,0,0,0|2,0,0]=3 155 B10R0.82 CC(=O)[C@H](O)C\C=C(\C)C=O Amb27989749 [0,0,1,0,0,0|2,0,0]=3 156 B10R0.82 CC\C(C)=C\CC(C)C(C)=O Amb27673783 [0,0,1,0,0,0|2,0,1]=4 157 B12R2.47 CC1(C)C2CCC(C=O)=C[C@@H]21 Amb27170168 [0,0,0,1,0,0|0,0,2]=3 158 B12R2.47 CC1(C)[C@H]2C=C(C=O)CC[C@H]21 Amb24614765 [0,0,0,1,0,0|0,0,2]=3 159 B12R2.1313 CC1=CC(=O)C2C=CC1CC2 Amb27599341 [0,0,0,1,0,0|0,0,2]=3 160 B12R2.1855 CC(C)C12CC=C(C=O)C1C2 Amb25723718 [0,0,0,1,0,0|0,0,2]=3 161 B12R2.1957 C=CC1=CCC2CC1C2(C)C Amb28348313 [0,0,0,1,0,0|1,0,2]=4 162 B12R2.1957 C=CC1=CC[C@@H]2C[C@H]1C2(C)C Amb25337671 [0,0,0,1,0,0|1,0,2]=4 163 B12R2.1957 CC1(C)C2CC=C(C=O)C1C2 Amb572600 [0,0,0,1,0,0|0,0,2]=3 164 B12R2.1957 CC1(C)C2CC=C(C=O)[C@H]1C2 Amb28351418 [0,0,0,1,0,0|0,0,2]=3 165 B12R2.1957 CC1(C)C2C[C@H]1CC=C2C=O Amb27216618 [0,0,0,1,0,0|0,0,2]=3 166 B12R2.1957 CC1(C)[C@@H]2CC=C(C=O)[C@H]1C2 Amb533031 [0,0,0,1,0,0|0,0,2]=3 167 B12R2.1957 CC1(C)[C@H]2CC=C(C=O)[C@@H]1C2 Amb2719650 [0,0,0,1,0,0|0,0,2]=3 168 B10R1.31 C=C(C)C1CCC(C=O)C1 Amb27830147 [0,0,0,0,1,0|0,0,1]=2 169 B10R1.31 CC(=O)C1CC=C(C#N)C1 Amb28351630 [0,0,0,0,1,0|2,0,1]=4 170 B10R1.31 CC(=O)N1CCC(C=O)C1 Amb22227837 [0,0,0,0,1,0|2,0,1]=4 171 B10R1.31 CC(=O)N1CC[C@H](C=O)C1 Amb27973567 [0,0,0,0,1,0|2,0,1]=4 172 B10R1.31 CC(=O)[C@@H]1CC[C@H](C=O)C1 Amb28052707 [0,0,0,0,1,0|1,0,1]=3 173 B10R1.31 CC(C)C1C=C(C=O)CC1 Amb27827369 [0,0,0,0,1,0|0,0,2]=3 174 B10R1.31 CC(C)C1CCC(C=O)C1 Amb26500515 [0,0,0,0,1,0|0,0,3]=4 175 B10R1.31 CC(O)C1CCN(C=O)C1 Amb28347665 [0,0,0,0,1,0|2,0,1]=4 176 B10R1.31 NC(=S)C1CCN(C=O)C1 Amb35596007 [0,0,0,0,1,0|3,0,0]=4 177 B12R1.4 C=C(C)CN1CC=C(C#N)CC1 Amb27652720 [0,0,0,0,0,1|2,0,1]=4 178 B12R1.4 C=C(C)CN1CCC(C=O)CC1 Amb18798927 [0,0,0,0,0,1|1,0,2]=4 179 B12R1.4 C=C(C)CN1CCN(C=O)CC1 Amb27220501 [0,0,0,0,0,1|2,0,1]=4 180 B12R1.4 CC(=O)OC1CCC(C=O)CC1 Amb26626079 [0,0,0,0,0,1|1,0,2]=4 181 B12R1.4 CC(=O)O[C@H]1CC[C@H](C=O)CC1 Amb27830043 [0,0,0,0,0,1|1,0,2]=4 182 B12R1.4 CC(=O)SC1CCN(C=O)CC1 Amb27237757 [0,0,0,0,0,1|2,0,1]=4 183 B9R0.1 C=C(Br)CCCC(=O)OC Amb24717516 [1,0,1,0,0,0|2,0,0]=4 184 B9R0.1 C=C(C)C#C\C=C(\C)C=O Amb28052621 [1,0,1,0,0,0|0,0,2]=4 185 B9R0.1 C=C(C)CCCC(=O)OC Amb25995990 [1,0,1,0,0,0|1,0,0]=3 186 B9R0.1 C=C(C)CCC[C@H](C)C=O Amb27230540 [1,0,1,0,0,0|0,0,1]=3 187 B9R0.1 C=C(C)CCNC(=O)CCl Amb27974797 [1,0,1,0,0,0|2,0,0]=4 188 B9R0.1 C=C(C)CCNC(=O)CS Amb28144813 [1,0,1,0,0,0|2,0,0]=4 189 B9R0.1 C=C(C)CCNC(=O)OC Amb27247131 [1,0,1,0,0,0|2,0,0]=4 190 B9R0.1 C=C(C)CCOC(=O)CC Amb27770403 [1,0,1,0,0,0|1,0,0]=3 191 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [1,0,1,0,0,0|2,0,0]=4 192 B9R0.1 C=C(C)CC\C=C(/C)C=O Amb27872349 [1,0,1,0,0,0|0,0,0]=2 193 B9R0.1 C=C(C)CC\C=C(\C)C=O Amb28062454 [1,0,1,0,0,0|0,0,0]=2 194 B9R0.1 C=C(C)CC\C=C(\C)CBr Amb27481630 [1,0,1,0,0,0|1,0,1]=4 195 B9R0.1 C=C(C)CC\C=C(\C)CCl Amb27252323 [1,0,1,0,0,0|1,0,1]=4 196 B9R0.1 C=C(C)CNCC(=O)NC Amb27407164 [1,0,1,0,0,0|2,0,0]=4 197 B9R0.1 C=C(C)CONC(=O)CC Amb28142558 [1,0,1,0,0,0|2,0,0]=4 198 B9R0.1 C=C(C)CO\C=C(\C)C=O Amb28130410 [1,0,1,0,0,0|1,0,0]=3 199 B9R0.1 C=C(C)CSCC(=C)CC Amb27424939 [1,0,1,0,0,0|1,0,1]=4 200 B9R0.1 C=C(C=O)CCCC(C)=O Amb8392635 [1,0,1,0,0,0|1,0,0]=3 201 B9R0.1 C=C(C=O)CCOC(C)=O Amb18643822 [1,0,1,0,0,0|2,0,0]=4 