0 B9R0.13 C=C(C)C(C#N)NCCC Amb28190390 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.13 C=C(C)C(CBr)CCCC Amb27963319 [0,0,0,0,0,0|2,0,0]=2 2 B9R0.13 C=C(C)C(CC)NCCC Amb27864838 [0,0,0,0,0,0|3,0,0]=3 3 B9R0.13 C=C(C)C(CCCC)NC Amb28319659 [0,0,0,0,0,0|3,0,0]=3 4 B9R0.13 C=C(C)C(CCCCl)NN Amb27587764 [0,0,0,0,0,0|4,0,0]=4 5 B9R0.13 C=C(C)C(CCl)COCC Amb27601918 [0,0,0,0,0,0|3,0,0]=3 6 B9R0.13 C=C(C)C(CO)CCCC Amb27772592 [0,0,0,0,0,0|1,0,0]=1 7 B9R0.13 C=C(C)C(CO)COCC Amb27981657 [0,0,0,0,0,0|2,0,0]=2 8 B9R0.13 C=C(C)C(COCC)NC Amb28046170 [0,0,0,0,0,0|4,0,0]=4 9 B9R0.13 C=C=C(CCCC)C(=O)O Amb27489813 [0,0,0,0,0,0|2,0,2]=4 10 B9R0.13 C=C=C(CCCC)C(C)=O Amb24479207 [0,0,0,0,0,0|1,0,2]=3 11 B9R0.13 C=CC(CCCC)C(=O)O Amb27759693 [0,0,0,0,0,0|2,0,1]=3 12 B9R0.13 C=CC(CCCCl)C(=O)O Amb28072929 [0,0,0,0,0,0|3,0,1]=4 13 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.13 C=CC(SCCC)C(=O)O Amb27207894 [0,0,0,0,0,0|3,0,1]=4 15 B9R0.13 C=CCCC(CBr)C(=C)C Amb27233163 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.13 C=CCCC(CC)C(=O)O Amb28050061 [0,0,0,0,0,0|2,0,2]=4 17 B9R0.13 C=CCCC(CO)C(C)C Amb27835043 [0,0,0,0,0,0|1,0,3]=4 18 B9R0.13 C=CCCC(OC)C(C)=O Amb27267298 [0,0,0,0,0,0|2,0,2]=4 19 B9R0.13 C=CCC[C@@H](CC)C(=O)O Amb27595843 [0,0,0,0,0,0|2,0,2]=4 20 B9R0.13 C=C[C@@H](CCCC)C(=O)O Amb28050245 [0,0,0,0,0,0|2,0,1]=3 21 B9R0.13 C=C[C@H](CCCC)C(=O)O Amb27838910 [0,0,0,0,0,0|2,0,1]=3 22 B9R0.13 CC#CCC(C#N)C(C)=O Amb28199860 [0,0,0,0,0,0|1,0,3]=4 23 B9R0.13 CC(=O)C(CO)CCCCl Amb27249647 [0,0,0,0,0,0|1,0,0]=1 24 B9R0.13 CC(=O)N(CCCCl)N=O Amb28067742 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.13 CC(=O)\C(CCC=O)=N\O Amb25932591 [0,0,0,0,0,0|2,0,2]=4 26 B9R0.13 CC(C)C(CO)NCCN Amb27586208 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.13 CCC(CCC=O)C(=O)O Amb27216961 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.13 CCC(CCCF)C(C)O Amb28049532 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.13 CCC(CCCO)C(C)O Amb27972744 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.13 CCC(CCOC)C(=O)O Amb25289946 [0,0,0,0,0,0|3,0,0]=3 31 B9R0.13 CCC(CCOC)C(C)=O Amb27601590 [0,0,0,0,0,0|2,0,0]=2 32 B9R0.13 CCC(CCSC)C(=O)O Amb24373794 [0,0,0,0,0,0|3,0,0]=3 33 B9R0.13 CCC(CCSC)C(C)N Amb27978850 [0,0,0,0,0,0|3,0,1]=4 34 B9R0.13 CCC(NCCF)C(=O)O Amb27427562 [0,0,0,0,0,0|4,0,0]=4 35 B9R0.13 CCC(NCCN)C(=O)O Amb28061779 [0,0,0,0,0,0|4,0,0]=4 36 B9R0.13 CCC(NCCO)C(=O)O Amb18115226 [0,0,0,0,0,0|4,0,0]=4 37 B9R0.13 CCC(OCCN)C(=O)O Amb18111197 [0,0,0,0,0,0|4,0,0]=4 38 B9R0.13 CCC(OCCN)C(N)=O Amb27783814 [0,0,0,0,0,0|4,0,0]=4 39 B9R0.13 CCC(OCOC)C(=O)O Amb28072710 [0,0,0,0,0,0|4,0,0]=4 40 B9R0.13 CCC(SCCN)C(=O)O Amb18788222 [0,0,0,0,0,0|4,0,0]=4 41 B9R0.13 CCC(SCCO)C(N)=O Amb18788232 [0,0,0,0,0,0|4,0,0]=4 42 B9R0.13 CCCCC(C#N)C(=O)O Amb27202774 [0,0,0,0,0,0|2,0,1]=3 43 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [0,0,0,0,0,0|1,0,1]=2 44 B9R0.13 CCCCC(C#N)C(N)=O Amb27403940 [0,0,0,0,0,0|2,0,1]=3 45 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [0,0,0,0,0,0|2,0,0]=2 46 B9R0.13 CCCCC(CBr)C(C)C Amb24751694 [0,0,0,0,0,0|2,0,1]=3 47 B9R0.13 CCCCC(CC)=C(C)C Amb25839850 [0,0,0,0,0,0|2,0,1]=3 48 B9R0.13 CCCCC(CC)C(=N)N Amb27622913 [0,0,0,0,0,0|3,0,0]=3 49 B9R0.13 CCCCC(CC)C(=O)Cl Amb3939067 [0,0,0,0,0,0|2,0,0]=2 50 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [0,0,0,0,0,0|2,0,0]=2 51 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22043361 [0,0,0,0,0,0|2,0,0]=2 52 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22053863 [0,0,0,0,0,0|2,0,0]=2 53 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387188 [0,0,0,0,0,0|2,0,0]=2 54 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387190 [0,0,0,0,0,0|2,0,0]=2 55 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8515519 [0,0,0,0,0,0|2,0,0]=2 56 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8516528 [0,0,0,0,0,0|2,0,0]=2 57 B9R0.13 CCCCC(CC)C(C)N Amb24437807 [0,0,0,0,0,0|2,0,1]=3 58 B9R0.13 CCCCC(CC)C(C)O Amb10807396 [0,0,0,0,0,0|1,0,2]=3 59 B9R0.13 CCCCC(CC)C(N)=O Amb3886579 [0,0,0,0,0,0|2,0,0]=2 60 B9R0.13 CCCCC(CC)C(O)O Amb28454128 [0,0,0,0,0,0|2,0,2]=4 61 B9R0.13 CCCCC(CC)[C@@H](C)N Amb33731288 [0,0,0,0,0,0|2,0,1]=3 62 B9R0.13 CCCCC(CC)[C@H](C)N Amb33729332 [0,0,0,0,0,0|2,0,1]=3 63 B9R0.13 CCCCC(CCl)C(C)C Amb27485250 [0,0,0,0,0,0|2,0,1]=3 64 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [0,0,0,0,0,0|2,0,0]=2 65 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [0,0,0,0,0,0|1,0,0]=1 66 B9R0.13 CCCCC(CO)C(C)C Amb28203923 [0,0,0,0,0,0|1,0,1]=2 67 B9R0.13 CCCCC(CO)C(C)Cl Amb28208474 [0,0,0,0,0,0|1,0,1]=2 68 B9R0.13 CCCCC(CO)C(C)O Amb2781829 [0,0,0,0,0,0|0,0,2]=2 69 B9R0.13 CCCCC(CO)N(C)C Amb24116645 [0,0,0,0,0,0|2,0,0]=2 70 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [0,0,0,0,0,0|3,0,0]=3 71 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [0,0,0,0,0,0|3,0,0]=3 72 B9R0.13 CCCCC(NCl)C(=O)O Amb27863591 [0,0,0,0,0,0|3,0,0]=3 73 B9R0.13 CCCCC(NN)C(=O)O Amb18644274 [0,0,0,0,0,0|3,0,0]=3 74 B9R0.13 CCCCC(NO)C(=O)O Amb27619251 [0,0,0,0,0,0|2,0,0]=2 75 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [0,0,0,0,0,0|3,0,0]=3 76 B9R0.13 CCCCC(OC)C(C)=O Amb27465061 [0,0,0,0,0,0|2,0,0]=2 77 B9R0.13 CCCCN(C#N)C(N)=O Amb28388588 [0,0,0,0,0,0|3,0,1]=4 78 B9R0.13 CCCCN(CC)C(=N)N Amb6682737 [0,0,0,0,0,0|4,0,0]=4 79 B9R0.13 CCCCN(CC)C(=O)Cl Amb17563080 [0,0,0,0,0,0|3,0,0]=3 80 B9R0.13 CCCCN(CC)C(N)=O Amb6246594 [0,0,0,0,0,0|3,0,0]=3 81 B9R0.13 CCCCN(CC)C(N)=S Amb6245925 [0,0,0,0,0,0|3,1,0]=4 82 B9R0.13 CCCCN(CCl)C(=O)Cl Amb27985843 [0,0,0,0,0,0|3,0,0]=3 83 B9R0.13 CCCCN(N=O)C(N)=O Amb24074260 [0,0,0,0,0,0|3,0,1]=4 84 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [0,0,0,0,0,0|2,0,0]=2 85 B9R0.13 CCCC[C@@H](CC)C(C)=O Amb27973070 [0,0,0,0,0,0|1,0,0]=1 86 B9R0.13 CCCC[C@@H](CC)[C@@H](C)O Amb27839212 [0,0,0,0,0,0|1,0,2]=3 87 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [0,0,0,0,0,0|2,0,0]=2 88 B9R0.13 CCCC[C@@H](CO)[C@H](C)Cl Amb27657521 [0,0,0,0,0,0|1,0,1]=2 89 B9R0.13 CCCC[C@@H](CO)[C@H](C)O Amb27979004 [0,0,0,0,0,0|0,0,2]=2 90 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [0,0,0,0,0,0|3,0,0]=3 91 B9R0.13 CCCC[C@@H](NO)C(=O)O Amb27162541 [0,0,0,0,0,0|2,0,0]=2 92 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [0,0,0,0,0,0|2,0,0]=2 93 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [0,0,0,0,0,0|1,0,0]=1 94 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [0,0,0,0,0,0|3,0,0]=3 95 B9R0.13 CCCC[C@H](NC)C(N)=O Amb27264530 [0,0,0,0,0,0|3,0,0]=3 96 B9R0.13 CCCC\C(=N/O)C(=O)O Amb28347572 [0,0,0,0,0,0|2,0,1]=3 97 B9R0.13 CCCC\C(=N/O)C(C)=O Amb27963521 [0,0,0,0,0,0|1,0,1]=2 98 B9R0.13 CCCC\C(=N\O)C(C)=O Amb26348647 [0,0,0,0,0,0|1,0,1]=2 99 B9R0.13 CCCC\C(C=O)=C(/C)Cl Amb27837980 [0,0,0,0,0,0|1,0,3]=4 100 B9R0.13 CCCC\C(CO)=C(/C)Cl Amb28069761 [0,0,0,0,0,0|1,0,1]=2 101 B9R0.13 CCCNC(CC)C(N)=O Amb27873895 [0,0,0,0,0,0|3,0,0]=3 102 B9R0.13 CCCNC(CI)C(C)C Amb27831043 [0,0,0,0,0,0|3,0,1]=4 103 B9R0.13 CCCNC(CN)C(C)C Amb27477306 [0,0,0,0,0,0|3,0,1]=4 104 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [0,0,0,0,0,0|2,1,0]=3 105 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [0,0,0,0,0,0|2,0,0]=2 106 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [0,0,0,0,0,0|3,0,0]=3 107 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [0,0,0,0,0,0|3,0,0]=3 108 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [0,0,0,0,0,0|3,0,0]=3 109 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [0,0,0,0,0,0|2,0,0]=2 110 B9R0.13 CCC\C=C(/CC)C(=O)O Amb25228438 [0,0,0,0,0,0|2,0,2]=4 111 B9R0.13 CCC\C=C(/CC)C(C)=O Amb4017066 [0,0,0,0,0,0|1,0,2]=3 112 B9R0.13 CCC\C=C(\CC)C(C)=O Amb25926099 [0,0,0,0,0,0|1,0,2]=3 113 B9R0.13 CCN(CCC#N)C(C)=O Amb22058982 [0,0,0,0,0,0|3,0,1]=4 114 B9R0.13 CCN(CCCN)C(C)=O Amb8829408 [0,0,0,0,0,0|3,0,0]=3 115 B9R0.13 CCNCC(CC)N(C)C Amb27768714 [0,0,0,0,0,0|4,0,0]=4 116 B9R0.13 CCOCC(CBr)C(C)C Amb25889936 [0,0,0,0,0,0|3,0,1]=4 117 B9R0.13 CCOCC(CCl)C(C)C Amb25795760 [0,0,0,0,0,0|3,0,1]=4 118 B9R0.13 CCOCC(SC)C(N)=O Amb28146021 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.13 CCOC[C@H](NC)C(=O)O Amb33347475 [0,0,0,0,0,0|4,0,0]=4 120 B9R0.13 CCSCC(CC)C(=O)O Amb24482439 [0,0,0,0,0,0|3,0,0]=3 121 B9R0.13 CCSCC(CN)C(=O)O Amb33324076 [0,0,0,0,0,0|3,0,0]=3 122 B9R0.13 CCSC[C@H](CO)N(C)C Amb28206019 [0,0,0,0,0,0|3,0,0]=3 123 B9R0.13 CC[C@@H](OCOC)C(C)=O Amb27203395 [0,0,0,0,0,0|3,0,0]=3 124 B9R0.13 CC\C=C\C(CC)C(=O)O Amb33080288 [0,0,0,0,0,0|2,0,2]=4 125 B9R0.13 CC\C=C\C(CN)C(=O)O Amb33268709 [0,0,0,0,0,0|2,0,2]=4 126 B9R0.13 CC\C=N\[C@H](CO)C(C)C Amb27457692 [0,0,0,0,0,0|2,0,2]=4 127 