202 B9R0.1 C=CC(=O)CCCC(C)=O Amb27409542 [1,0,1,0,0,0|1,0,1]=4 203 B9R0.1 C=CC(=O)NCCC(=C)C Amb27974796 [1,0,1,0,0,0|1,0,1]=4 204 B9R0.1 C=C\C(C)=C/CCC(=C)C Amb28059806 [1,0,1,0,0,0|1,0,0]=3 205 B9R0.1 C=C\C(C)=C\CCC(=C)C Amb27248496 [1,0,1,0,0,0|1,0,0]=3 206 B9R0.1 CC(=O)CC\C=C(/C)C=O Amb18124577 [1,0,1,0,0,0|1,0,0]=3 207 B9R0.1 CC(=O)CC\C=C(\C)C=O Amb27195922 [1,0,1,0,0,0|1,0,0]=3 208 B9R0.1 CC(=O)OC\C=C(/C)C=O Amb17593584 [1,0,1,0,0,0|2,0,0]=4 209 B9R0.1 CC(=O)SC\C=C(\C)C=O Amb28411202 [1,0,1,0,0,0|2,0,0]=4 210 B9R0.1 CCC(=O)NCCC(C)=O Amb17102869 [1,0,1,0,0,0|2,0,0]=4 211 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [1,0,1,0,0,0|1,0,1]=4 212 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [1,0,1,0,0,0|2,0,0]=4 213 B9R0.1 C\C(C=O)=C/CCC(C)O Amb27598642 [1,0,1,0,0,0|1,0,1]=4 214 B9R0.1 C\C(C=O)=C\CCC(C)O Amb27841297 [1,0,1,0,0,0|1,0,1]=4 215 B9R0.50 C=CC(CO)CC\C=C\C Amb27615147 [1,0,1,0,0,0|2,0,0]=4 216 B9R0.50 C=CCCC[C@@H](C=O)OC Amb28049854 [1,0,1,0,0,0|1,0,1]=4 217 B9R0.50 C=C\C=C\CC(C=C)CO Amb28185034 [1,0,1,0,0,0|2,0,0]=4 218 B9R0.50 C=C\C=C\C\C(C=O)=C\C Amb28411213 [1,0,1,0,0,0|0,0,2]=4 219 B9R0.50 CCCCC\C(C=O)=C/N Amb27591489 [1,0,1,0,0,0|1,0,1]=4 220 B9R0.50 CCCC\C=C(/C=O)CCl Amb28319228 [1,0,1,0,0,0|1,0,1]=4 221 B9R0.50 CCCC\C=C(/C=O)SC Amb25324111 [1,0,1,0,0,0|1,0,1]=4 222 B9R0.50 C\C=C(\C=O)CCCCC Amb27443056 [1,0,1,0,0,0|0,0,1]=3 223 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [1,0,1,0,0,0|1,0,0]=3 224 B9R0.7 C=C(C)C(C)\C=C\C(C)=O Amb26010606 [1,0,1,0,0,0|0,0,1]=3 225 B9R0.7 C=C(C)C(Cl)CC=C(C)C Amb27875414 [1,0,1,0,0,0|1,0,1]=4 226 B9R0.7 C=C(C)C(Cl)COC(C)=O Amb28137880 [1,0,1,0,0,0|2,0,0]=4 227 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [1,0,1,0,0,0|2,0,0]=4 228 B9R0.7 C=C(C)C(O)COC(C)=O Amb27170291 [1,0,1,0,0,0|2,0,0]=4 229 B9R0.7 C=C(C)CCC(C)C(C)=O Amb27753284 [1,0,1,0,0,0|1,0,1]=4 230 B9R0.7 C=C(C)[C@@H](C)CCC(C)=O Amb24583145 [1,0,1,0,0,0|0,0,1]=3 231 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [1,0,1,0,0,0|2,0,0]=4 232 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [1,0,1,0,0,0|2,0,0]=4 233 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [1,0,1,0,0,0|2,0,0]=4 234 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [1,0,1,0,0,0|2,0,0]=4 235 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [1,0,1,0,0,0|2,0,0]=4 236 B9R0.24 CCC(C)C\C=C(\C)C=O Amb27493317 [1,0,1,0,0,0|0,0,1]=3 237 B9R0.47 C=C(C)C(O)CC\C=C\C Amb27839343 [1,0,1,0,0,0|2,0,0]=4 238 B9R0.13 C=CCCC(CBr)C(=C)C Amb27233163 [1,0,1,0,0,0|1,0,0]=3 239 B9R0.13 C\C=C\CC(CC)C(C)=O Amb27465073 [1,0,1,0,0,0|1,0,1]=4 240 B9R1.1 C=CC1=CCC(N)CC1 Amb28366097 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.1 C=CC1=CCC(O)CC1 Amb28350279 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.1 C=CN1CCC(=O)CC1 Amb24384226 [2,0,0,0,0,0|1,0,1]=4 243 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [2,0,0,0,0,0|1,0,1]=4 244 B9R1.1 CC1CC=C(C#N)CC1 Amb18642016 [2,0,0,0,0,0|1,0,1]=4 245 B9R1.1 CC1CCC(=CBr)CC1 Amb22227652 [2,0,0,0,0,0|1,0,1]=4 246 B9R1.1 CC1CCC(=CCl)CC1 Amb27858789 [2,0,0,0,0,0|1,0,1]=4 247 B9R1.1 CC1CCC(C=O)CC1 Amb18642467 [2,0,0,0,0,0|0,0,2]=4 248 B9R1.1 CC1CCC(C=O)OC1 Amb27827433 [2,0,0,0,0,0|1,0,1]=4 