B9R0.13 CN(C)C(CO)CCCO Amb28247002 [0,0,0,0,0,0|3,0,0]=3 128 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [0,0,0,0,0,0|4,0,0]=4 129 B9R0.13 CNC(CCSC)C(=O)O Amb18792506 [0,0,0,0,0,0|4,0,0]=4 130 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [0,0,0,0,0,0|4,0,0]=4 131 B9R0.13 CN[C@@H](CCOC)C(N)=O Amb27175032 [0,0,0,0,0,0|4,0,0]=4 132 B9R0.13 CN[C@@H](CCSC)C(=O)O Amb26844419 [0,0,0,0,0,0|4,0,0]=4 133 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [0,0,0,0,0,0|4,0,0]=4 134 B9R0.13 CN[C@H](CCSC)C(=O)O Amb27974159 [0,0,0,0,0,0|4,0,0]=4 135 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [0,0,0,0,0,0|4,0,0]=4 136 B9R0.13 COC(CCSC)C(=O)O Amb28288804 [0,0,0,0,0,0|4,0,0]=4 137 B9R0.13 COC(SCCO)C(C)=O Amb27835655 [0,0,0,0,0,0|4,0,0]=4 138 B9R0.13 COCCC(CBr)C(C)C Amb25711707 [0,0,0,0,0,0|3,0,1]=4 139 B9R0.13 COCCC(CCl)C(C)C Amb25707930 [0,0,0,0,0,0|3,0,1]=4 140 B9R0.13 COCCC(CN)C(=O)O Amb24697893 [0,0,0,0,0,0|3,0,0]=3 141 B9R0.13 COCCC(OC)C(=O)O Amb33428673 [0,0,0,0,0,0|4,0,0]=4 142 B9R0.13 COCC\C(=N/O)C(=O)O Amb27628764 [0,0,0,0,0,0|3,0,1]=4 143 B9R0.13 CSCCC(CBr)C(C)C Amb25027965 [0,0,0,0,0,0|3,0,1]=4 144 B9R0.13 CSCCC(CCl)C(C)C Amb27485241 [0,0,0,0,0,0|3,0,1]=4 145 B9R0.13 CSCCC(CN)C(=O)O Amb24618199 [0,0,0,0,0,0|3,0,0]=3 146 B9R0.13 CSCCC(CN)N(C)C Amb2371882 [0,0,0,0,0,0|4,0,0]=4 147 B9R0.13 CSCCC(NCl)C(=O)O Amb27635192 [0,0,0,0,0,0|4,0,0]=4 148 B9R0.13 CSCCC(NF)C(=O)O Amb27233599 [0,0,0,0,0,0|4,0,0]=4 149 B9R0.13 CSCC[C@@H](CN)C(=O)O Amb28458297 [0,0,0,0,0,0|3,0,0]=3 150 B9R0.13 CSCC[C@@H](CO)N(C)C Amb27456303 [0,0,0,0,0,0|3,0,0]=3 151 B9R0.13 C\C=C\CC(CC)C(=O)O Amb18643880 [0,0,0,0,0,0|2,0,2]=4 152 B9R0.13 C\C=C\CC(CC)C(C)=O Amb27465073 [0,0,0,0,0,0|1,0,2]=3 153 B9R0.13 NCC(NCCF)C(=O)O Amb27246937 [0,0,0,0,0,0|4,0,0]=4 154 B9R0.13 NCC(SCCO)C(=O)O Amb27233935 [0,0,0,0,0,0|4,0,0]=4 155 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [0,0,0,0,0,0|2,1,0]=3 156 B9R0.13 NCCC[C@@H](NN)C(=O)O Amb27768758 [0,0,0,0,0,0|4,0,0]=4 157 B9R0.13 NCCNC(CN)C(=O)O Amb28454232 [0,0,0,0,0,0|4,0,0]=4 158 B9R0.13 NCCN[C@@H](CS)C(=O)O Amb27407766 [0,0,0,0,0,0|3,1,0]=4 159 B9R0.13 O=C(O)C(CO)SCCO Amb28196797 [0,0,0,0,0,0|3,0,0]=3 160 B9R0.13 O=C(O)C(CS)NCCO Amb27454918 [0,0,0,0,0,0|3,1,0]=4 161 B9R0.13 O=C(O)[C@H](CS)NCCCl Amb27592190 [0,0,0,0,0,0|3,1,0]=4 162 B9R0.13 O=C(O)[C@H](CS)NCCO Amb27617120 [0,0,0,0,0,0|3,1,0]=4 163 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [1,0,0,0,0,0|1,0,2]=4 164 B8R0.8 C#CCCC(C)C(N)=O Amb28341068 [1,0,0,0,0,0|1,0,2]=4 165 B8R0.8 C#CCCC(O)C(N)=O Amb28057741 [1,0,0,0,0,0|1,0,2]=4 166 B8R0.8 C#CCCN(C)C(C)=O Amb35601310 [1,0,0,0,0,0|1,0,2]=4 167 B8R0.8 C=C(Br)C(O)CCCC Amb27978217 [1,0,0,0,0,0|1,0,1]=3 168 B8R0.8 C=C(C)C(=O)CCCC Amb27968800 [1,0,0,0,0,0|1,0,2]=4 169 B8R0.8 C=C(C)C(C)CCCO Amb28069648 [1,0,0,0,0,0|2,0,0]=3 170 B8R0.8 C=C(C)C(Cl)CCCBr Amb27619001 [1,0,0,0,0,0|3,0,0]=4 171 B8R0.8 C=C(C)C(Cl)CCCC Amb27433963 [1,0,0,0,0,0|2,0,0]=3 172 B8R0.8 C=C(C)C(N)CSCC Amb27252910 [1,0,0,0,0,0|3,0,0]=4 173 B8R0.8 C=C(C)C(O)C#CCC Amb27660888 [1,0,0,0,0,0|1,0,2]=4 174 B8R0.8 C=C(C)C(O)CCCC Amb4037317 [1,0,0,0,0,0|1,0,0]=2 175 B8R0.8 C=C(C)C(O)CCOC Amb27844656 [1,0,0,0,0,0|2,0,0]=3 176 B8R0.8 C=C(C)C(O)CNCC Amb27814109 [1,0,0,0,0,0|2,0,0]=3 177 B8R0.8 C=C(C)C(O)\C=C\CC Amb27651717 [1,0,0,0,0,0|1,0,2]=4 178 B8R0.8 C=C(C)[C@H](O)CCCC Amb28205959 [1,0,0,0,0,0|1,0,0]=2 179 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [1,0,0,0,0,0|1,0,2]=4 180 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [1,0,0,0,0,0|0,0,2]=3 181 B8R0.8 C=C(Cl)C(O)CNCC Amb28342104 [1,0,0,0,0,0|2,0,1]=4 182 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [1,0,0,0,0,0|1,0,2]=4 183 B8R0.8 C=CCCC(C)C(C)=O Amb27470888 [1,0,0,0,0,0|0,0,2]=3 184 B8R0.8 C=CCCC(O)C(=C)C Amb17593327 [1,0,0,0,0,0|1,0,2]=4 185 B8R0.8 C=CCCN(C)C(C)=O Amb28370172 [1,0,0,0,0,0|1,0,2]=4 186 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [1,0,0,0,0,0|1,0,2]=4 187 B8R0.8 C=CCOC(C)C(C)=O Amb27837483 [1,0,0,0,0,0|1,0,2]=4 188 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [1,0,0,0,0,0|1,0,2]=4 189 B8R0.8 CC#CCC(C)C(C)=O Amb28049063 [1,0,0,0,0,0|0,0,2]=3 190 B8R0.8 CC(=O)C(=O)CCCBr Amb27955170 [1,0,0,0,0,0|1,0,2]=4 191 B8R0.8 CC(=O)C(=O)CCCN Amb27666363 [1,0,0,0,0,0|1,0,2]=4 192 B8R0.8 CC(=O)C(C)CCC#N Amb8394545 [1,0,0,0,0,0|1,0,1]=3 193 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [1,0,0,0,0,0|1,0,0]=2 194 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [1,0,0,0,0,0|1,0,0]=2 195 B8R0.8 CC(=O)C(C)CN=C=S Amb27836774 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [1,0,0,0,0,0|2,0,0]=3 197 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [1,0,0,0,0,0|2,0,0]=3 198 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [1,0,0,0,0,0|1,0,1]=3 199 B8R0.8 CC(=O)N(C)CCC#N Amb1035868 [1,0,0,0,0,0|2,0,1]=4 200 B8R0.8 CC(=O)N(C)CCC=O Amb27985872 [1,0,0,0,0,0|2,0,1]=4 201 B8R0.8 CC(=O)N(C)CCCBr Amb28189301 [1,0,0,0,0,0|2,0,0]=3 202 B8R0.8 CC(=O)N(C)CCCN Amb32666496 [1,0,0,0,0,0|2,0,0]=3 203 B8R0.8 CC(=O)N(C)CCCN Amb33533003 [1,0,0,0,0,0|2,0,0]=3 204 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [1,0,0,0,0,0|3,0,0]=4 205 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [1,0,0,0,0,0|2,0,0]=3 206 B8R0.8 CC(=O)[C@H](C)CN=[N+]=[N-] Amb27832175 [1,0,0,0,0,0|3,0,0]=4 207 B8R0.8 CC(Br)C(O)CCCO Amb27658525 [1,0,0,0,0,0|2,0,1]=4 208 B8R0.8 CC(C)=C(C)CCCO Amb27456694 [1,0,0,0,0,0|2,0,1]=4 209 B8R0.8 CC(C)C(C)CCCN Amb17569922 [1,0,0,0,0,0|2,0,1]=4 210 B8R0.8 CC(C)C(O)CCCCl Amb27242357 [1,0,0,0,0,0|2,0,1]=4 211 B8R0.8 CC(C)C(O)CCCN Amb18203175 [1,0,0,0,0,0|2,0,1]=4 212 B8R0.8 CC(C)C(O)CCCO Amb27652039 [1,0,0,0,0,0|2,0,1]=4 213 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [1,0,0,0,0,0|2,0,1]=4 214 B8R0.8 CC(CCC#N)S(C)=O Amb29852641 [1,0,0,0,0,0|2,0,1]=4 215 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [1,0,0,0,0,0|2,0,0]=3 216 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [1,0,0,0,0,0|2,0,0]=3 217 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [1,0,0,0,0,0|2,0,0]=3 218 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [1,0,0,0,0,0|2,0,0]=3 219 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [1,0,0,0,0,0|2,0,0]=3 220 B8R0.8 CC(CCCN)N(C)C Amb17078915 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.8 CC(CCCO)N(C)C Amb27474182 [1,0,0,0,0,0|3,0,0]=4 222 B8R0.8 CC(NCCF)C(N)=O Amb27453201 [1,0,0,0,0,0|3,0,0]=4 223 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [1,0,0,0,0,0|3,0,0]=4 224 B8R0.8 CC(NCCS)C(N)=O Amb27168964 [1,0,0,0,0,0|3,0,0]=4 225 B8R0.8 CC(O)C(C)CCCF Amb28348330 [1,0,0,0,0,0|1,0,2]=4 226 B8R0.8 CC(O)C(C)CCCO Amb28457820 [1,0,0,0,0,0|1,0,2]=4 227 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [1,0,0,0,0,0|3,0,0]=4 228 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [1,0,0,0,0,0|3,0,0]=4 229 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [1,0,0,0,0,0|3,0,0]=4 230 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [1,0,0,0,0,0|3,0,0]=4 231 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [1,0,0,0,0,0|3,0,0]=4 232 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [1,0,0,0,0,0|3,0,0]=4 233 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [1,0,0,0,0,0|1,0,2]=4 234 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [1,0,0,0,0,0|1,0,2]=4 235 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [1,0,0,0,0,0|0,0,2]=3 236 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [1,0,0,0,0,0|2,0,0]=3 237 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [1,0,0,0,0,0|2,0,0]=3 238 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [1,0,0,0,0,0|2,0,0]=3 239 B8R0.8 CCCCC(Br)C(C)O Amb27400344 [1,0,0,0,0,0|1,0,2]=4 240 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [1,0,0,0,0,0|2,0,0]=3 241 B8R0.8 CCCCC(Br)C(N)=S Amb27239240 [1,0,0,0,0,0|2,1,0]=4 242 B8R0.8 CCCCC(C)=C(C)C Amb22228294 [1,0,0,0,0,0|1,0,1]=3 243 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [1,0,0,0,0,0|1,0,0]=2 244 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [1,0,0,0,0,0|0,0,0]=1 245 B8R0.8 CCCCC(C)C(C)C Amb22228295 [1,0,0,0,0,0|1,0,1]=3 246 B8R0.8 CCCCC(C)C(C)Cl Amb27164788 [1,0,0,0,0,0|1,0,1]=3 247 B8R0.8 CCCCC(C)C(C)O Amb4017613 [1,0,0,0,0,0|0,0,2]=3 248 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [1,0,0,0,0,0|1,0,0]=2 249 B8R0.8 CCCCC(C)N(C)C Amb27837632 [1,0,0,0,0,0|2,0,0]=3 250 B8R0.8 CCCCC(C)S(=O)Cl Amb32720495 [1,0,0,0,0,0|2,0,0]=3 251 B8R0.8 CCCCC(C)S(=O)[O-] Amb32754844 [1,0,0,0,0,0|2,0,0]=3 252 B8R0.8 CCCCC(C)S(N)=O Amb32720496 [1,0,0,0,0,0|2,0,0]=3 253 B8R0.8 CCCCC(C)[N+](=O)[O-] Amb27229455 [1,0,0,0,0,0|2,0,0]=3 254 