249 B9R1.1 CC=C1CCC(=O)CC1 Amb28129794 [2,0,0,0,0,0|0,0,2]=4 250 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [2,0,0,0,0,0|0,0,2]=4 251 B9R1.1 CCC1CCC(=O)CC1 Amb6296028 [2,0,0,0,0,0|0,0,2]=4 252 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [2,0,0,0,0,0|1,0,1]=4 253 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [2,0,0,0,0,0|1,0,1]=4 254 B9R1.1 CNC1CCC(=O)NC1 Amb28047809 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.1 CN[C@@H]1CC=C(C)CC1 Amb28049919 [2,0,0,0,0,0|1,0,1]=4 256 B9R1.1 COC1C=CC(=O)CC1 Amb27256443 [2,0,0,0,0,0|1,0,1]=4 257 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [2,0,0,0,0,0|1,0,1]=4 258 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [2,0,0,0,0,0|1,0,1]=4 259 B9R1.1 CSC1C=CC(=O)CC1 Amb27211800 [2,0,0,0,0,0|1,0,1]=4 260 B9R1.1 C[C@H]1CC[C@@H](C=O)CC1 Amb27614173 [2,0,0,0,0,0|0,0,2]=4 261 B9R1.1 C[C@H]1CC[C@H](C=O)CC1 Amb25075627 [2,0,0,0,0,0|0,0,2]=4 262 B9R1.1 O=CC1CC=C(Cl)CC1 Amb18124712 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.1 O=CC1CCC(=O)CC1 Amb8385725 [2,0,0,0,0,0|1,0,1]=4 264 B9R1.6 C=C(C)C1CCCCC1 Amb24478631 [2,0,0,0,0,0|0,0,2]=4 265 B9R1.6 C=C(C)C1CCCNC1 Amb23536695 [2,0,0,0,0,0|1,0,1]=4 266 B9R1.6 C=C(C)C1CCNCC1 Amb23536711 [2,0,0,0,0,0|1,0,1]=4 267 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [2,0,0,0,0,0|1,0,0]=3 268 B9R1.6 CC(=O)C1CCC=CN1 Amb25094747 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.6 CC(=O)C1CCC=NC1 Amb25073951 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [2,0,0,0,0,0|1,0,0]=3 272 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.6 CC(N)C1CC=CCC1 Amb33316363 [2,0,0,0,0,0|1,0,1]=4 274 B9R1.6 CC(O)C1CC=CCC1 Amb26633109 [2,0,0,0,0,0|1,0,1]=4 275 B9R1.6 C[C@@H](N)C1CC=CCC1 Amb33314944 [2,0,0,0,0,0|1,0,1]=4 276 B9R1.6 C[C@@H](O)C1CC=CCC1 Amb33314942 [2,0,0,0,0,0|1,0,1]=4 277 B9R1.6 C[C@H](N)C1CC=CCC1 Amb33314943 [2,0,0,0,0,0|1,0,1]=4 278 B9R1.6 C[C@H](O)C1CC=CCC1 Amb33314845 [2,0,0,0,0,0|1,0,1]=4 279 B9R1.6 N=C(N)C1CC=CCC1 Amb25143265 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.6 N=C(N)C1CC=CCC1 Amb8630598 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.6 NC(=O)C1CC=CCC1 Amb16231370 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.6 NC(=S)C1CC=CCC1 Amb33318647 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.6 O=C(Cl)C1CC=CCC1 Amb10844648 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [2,0,0,0,0,0|2,0,0]=4 288 B11R0.150 C=C(CCC(C)C(=O)O)C(=O)O Amb24065778 [0,1,1,0,0,0|2,0,0]=4 289 B11R1.83 C=CCC1CC=C(C=O)CC1 Amb27256342 [1,1,0,0,0,0|0,0,0]=2 290 B11R1.83 CCC1CCC(=CC=O)CC1 Amb28381127 [1,1,0,0,0,0|0,0,2]=4 291 B11R1.83 C\C=C\C1CCC(C=O)CC1 Amb26477453 [1,1,0,0,0,0|0,0,2]=4 292 B11R1.83 C\C=C\[C@H]1CC[C@@H](C=O)CC1 Amb27195788 [1,1,0,0,0,0|0,0,2]=4 293 B11R1.83 C\C=C\[C@H]1CC[C@H](C=O)CC1 Amb28131417 [1,1,0,0,0,0|0,0,2]=4 294 B11R1.279 C=CC1=CC(O)C(C=C)OC1 Amb28065090 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.279 C=CC1=CCC(C=O)CC1C Amb28321792 [1,1,0,0,0,0|2,0,0]=4 296 B11R1.279 C=CC1=CC[C@@H](C=O)C[C@@H]1C Amb28246538 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.21 C=C(C)C1C=C(C)C(=O)CC1 Amb28141283 [1,1,0,0,0,0|0,0,1]=3 298 B11R1.21 C=C(C)C1CC=C(C)C(=O)C1 Amb9702854 [1,1,0,0,0,0|0,0,2]=4 299 B11R1.21 C=C(C)C1CC=C(C)C(O)C1 Amb9825852 [1,1,0,0,0,0|0,0,1]=3 300 B11R1.21 C=C(C)C1CC=C(C)[C@@H](O)C1 Amb27197549 [1,1,0,0,0,0|0,0,1]=3 301 B11R1.21 C=C(C)C1CCC(C)=C(C)C1 Amb25258161 [1,1,0,0,0,0|0,0,1]=3 302 B11R1.21 C=C(C)C1CCC(C)C(=O)C1 Amb3940292 [1,1,0,0,0,0|0,0,2]=4 303 B11R1.21 C=C(C)[C@@H]1C=CC(=O)[C@H](C)C1 Amb28052437 [1,1,0,0,0,0|0,0,1]=3 304 B11R1.21 C=C(C)[C@@H]1CC=C(C)C(=O)C1 Amb533951 [1,1,0,0,0,0|0,0,2]=4 305 B11R1.21 C=C(C)[C@@H]1CC=C(C)[C@@H](O)C1 Amb24519549 [1,1,0,0,0,0|0,0,1]=3 306 B11R1.21 C=C(C)[C@@H]1CC=C(C)[C@H](N)C1 Amb27620466 [1,1,0,0,0,0|0,0,1]=3 307 B11R1.21 C=C(C)[C@@H]1CC=C(C)[C@H](O)C1 Amb26566212 [1,1,0,0,0,0|0,0,1]=3 308 B11R1.21 C=C(C)[C@@H]1CC[C@@H](C)C(=O)C1 Amb26925649 [1,1,0,0,0,0|0,0,2]=4 309 B11R1.21 C=C(C)[C@H]1C=C(C)C(=O)CC1 Amb27212534 [1,1,0,0,0,0|0,0,1]=3 310 B11R1.21 C=C(C)[C@H]1CC=C(C)C(=O)C1 Amb2718755 [1,1,0,0,0,0|0,0,2]=4 311 B11R1.21 C=C(C)[C@H]1CC=C(C)C(N)C1 Amb10842059 [1,1,0,0,0,0|0,0,1]=3 312 B11R1.21 C=C(C)[C@H]1CC=C(C)C(O)C1 Amb25920813 [1,1,0,0,0,0|0,0,1]=3 313 B11R1.21 C=C(C)[C@H]1CC=C(C)[C@@H](Cl)C1 Amb27433890 [1,1,0,0,0,0|0,0,1]=3 314 B11R1.21 C=C(C)[C@H]1CC=C(C)[C@@H](O)C1 Amb26987622 [1,1,0,0,0,0|0,0,1]=3 315 B11R1.21 C=C(C)[C@H]1CC=C(C)[C@H](O)C1 Amb28076908 [1,1,0,0,0,0|0,0,1]=3 316 B11R1.21 C=C(C)[C@H]1CCC(=C)[C@H](N)C1 Amb28368108 [1,1,0,0,0,0|0,0,1]=3 317 B11R1.21 C=C(C)[C@H]1CCC(=C)[C@H](O)C1 Amb27452430 [1,1,0,0,0,0|0,0,1]=3 318 B11R1.21 C=C(C)[C@H]1CCC(=O)[C@@H](C)C1 Amb27427769 [1,1,0,0,0,0|0,0,1]=3 319 B11R1.21 C=C(C)[C@H]1CCC(C)C(=O)C1 Amb27164605 [1,1,0,0,0,0|0,0,2]=4 320 B11R1.21 C=C(C)[C@H]1CC[C@H](C)C(=O)C1 Amb6600487 [1,1,0,0,0,0|0,0,2]=4 321 B11R1.21 C=C1CCC(C(=C)C)CC1O Amb27831439 [1,1,0,0,0,0|0,0,1]=3 322 B11R1.21 C=C1CCC(C(C)=O)CC1=C Amb24363799 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.21 C=C1CCC(C(C)=O)CC1O Amb27176394 [1,1,0,0,0,0|1,0,1]=4 324 B11R1.21 C=C1CCC(C(C)C)CC1=O Amb27212483 [1,1,0,0,0,0|0,0,2]=4 325 B11R1.21 C=C1CC[C@@H](C(=C)C)CC1O Amb17617403 [1,1,0,0,0,0|0,0,1]=3 326 B11R1.21 C=C1CC[C@@H](C(=C)C)C[C@H]1O Amb27653205 [1,1,0,0,0,0|0,0,1]=3 327 B11R1.21 C=C1CC[C@@H](C(C)=O)C[C@@H]1O Amb26875593 [1,1,0,0,0,0|1,0,1]=4 328 B11R1.21 C=C1CC[C@@H](C(C)=O)C[C@H]1O Amb27768041 [1,1,0,0,0,0|1,0,1]=4 329 B11R1.21 C=C1CC[C@H](C(=C)C)CC1O Amb27823756 [1,1,0,0,0,0|0,0,1]=3 330 B11R1.21 C=C1C[C@H](C(=C)C)CC[C@@H]1O Amb27422398 [1,1,0,0,0,0|0,0,2]=4 331 B11R1.21 CC(=O)C1CC=C(C)C(O)C1 Amb27237661 [1,1,0,0,0,0|1,0,1]=4 332 B11R1.21 CC(=O)C1CCC(C)=C(C)C1 Amb25920982 [1,1,0,0,0,0|1,0,1]=4 333 B11R1.21 CC(=O)[C@H]1CC=C(C)[C@@H](O)C1 Amb27433138 [1,1,0,0,0,0|1,0,1]=4 334 B11R1.21 CC(=O)[C@H]1CC=C(C)[C@H](O)C1 Amb27212798 [1,1,0,0,0,0|1,0,1]=4 335 B11R1.22 C=C(C=O)C1CC=C(C)CC1 Amb18125173 [1,1,0,0,0,0|0,0,2]=4 336 B11R1.22 C=C(CCl)C1CC=C(C)CC1 Amb28071054 [1,1,0,0,0,0|0,0,1]=3 337 B11R1.22 C=C(CCl)[C@H]1CC=C(C)CC1 Amb27477786 [1,1,0,0,0,0|0,0,1]=3 338 B11R1.22 C=C(CN)[C@@H]1CC=C(C)CC1 Amb28323112 [1,1,0,0,0,0|0,0,1]=3 339 B11R1.22 C=C(CO)C1CC=C(C)CC1 Amb25149575 [1,1,0,0,0,0|0,0,1]=3 340 B11R1.22 C=C(CO)[C@@H]1CC=C(C)CC1 Amb28366918 [1,1,0,0,0,0|0,0,1]=3 341 B11R1.22 C=C1CCC(C(=C)CO)CC1 Amb24733840 [1,1,0,0,0,0|0,0,1]=3 342 B11R1.22 