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [1,0,0,0,0,0|2,0,0]=3 255 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [1,0,0,0,0,0|2,0,0]=3 256 B8R0.8 CCCCC(Cl)N(C)C Amb27867830 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [1,0,0,0,0,0|2,0,0]=3 258 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [1,0,0,0,0,0|1,0,0]=2 259 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [1,0,0,0,0,0|2,0,0]=3 260 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [1,0,0,0,0,0|2,0,0]=3 261 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [1,0,0,0,0,0|1,0,0]=2 262 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [1,0,0,0,0,0|1,0,0]=2 263 B8R0.8 CCCCC(N)C(C)O Amb24351619 [1,0,0,0,0,0|1,0,2]=4 264 B8R0.8 CCCCC(N)C(C)O Amb28935013 [1,0,0,0,0,0|1,0,2]=4 265 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [1,0,0,0,0,0|2,0,0]=3 266 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [1,0,0,0,0,0|3,0,0]=4 267 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [1,0,0,0,0,0|1,0,0]=2 268 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [1,0,0,0,0,0|0,0,0]=1 269 B8R0.8 CCCCC(O)C(C)C Amb4017685 [1,0,0,0,0,0|1,0,1]=3 270 B8R0.8 CCCCC(O)C(F)F Amb27780124 [1,0,0,0,0,0|2,0,1]=4 271 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [1,0,0,0,0,0|1,0,0]=2 272 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [1,0,0,0,0,0|2,0,0]=3 273 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [1,0,0,0,0,0|1,1,0]=3 274 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [1,0,0,0,0,0|2,0,0]=3 275 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [1,0,0,0,0,0|2,0,0]=3 276 B8R0.8 CCCCN(C)C(N)=S Amb6247550 [1,0,0,0,0,0|2,1,0]=4 277 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [1,0,0,0,0,0|2,0,0]=3 278 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [1,0,0,0,0,0|1,0,0]=2 279 B8R0.8 CCCC[C@@H](C)[C@H](C)O Amb27763643 [1,0,0,0,0,0|0,0,2]=3 280 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [1,0,0,0,0,0|2,0,0]=3 281 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [1,0,0,0,0,0|2,0,0]=3 282 B8R0.8 CCCC[C@@H](O)C(C)C Amb27474121 [1,0,0,0,0,0|1,0,1]=3 283 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [1,0,0,0,0,0|2,0,0]=3 284 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [1,0,0,0,0,0|1,0,0]=2 285 B8R0.8 CCCC[C@H](C)[C@@H](C)N Amb27851649 [1,0,0,0,0,0|1,0,1]=3 286 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [1,0,0,0,0,0|2,0,0]=3 287 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [1,0,0,0,0,0|2,0,0]=3 288 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [1,0,0,0,0,0|2,0,0]=3 289 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [1,0,0,0,0,0|2,0,0]=3 290 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [1,0,0,0,0,0|1,0,0]=2 291 B8R0.8 CCCC[C@H](O)[C@@H](C)O Amb28139279 [1,0,0,0,0,0|0,0,2]=3 292 B8R0.8 CCCNC(=O)C(C)=O Amb17399819 [1,0,0,0,0,0|1,0,2]=4 293 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [1,0,0,0,0,0|2,0,0]=3 294 B8R0.8 CCCNC(C)C(C)C Amb21959690 [1,0,0,0,0,0|2,0,1]=4 295 B8R0.8 CCCNC(C)C(C)C Amb9724088 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.8 CCCNC(C)C(C)N Amb27834964 [1,0,0,0,0,0|2,0,1]=4 297 B8R0.8 CCCNC(C)C(C)S Amb18644349 [1,0,0,0,0,0|1,1,1]=4 298 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [1,0,0,0,0,0|2,0,0]=3 299 B8R0.8 CCCOC(=O)C(C)=O Amb25838665 [1,0,0,0,0,0|1,0,2]=4 300 B8R0.8 CCCOC(C)C(=N)N Amb28049083 [1,0,0,0,0,0|3,0,0]=4 301 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [1,0,0,0,0,0|2,0,0]=3 302 B8R0.8 CCCOC(C)C(C)N Amb18306548 [1,0,0,0,0,0|2,0,1]=4 303 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [1,0,0,0,0,0|2,0,0]=3 304 B8R0.8 CCCOC(C)[C@@H](C)N Amb27828248 [1,0,0,0,0,0|2,0,1]=4 305 B8R0.8 CCCOC(C)[C@@H](C)O Amb27869773 [1,0,0,0,0,0|1,0,2]=4 306 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [1,0,0,0,0,0|2,0,0]=3 307 B8R0.8 CCCSC(C)C(C)C Amb28429774 [1,0,0,0,0,0|2,0,1]=4 308 B8R0.8 CCCSC(C)C(C)O Amb27482489 [1,0,0,0,0,0|1,0,2]=4 309 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [1,0,0,0,0,0|2,0,0]=3 310 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [1,0,0,0,0,0|3,0,0]=4 311 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [1,0,0,0,0,0|3,0,0]=4 312 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [1,0,0,0,0,0|2,0,0]=3 313 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [1,0,0,0,0,0|1,0,2]=4 314 B8R0.8 CCC\C=C(/C)C(C)=O Amb17593317 [1,0,0,0,0,0|0,0,2]=3 315 B8R0.8 CCC\C=C(/F)C(C)=O Amb27227052 [1,0,0,0,0,0|1,0,2]=4 316 B8R0.8 CCC\N=C(\C)C(C)=O Amb28255004 [1,0,0,0,0,0|1,0,1]=3 317 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [1,0,0,0,0,0|2,0,0]=3 318 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [1,0,0,0,0,0|2,0,0]=3 319 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [1,0,0,0,0,0|2,0,0]=3 320 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [1,0,0,0,0,0|2,0,0]=3 321 B8R0.8 CCN\C=C(\C)C(C)=O Amb27469636 [1,0,0,0,0,0|1,0,2]=4 322 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [1,0,0,0,0,0|3,0,0]=4 323 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [1,0,0,0,0,0|2,0,0]=3 324 B8R0.8 CCOCC(C)C(C)Cl Amb27777113 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.8 CCOCC(C)C(C)O Amb24529048 [1,0,0,0,0,0|1,0,2]=4 326 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [1,0,0,0,0,0|2,0,0]=3 327 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [1,0,0,0,0,0|3,0,0]=4 328 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [1,0,0,0,0,0|3,0,0]=4 329 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [1,0,0,0,0,0|3,0,0]=4 330 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [1,0,0,0,0,0|2,0,0]=3 331 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [1,0,0,0,0,0|3,0,0]=4 332 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [1,0,0,0,0,0|3,0,0]=4 333 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [1,0,0,0,0,0|2,0,0]=3 334 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [1,0,0,0,0,0|2,0,0]=3 335 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [1,0,0,0,0,0|3,0,0]=4 337 B8R0.8 CCONC(C)C(N)=O Amb27228322 [1,0,0,0,0,0|3,0,0]=4 338 B8R0.8 CCO\C=C(/C)C(C)=O Amb26853746 [1,0,0,0,0,0|1,0,2]=4 339 B8R0.8 CCO\C=C(\O)C(C)=O Amb27486167 [1,0,0,0,0,0|1,0,2]=4 340 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [1,0,0,0,0,0|2,0,0]=3 341 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [1,0,0,0,0,0|1,0,0]=2 342 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [1,0,0,0,0,0|2,0,0]=3 344 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [1,0,0,0,0,0|2,0,0]=3 345 B8R0.8 CC\C=C/C(O)C(C)=O Amb28122622 [1,0,0,0,0,0|0,0,2]=3 346 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [1,0,0,0,0,0|1,0,2]=4 347 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [1,0,0,0,0,0|0,0,2]=3 348 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [1,0,0,0,0,0|1,0,2]=4 349 B8R0.8 CN(CCCBr)C(=O)Cl Amb33296940 [1,0,0,0,0,0|3,0,0]=4 350 B8R0.8 CN(CCCCl)C(=O)Cl Amb32668823 [1,0,0,0,0,0|3,0,0]=4 351 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [1,0,0,0,0,0|2,0,0]=3 352 B8R0.8 CNCCN(C)C(=O)S Amb27473520 [1,0,0,0,0,0|3,0,0]=4 353 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [1,0,0,0,0,0|2,0,0]=3 354 B8R0.8 CNCCN(C)C(N)=O Amb27765294 [1,0,0,0,0,0|3,0,0]=4 355 B8R0.8 CNCCN(C)C(N)=O Amb32674843 [1,0,0,0,0,0|3,0,0]=4 356 B8R0.8 CNCCN(C)S(C)=O Amb27186394 [1,0,0,0,0,0|3,0,0]=4 357 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [1,0,0,0,0,0|3,0,0]=4 358 B8R0.8 COCCC(C)C(=O)O Amb18523823 [1,0,0,0,0,0|2,0,0]=3 359 B8R0.8 COCCC(C)S(=O)Cl Amb32720499 [1,0,0,0,0,0|3,0,0]=4 360 B8R0.8 COCCC(C)S(=O)[O-] Amb32754663 [1,0,0,0,0,0|3,0,0]=4 361 B8R0.8 COCCC(C)S(N)=O Amb32720500 [1,0,0,0,0,0|3,0,0]=4 362 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [1,0,0,0,0,0|3,0,0]=4 363 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [1,0,0,0,0,0|3,0,0]=4 364 B8R0.8 COCCC(N)C(=O)O Amb32675454 [1,0,0,0,0,0|3,0,0]=4 365 B8R0.8 COCCC(N)C(=O)O Amb6281324 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.8 COCCC(N)C(N)=O Amb18311365 [1,0,0,0,0,0|3,0,0]=4 367 B8R0.8 COCCC(N)C(N)=O Amb32712112 [1,0,0,0,0,0|3,0,0]=4 368 B8R0.8 COCCC(O)C(=O)O Amb27647966 [1,0,0,0,0,0|2,0,0]=3 369 B8R0.8 COCCC(O)C(C)C Amb20622333 [1,0,0,0,0,0|2,0,1]=4 370 B8R0.8 COCCN(C)C(=O)Cl Amb27595784 [1,0,0,0,0,0|3,0,0]=4 371 B8R0.8 COCCN(C)C(=O)O Amb32677018 [1,0,0,0,0,0|3,0,0]=4 372 B8R0.8 COCCN(C)C(N)=O Amb27475656 [1,0,0,0,0,0|3,0,0]=4 373 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [1,0,0,0,0,0|3,0,0]=4 374 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [1,0,0,0,0,0|3,0,0]=4 375 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [1,0,0,0,0,0|3,0,0]=4 