C=C1CCC(C(=O)OC)CC1 Amb26026534 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.22 C=C1CCC(C(C)C=O)CC1 Amb28397507 [1,1,0,0,0,0|0,0,2]=4 344 B11R1.22 CC1=CCC(C(=O)CCl)CC1 Amb27165699 [1,1,0,0,0,0|1,0,1]=4 345 B11R1.22 CC1=CCC([C@@H](C)C=O)CC1 Amb27948724 [1,1,0,0,0,0|0,0,2]=4 346 B11R1.22 CC1=CC[C@H]([C@@H](C)C=O)CC1 Amb27488233 [1,1,0,0,0,0|0,0,2]=4 347 B11R1.22 CNC(=O)C1CCC(=O)CC1 Amb26327084 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.22 COC(=O)C1C=CC(=O)CC1 Amb27948565 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.22 COC(=O)C1CC=C(Br)CC1 Amb24749863 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.22 COC(=O)C1CC=C(C)CC1 Amb22493627 [1,1,0,0,0,0|1,0,1]=4 351 B11R1.22 COC(=O)C1CCC(=O)CC1 Amb4477304 [1,1,0,0,0,0|1,0,1]=4 352 B11R1.22 COC(=O)C1CCC(=O)NC1 Amb19957331 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.22 COC(=O)C1CCC(=O)SC1 Amb27445750 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.22 COC(=O)[C@@H]1CC=C(C)CC1 Amb26337856 [1,1,0,0,0,0|1,0,1]=4 355 B11R1.22 COC(=O)[C@@H]1CCC(=O)NC1 Amb27633633 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.22 COC(=O)[C@H]1CC=C(C)CC1 Amb25684213 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 Amb27965494 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.166 C=C(C)C1CC=C(C)CC1=O Amb24625828 [1,1,0,0,0,0|0,0,2]=4 359 B11R1.166 C=C(C)C1CC=C(C)CC1O Amb27967264 [1,1,0,0,0,0|0,0,1]=3 360 B11R1.166 C=C(C)C1CCC(C)=CC1=O Amb26062070 [1,1,0,0,0,0|0,0,2]=4 361 B11R1.166 C=C(C)[C@@H]1CC=C(C)CC1O Amb26887233 [1,1,0,0,0,0|0,0,1]=3 362 B11R1.166 C=C(C)[C@@H]1CCC(=O)C[C@H]1O Amb28202205 [1,1,0,0,0,0|0,0,1]=3 363 B11R1.166 C=C(C)[C@@H]1CCC(C)=C[C@H]1O Amb27448156 [1,1,0,0,0,0|0,0,1]=3 364 B11R1.166 C=C(C)[C@H]1CCC(=O)C[C@@H]1O Amb27428321 [1,1,0,0,0,0|0,0,1]=3 365 B11R1.166 C=C(C)[C@H]1CCC(C)=CC1=O Amb28461259 [1,1,0,0,0,0|0,0,2]=4 366 B11R1.166 C=C(C)[C@H]1CCC(C)=C[C@@H]1O Amb28069432 [1,1,0,0,0,0|0,0,1]=3 367 B11R1.166 CC(=O)C1CC=C(C)CC1O Amb27802705 [1,1,0,0,0,0|1,0,1]=4 368 B11R1.166 CC(=O)C1CCC(=O)C=C1C Amb28194490 [1,1,0,0,0,0|1,0,1]=4 369 B11R1.166 CC(=O)C1CCC(=O)NC1C Amb27848310 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.166 CC(=O)C1CCC(C)=CC1C Amb25100211 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.166 CC(=O)[C@@H]1CC=C(C)C[C@H]1C Amb28052227 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.166 CC(=O)[C@@H]1CC=C(C)C[C@H]1Cl Amb28436857 [1,1,0,0,0,0|1,0,1]=4 373 B11R1.166 CC(=O)[C@@H]1CCC(=O)C[C@@H]1C Amb24571662 [1,1,0,0,0,0|1,0,1]=4 374 B11R1.166 CC(=O)[C@@H]1CCC(C)=C[C@@H]1C Amb27632382 [1,1,0,0,0,0|1,0,1]=4 375 B11R1.166 CC(=O)[C@H]1CC=C(C)C[C@@H]1O Amb28285903 [1,1,0,0,0,0|1,0,1]=4 376 B11R1.166 CC(=O)[C@H]1CCC(=O)C[C@H]1C Amb26032690 [1,1,0,0,0,0|1,0,1]=4 377 B11R1.166 CC(=O)[C@H]1CCC(C)=C[C@H]1C Amb27768049 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.220 C=C(C)C1(N)CC=C(C)CC1 Amb25096389 [1,1,0,0,0,0|0,0,1]=3 379 B11R1.220 C=C(C)C1(O)CC=C(C)CC1 Amb27751715 [1,1,0,0,0,0|0,0,1]=3 380 B11R1.220 CC(=O)C1(C)C=CC(=O)CC1 Amb28351549 [1,1,0,0,0,0|1,0,1]=4 381 B11R1.220 CC(=O)C1(C)CCC(=O)CC1 Amb22497449 [1,1,0,0,0,0|1,0,1]=4 382 B11R1.220 CC(=O)C1(O)CC=C(C)CC1 Amb27475439 [1,1,0,0,0,0|1,0,1]=4 383 B11R1.220 CC(=O)[C@@]1(Cl)CC=C(C)CC1 