376 B8R0.8 COCOC(C)C(=O)O Amb28120688 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.8 COCOC(C)C(C)=O Amb24563208 [1,0,0,0,0,0|2,0,0]=3 378 B8R0.8 COCSC(C)C(=O)O Amb28410278 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.8 COCSC(C)C(C)=O Amb28189229 [1,0,0,0,0,0|2,0,0]=3 380 B8R0.8 COC\C=C(/C)C(C)=O Amb27838769 [1,0,0,0,0,0|1,0,2]=4 381 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [1,0,0,0,0,0|2,0,0]=3 382 B8R0.8 CSCCC(C)C(C)Br Amb28141386 [1,0,0,0,0,0|2,0,1]=4 383 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [1,0,0,0,0,0|3,0,0]=4 384 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [1,0,0,0,0,0|3,0,0]=4 385 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [1,0,0,0,0,0|3,0,0]=4 386 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [1,0,0,0,0,0|2,0,0]=3 387 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [1,0,0,0,0,0|3,0,0]=4 388 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [1,0,0,0,0,0|3,0,0]=4 389 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [1,0,0,0,0,0|2,0,0]=3 390 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [1,0,0,0,0,0|2,0,0]=3 391 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [1,0,0,0,0,0|2,0,0]=3 392 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [1,0,0,0,0,0|3,0,0]=4 393 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [1,0,0,0,0,0|3,0,0]=4 394 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [1,0,0,0,0,0|3,0,0]=4 395 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [1,0,0,0,0,0|3,0,0]=4 396 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [1,0,0,0,0,0|2,0,0]=3 397 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [1,0,0,0,0,0|3,0,0]=4 398 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [1,0,0,0,0,0|3,0,0]=4 399 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [1,0,0,0,0,0|2,0,0]=3 400 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [1,0,0,0,0,0|3,0,0]=4 401 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [1,0,0,0,0,0|3,0,0]=4 402 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [1,0,0,0,0,0|2,0,0]=3 403 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [1,0,0,0,0,0|3,0,0]=4 404 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [1,0,0,0,0,0|2,0,1]=4 405 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [1,0,0,0,0,0|2,0,0]=3 406 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [1,0,0,0,0,0|3,0,0]=4 407 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [1,0,0,0,0,0|3,0,0]=4 408 B8R0.8 C[C@@H](O)[C@H](O)CCCO Amb27982574 [1,0,0,0,0,0|1,0,2]=4 409 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [1,0,0,0,0,0|3,0,0]=4 410 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [1,0,0,0,0,0|3,0,0]=4 411 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [1,0,0,0,0,0|3,0,0]=4 412 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [1,0,0,0,0,0|3,0,0]=4 413 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [1,0,0,0,0,0|3,0,0]=4 414 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [1,0,0,0,0,0|3,0,0]=4 415 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [1,0,0,0,0,0|3,0,0]=4 416 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [1,0,0,0,0,0|3,0,0]=4 417 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [1,0,0,0,0,0|3,0,0]=4 418 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [1,0,0,0,0,0|1,0,2]=4 419 B8R0.8 C\C=C\CC(C)C(C)=O Amb27799374 [1,0,0,0,0,0|0,0,2]=3 420 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [1,0,0,0,0,0|0,0,2]=3 421 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [1,0,0,0,0,0|1,0,2]=4 422 B8R0.8 C\C=C\C[C@H](C)C(C)=O Amb26891739 [1,0,0,0,0,0|0,0,2]=3 423 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [1,0,0,0,0,0|2,0,1]=4 424 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [1,0,0,0,0,0|2,0,1]=4 425 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [1,0,0,0,0,0|3,0,0]=4 426 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [1,0,0,0,0,0|3,0,0]=4 427 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [1,0,0,0,0,0|3,0,0]=4 428 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [1,0,0,0,0,0|3,0,0]=4 429 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [1,0,0,0,0,0|3,0,0]=4 430 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [1,0,0,0,0,0|3,0,0]=4 431 