Amb28285894 [1,1,0,0,0,0|1,0,1]=4 384 B11R1.220 CC(=O)[C@]1(O)CC=C(C)CC1 Amb26847058 [1,1,0,0,0,0|1,0,1]=4 385 B11R1.44 CNC(=O)C1CCN(C=O)C1 Amb27867559 [0,1,0,0,1,0|2,0,0]=4 386 B11R1.44 COC(=O)C1CC(C=O)=CN1 Amb25065170 [0,1,0,0,1,0|2,0,0]=4 387 B11R1.44 COC(=O)C1CCC(C=O)C1 Amb18644789 [0,1,0,0,1,0|1,0,1]=4 388 B11R1.44 COC(=O)N1C=C(C=O)CC1 Amb18125828 [0,1,0,0,1,0|2,0,0]=4 389 B11R1.44 COC(=O)[C@@H]1CC[C@@H](C=O)C1 Amb25335264 [0,1,0,0,1,0|1,0,1]=4 390 B11R1.44 COC(=O)[C@@H]1CC[C@H](C=O)C1 Amb27799242 [0,1,0,0,1,0|1,0,1]=4 391 B11R1.44 COC(=O)[C@H]1CC[C@@H](C=O)C1 Amb32757572 [0,1,0,0,1,0|1,0,1]=4 392 B11R1.175 C=C(C)C1CC(C(=O)Cl)=CO1 Amb25831190 [0,1,0,0,1,0|1,0,0]=3 393 B11R1.175 C=C(C)C1CCC(C(C)=O)C1 Amb28201073 [0,1,0,0,1,0|0,0,1]=3 394 B11R1.175 C=C(C)C1CN[C@H](C(=O)O)C1 Amb26474274 [0,1,0,0,1,0|1,0,1]=4 395 B11R1.175 C=C(C)[C@@H]1CC=C(C(C)=O)C1 Amb25074473 [0,1,0,0,1,0|0,0,0]=2 396 B11R1.175 C=C(C)[C@@H]1CN[C@H](C(=O)O)C1 Amb26552795 [0,1,0,0,1,0|1,0,1]=4 397 B11R1.175 C=C(C)[C@H]1CC=C(C(C)=O)C1 Amb27470722 [0,1,0,0,1,0|0,0,0]=2 398 B11R1.175 C=C(C)[C@H]1CN[C@@H](C(=O)O)C1 Amb27446209 [0,1,0,0,1,0|1,0,1]=4 399 B11R1.175 C=C(C)[C@H]1CN[C@H](C(=O)O)C1 Amb26527939 [0,1,0,0,1,0|1,0,1]=4 400 B11R1.175 CC(=O)C1=CC(C(C)C)CC1 Amb27434213 [0,1,0,0,1,0|0,0,2]=4 401 B11R1.175 CC(=O)C1=CCC(C(C)C)C1 Amb24485808 [0,1,0,0,1,0|0,0,2]=4 402 B11R1.175 CC(=O)C1=CC[C@H](C(C)C)C1 Amb28182536 [0,1,0,0,1,0|0,0,2]=4 403 B11R1.175 CC(=O)C1CCC(C(=O)O)C1 Amb24373216 [0,1,0,0,1,0|1,0,1]=4 404 B11R1.175 CC(=O)C1CCN(C(C)=O)C1 Amb27642976 [0,1,0,0,1,0|2,0,0]=4 405 B11R1.175 CC(=O)[C@@H]1CC[C@H](C(=O)O)C1 Amb28052085 [0,1,0,0,1,0|1,0,1]=4 406 B11R1.175 CC(=O)[C@H]1CC[C@H](C(=O)O)C1 Amb28052084 [0,1,0,0,1,0|1,0,1]=4 407 B11R1.175 CC(C)[C@H]1C=C(C(=O)O)CC1 Amb24680952 [0,1,0,0,1,0|0,0,2]=4 408 B11R1.175 CN(C)C1CC=C(C(=O)O)C1 Amb35587139 [0,1,0,0,1,0|1,0,1]=4 409 B13R1.653 CC(=O)OC1COC(C=O)=CC1O Amb27199132 [0,1,0,0,0,1|2,0,0]=4 410 B13R1.537 C#CC(O)C1=CCC(C(=C)C)CC1 Amb27179465 [0,2,0,0,0,0|0,0,2]=4 411 B13R1.537 C=C(C)C1CC=C(C(O)CO)CC1 Amb27761638 [0,2,0,0,0,0|0,0,2]=4 412 B13R1.537 C=C(C)[C@@H]1CC=C(C(O)CC)CC1 Amb27662184 [0,2,0,0,0,0|0,0,2]=4 413 B13R1.537 C=C(C)[C@@H]1CC=C([C@@H](O)CC)CC1 Amb28065955 [0,2,0,0,0,0|0,0,2]=4 414 B13R1.537 C=CC(=O)N1CC=C(C(=O)O)CC1 Amb35710879 [0,2,0,0,0,0|2,0,0]=4 415 B13R1.537 CCC(=O)N1CC=C(C(=O)O)CC1 Amb35710880 [0,2,0,0,0,0|2,0,0]=4 416 B13R1.537 CNC(=O)N1CC=C(C(=O)O)CC1 Amb29851809 [0,2,0,0,0,0|2,0,0]=4 417 B13R1.537 COC(=O)C1=CCC(C(=O)O)CC1 Amb27187214 [0,2,0,0,0,0|2,0,0]=4 418 B13R1.537 COC(=O)C1CCC(C(N)=O)=CO1 Amb28239665 [0,2,0,0,0,0|2,0,0]=4 419 B13R1.537 COC(=O)N1CC=C(C(=O)O)CC1 Amb29851810 [0,2,0,0,0,0|2,0,0]=4 420 B13R1.537 NCC(=O)N1CC=C(C(=O)O)CC1 Amb35680150 [0,2,0,0,0,0|2,0,0]=4 421 B13R1.338 CC(=O)C1=CCC(C(C)(C)C)CC1 Amb25300478 [0,2,0,0,0,0|0,0,2]=4 422 B13R1.338 CC(C)(C)C1CC=C(C(=O)O)CC1 Amb2616695 [0,2,0,0,0,0|0,0,2]=4 423 B13R1.338 CC(C)(O)C1CC=C(C(=O)O)CC1 Amb26585235 [0,2,0,0,0,0|0,0,2]=4 424 B13R1.338 CC(C)(O)[C@@H]1CC=C(C(=O)O)CC1 Amb25846416 [0,2,0,0,0,0|0,0,2]=4 425 B13R1.338 CC(C)(O)[C@H]1CC=C(C(=O)O)CC1 Amb27865657 [0,2,0,0,0,0|0,0,2]=4 426 B13R1.144 C=C(C)C1CC=C(CCO)C(O)C1 Amb27605294 [0,2,0,0,0,0|0,0,2]=4 427 B13R1.3096 C=C(C)[C@@H]1CC=C(CO)[C@@H](O)[C@@H]1O Amb27443238 [0,2,0,0,0,0|0,0,2]=4 428 B13R1.5944 C=CC1(C)CCC(C(=C)C)CC1=O Amb27861492 [0,2,0,0,0,0|1,0,1]=4 429 B13R1.74 C=C(C)[C@@H]1CC=C(\C=C\C=O)CC1 Amb27854692 [0,2,0,0,0,0|0,0,0]=2 430 B13R1.8764 C=C(C)[C@]1(O)CC[C@@H](C(=O)O)CC1 Amb27657673 [0,2,0,0,0,0|0,0,2]=4 431 B11R1.43 CC(=O)OC1C=C(C=O)CC1 Amb18125682 [0,0,1,1,0,0|2,0,0]=4 432 B11R1.511 CC1=CC[C@H](C)C(C)(C)C1=O Amb28381118 [0,0,1,1,0,0|0,0,2]=4 433 B11R1.1270 CC1=CCC(C)(C(=O)Cl)C1=O Amb25760656 [0,0,1,1,0,0|2,0,0]=4 434 B11R1.1270 CC1=CCC(C)(C(C)C)C1=O Amb28182524 [0,0,1,1,0,0|0,0,2]=4 435 B11R1.180 CN1CCCC1C\C=C\C=O Amb33320706 [0,0,1,1,0,0|1,0,1]=4 436 B11R1.268 CCC1CC=CC(=O)C1(C)C Amb27785512 [0,0,1,1,0,0|0,0,2]=4 437 B11R1.268 CC[C@H]1CC=CC(=O)C1(C)C Amb27973096 [0,0,1,1,0,0|0,0,2]=4 438 B11R2.64 O=C1C=CC2CCC1CC2 Amb25145554 [1,0,0,1,0,0|0,0,2]=4 439 B11R2.367 C=C1C(=O)C2CCC1CC2 Amb9783349 [1,0,0,1,0,0|0,0,2]=4 440 B11R2.2021 C=C1C2CCC1(C=O)CC2 Amb27402645 [1,0,0,1,0,0|0,0,2]=4 441 B11R2.2086 O=CC12C=CC(CC1)CC2 Amb18643088 [1,0,0,1,0,0|0,0,2]=4 442 B11R2.363 CC1=CC[C@H]2C(=O)C[C@H]2C1 Amb27452821 [1,0,0,1,0,0|1,0,1]=4 443 B11R2.201 CC1=CC(=O)[C@@H]2CC[C@H]1C2 Amb27626840 [0,0,0,1,1,0|0,0,1]=3 444 B11R2.201 O=C1CC(=O)C2CCC1C2 Amb26560433 [0,0,0,1,1,0|1,0,1]=4 445 B13R2.2121 CC1=CC2CC=C(C=O)CC2C1 Amb27770782 [0,0,0,1,0,1|0,0,1]=3 446 B13R2.1621 CC1(C)C2CCC=C(C=O)C1C2 Amb28252420 [0,0,0,1,0,1|0,0,2]=4 447 B13R2.17256 C=C(C)[C@H]1CC[C@]2(C=O)O[C@@H]2C1 Amb27195798 [0,0,0,1,0,1|0,0,2]=4 448 B13R2.186 CC1(C2CC=C(C=O)CC2)CO1 Amb27177665 [0,1,0,1,0,0|0,0,2]=4 449 B13R2.97 CC1(C)CC2C=C(C=O)CCC21 Amb27176153 [0,1,0,1,0,0|0,0,2]=4 450 B13R2.2109 CC1(C)O[C@@H]2C[C@H]1CC=C2C=O Amb27432674 [0,1,0,1,0,0|0,0,2]=4 451 B13R2.428 C=C(C)[C@@H]1CC=C(C2CO2)CC1 Amb27800778 [0,1,0,1,0,0|0,0,2]=4 452 B13R2.4143 CC1(C)C2CC=C(CC=O)C1C2 Amb27646385 [0,1,0,1,0,0|0,0,2]=4 453 B13R2.438 CC(=O)C1=CCC2C(C1)C2(C)C Amb25045865 [0,1,0,1,0,0|0,0,2]=4 454 B13R2.13764 CC(=O)C1=CCC2CC1C2(C)C Amb28290526 [0,1,0,1,0,0|0,0,2]=4 455 B13R2.13764 CC1(C)C2CC=C(C(=O)O)C1C2 Amb17594128 [0,1,0,1,0,0|0,0,2]=4 456 B13R2.13764 CC1(C)C2CC=C(C(N)=O)C1C2 Amb27616374 [0,1,0,1,0,0|0,0,2]=4 457 B13R2.13764 CC1(C)[C@@H]2CC=C(C(=O)O)[C@H]1C2 Amb27859209 [0,1,0,1,0,0|0,0,2]=4 458 B13R2.13764 CC1(C)[C@H]2CC=C(C(=O)O)[C@@H]1C2 Amb28195100 [0,1,0,1,0,0|0,0,2]=4 459 B13R2.9615 CC1C=C(C=O)[C@@H]2C[C@H]1C2(C)C Amb28422766 [0,1,0,1,0,0|0,0,2]=4 460 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [0,0,1,0,1,0|1,0,1]=4 461 B9R0.43 CCN(C=O)CCC(C)=O Amb24458250 [0,0,1,0,1,0|2,0,0]=4 462 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [0,0,1,0,1,0|1,0,1]=4 463 B9R0.43 CC\C(C=O)=C\CC(C)C Amb27640555 [0,0,1,0,1,0|0,0,2]=4 464 B9R0.43 C\C=C(/C=O)COC(C)=O Amb25371691 [0,0,1,0,1,0|2,0,0]=4 465 B9R0.43 C\C=C(/CC)CCC(C)=O Amb25857597 [0,0,1,0,1,0|2,0,0]=4 466 B9R0.43 C\C=C(\C=O)CC=C(C)C Amb28198047 [0,0,1,0,1,0|0,0,2]=4 467 B9R0.42 C=C\C(C)=C/[C@@H](C)C(C)=O Amb25991210 [0,0,1,0,1,0|2,0,0]=4 468 B9R0.42 CC(=O)C(C)\C=C(/C)C=O Amb27753996 [0,0,1,0,1,0|1,0,0]=3 469 B9R0.42 CC(C)=C(C)\C=C(/C)C=O Amb28052687 [0,0,1,0,1,0|0,0,2]=4 470 B9R0.42 C\C(C=O)=C/C(C)C(C)O Amb28252434 [0,0,1,0,1,0|1,0,1]=4 471 B9R1.21 C=CC1CCC(C=C)C1 Amb22351911 [1,0,0,0,1,0|1,0,1]=4 472 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [1,0,0,0,1,0|0,0,2]=4 473 B9R1.21 COC1CCN(C=O)C1 Amb28188409 [1,0,0,0,1,0|2,0,0]=4 474 B9R1.21 CSC1CCN(C=O)C1 Amb27432869 [1,0,0,0,1,0|2,0,0]=4 475 B9R1.21 O=CC1=CCC(C=S)C1 Amb28367237 [1,0,0,0,1,0|1,0,0]=3 476 B9R1.21 O=CC1CCC(C=O)C1 Amb18642420 [1,0,0,0,1,0|1,0,1]=4 477 B9R1.35 C=C(Br)C1COC(=O)C1 Amb25707934 [1,0,0,0,1,0|2,0,0]=4 478 B9R1.35 C=C(C)C1=CC(=O)CC1 Amb27838786 [1,0,0,0,1,0|0,0,1]=3 479 B9R1.35 C=C(C)C1CCC(=O)N1 Amb27196085 [1,0,0,0,1,0|1,0,0]=3 480 B9R1.35 C=C(C)C1CCC(O)C1 Amb27807267 [1,0,0,0,1,0|0,0,2]=4 481 B9R1.35 C=C(C)C1CNC(=O)C1 Amb25921040 [1,0,0,0,1,0|1,0,0]=3 482 B9R1.35 C=C(C)C1CNC(=O)O1 Amb33199198 [1,0,0,0,1,0|2,0,0]=4 483 B9R1.35 C=C(C)C1COC(=O)N1 Amb24477743 [1,0,0,0,1,0|2,0,0]=4 484 B9R1.35 C=C(C)[C@@H]1CC[C@H](O)C1 Amb27857420 [1,0,0,0,1,0|0,0,2]=4 485 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [1,0,0,0,1,0|2,0,0]=4 486 B9R1.35 C=C1CCC(C(C)=O)C1 Amb27476121 [1,0,0,0,1,0|1,0,0]=3 487 B9R1.35 C=C1CCC(C(C)C)C1 Amb28342758 [1,0,0,0,1,0|0,0,2]=4 488 B9R1.35 C=C1CCN(C(C)=O)C1 Amb29879291 [1,0,0,0,1,0|2,0,0]=4 489 B9R1.35 CC(=O)C1C=C(C)CC1 Amb28137737 [1,0,0,0,1,0|1,0,1]=4 490 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [1,0,0,0,1,0|1,0,1]=4 491 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [1,0,0,0,1,0|1,0,0]=3 492 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [1,0,0,0,1,0|2,0,0]=4 493 B9R1.35 CC(=O)C1CNC(=O)C1 Amb27488585 [1,0,0,0,1,0|2,0,0]=4 494 B9R1.35 CC(=O)N1CCC(=O)C1 Amb18832698 [1,0,0,0,1,0|2,0,0]=4 495 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [1,0,0,0,1,0|1,0,0]=3 496 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [1,0,0,0,1,0|2,0,0]=4 497 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [1,0,0,0,1,0|2,0,0]=4 498 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [1,0,0,0,1,0|1,0,0]=3 499 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [1,0,0,0,1,0|2,0,0]=4 500 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [1,0,0,0,1,0|2,0,0]=4 501 B9R1.35 CC(C)C1CCC(=O)C1 Amb25147190 [1,0,0,0,1,0|0,0,2]=4 502 B9R1.35 CC(C)[C@@H]1CCC(=O)C1 Amb27255871 [1,0,0,0,1,0|0,0,2]=4 503 B9R1.35 CC(C)[C@H]1CCC(=O)C1 Amb27589313 [1,0,0,0,1,0|0,0,2]=4 504 B9R1.35 CC(Cl)C1CCC(=O)C1 Amb27983825 [1,0,0,0,1,0|1,0,1]=4 505 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [1,0,0,0,1,0|2,0,0]=4 506 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [1,0,0,0,1,0|2,0,0]=4 507 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [1,0,0,0,1,0|2,0,0]=4 508 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [1,0,0,0,1,0|2,0,0]=4 509 B9R1.95 CC(=O)C1CC(C=O)C1 Amb32669290 [0,0,0,0,2,0|1,0,1]=4 510 B11R1.20 C=C(C)CN1CCC(=O)CC1 Amb6271321 [1,0,0,0,0,1|1,0,1]=4 511 B11R1.20 CC(=N)NC1CCC(=O)NC1 Amb28124170 [1,0,0,0,0,1|2,0,0]=4 512 B11R1.20 CC(=O)NC1CCC(=O)CC1 Amb1162738 [1,0,0,0,0,1|1,0,1]=4 513 B11R1.20 CC(=O)OC1C=CC(=O)CC1 Amb28126635 [1,0,0,0,0,1|1,0,1]=4 514 B11R1.20 CC(=O)OC1CCC(=O)CC1 Amb8391813 [1,0,0,0,0,1|1,0,1]=4 515 B11R1.20 CC(=O)SC1CCC(=O)CC1 Amb26449704 [1,0,0,0,0,1|1,0,1]=4 516 B11R1.266 C=C(C)[C@@H]1CCC=C(C=O)C1 Amb27848984 [0,0,0,0,1,1|0,0,0]=2