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [1,0,0,0,0,0|3,0,0]=4 432 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [1,0,0,0,0,0|3,0,0]=4 433 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [1,0,0,0,0,0|3,0,0]=4 434 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [1,0,0,0,0,0|3,0,0]=4 435 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [1,0,0,0,0,0|3,0,0]=4 436 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [1,0,0,0,0,0|3,0,0]=4 437 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [1,0,0,0,0,0|3,0,0]=4 438 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [1,0,0,0,0,0|3,0,0]=4 439 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [1,0,0,0,0,0|3,0,0]=4 440 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [1,0,0,0,0,0|3,0,0]=4 441 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [1,0,0,0,0,0|3,0,0]=4 442 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [1,0,0,0,0,0|3,0,0]=4 443 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [1,0,0,0,0,0|3,0,0]=4 444 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [1,0,0,0,0,0|3,0,0]=4 445 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [1,0,0,0,0,0|2,0,0]=3 446 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [1,0,0,0,0,0|3,0,0]=4 447 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [1,0,0,0,0,0|3,0,0]=4 448 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [1,0,0,0,0,0|3,0,0]=4 449 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [1,0,0,0,0,0|3,0,0]=4 450 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [1,0,0,0,0,0|3,0,0]=4 451 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [1,0,0,0,0,0|3,0,0]=4 452 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [1,0,0,0,0,0|3,0,0]=4 453 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [1,0,0,0,0,0|3,0,0]=4 454 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [1,0,0,0,0,0|3,0,0]=4 455 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [1,0,0,0,0,0|2,0,0]=3 456 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [1,0,0,0,0,0|2,0,0]=3 457 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [1,0,0,0,0,0|2,0,0]=3 458 B8R0.11 C#CC(CC)CCCC Amb28315010 [1,0,0,0,0,0|1,0,2]=4 459 B8R0.11 C#CC(CO)CCCC Amb28460669 [1,0,0,0,0,0|0,0,2]=3 460 B8R0.11 C#CC(CO)NCCC Amb28247937 [1,0,0,0,0,0|1,0,2]=4 461 B8R0.11 C=C=C(CO)CCCC Amb28315430 [1,0,0,0,0,0|0,0,3]=4 462 B8R0.11 C=CC(CBr)OCCC Amb27477649 [1,0,0,0,0,0|2,0,1]=4 463 B8R0.11 C=CC(CC)CCCC Amb28428348 [1,0,0,0,0,0|1,0,1]=3 464 B8R0.11 C=CC(CCCC)NC Amb27173429 [1,0,0,0,0,0|2,0,1]=4 465 B8R0.11 C=CCCC(CC)CO Amb27451634 [1,0,0,0,0,0|0,0,3]=4 466 B8R0.11 C=CCC[C@@H](CC)CO Amb27456440 [1,0,0,0,0,0|0,0,3]=4 467 B8R0.11 C=CCC[C@H](CC)CO Amb27805355 [1,0,0,0,0,0|0,0,3]=4 468 B8R0.11 C=CN(C=O)CCCC Amb28386437 [1,0,0,0,0,0|2,0,1]=4 469 B8R0.11 C=C[C@@H](CO)CCCC Amb27652686 [1,0,0,0,0,0|0,0,1]=2 470 B8R0.11 C=C[C@H](CCl)CCCC Amb27250687 [1,0,0,0,0,0|1,0,1]=3 471 B8R0.11 CCC(C=O)CCC#N Amb27816345 [1,0,0,0,0,0|2,0,1]=4 472 B8R0.11 CCC(C=O)CCCCl Amb18643667 [1,0,0,0,0,0|2,0,0]=3 473 B8R0.11 CCC(CBr)CCOC Amb24353838 [1,0,0,0,0,0|2,0,1]=4 474 B8R0.11 CCC(CBr)CCSC Amb24642363 [1,0,0,0,0,0|2,0,1]=4 475 B8R0.11 CCC(CC)CCCBr Amb24650584 [1,0,0,0,0,0|2,0,1]=4 476 B8R0.11 CCC(CC)CCCCl Amb26982635 [1,0,0,0,0,0|2,0,1]=4 477 B8R0.11 CCC(CC)CCCN Amb25973294 [1,0,0,0,0,0|2,0,1]=4 478 B8R0.11 CCC(CC)CCCO Amb25690952 [1,0,0,0,0,0|2,0,1]=4 479 B8R0.11 CCC(CC)CCCS Amb33225776 [1,0,0,0,0,0|2,0,1]=4 480 B8R0.11 CCC(CC)CCNC Amb24528537 [1,0,0,0,0,0|2,0,1]=4 481 B8R0.11 CCC(CCCBr)OC Amb25758733 [1,0,0,0,0,0|3,0,0]=4 482 B8R0.11 CCC(CCCCl)OC Amb25979072 [1,0,0,0,0,0|3,0,0]=4 483 B8R0.11 CCC(CCCN)OC Amb26440196 [1,0,0,0,0,0|3,0,0]=4 484 B8R0.11 CCC(CCCO)OC Amb28315488 [1,0,0,0,0,0|3,0,0]=4 485 B8R0.11 CCC(CCCS)OC Amb33325359 [1,0,0,0,0,0|3,0,0]=4 486 B8R0.11 CCC(CCNC)OC Amb25977583 [1,0,0,0,0,0|3,0,0]=4 487 B8R0.11 CCC(CCl)CCOC Amb27467384 [1,0,0,0,0,0|2,0,1]=4 488 B8R0.11 CCC(CCl)CCSC Amb24481655 [1,0,0,0,0,0|2,0,1]=4 489 B8R0.11 CCC(CN)CCNC Amb27837124 [1,0,0,0,0,0|2,0,1]=4 490 B8R0.11 CCC(CO)CCCCl Amb27945583 [1,0,0,0,0,0|1,0,1]=3 491 B8R0.11 CCC(CO)CCSC Amb28283745 [1,0,0,0,0,0|1,0,1]=3 492 B8R0.11 CCC(CO)OCOC Amb27763835 [1,0,0,0,0,0|2,0,1]=4 493 B8R0.11 CCCCC(C#N)C=O Amb27775574 [1,0,0,0,0,0|1,0,1]=3 494 B8R0.11 CCCCC(C#N)CC Amb16233596 [1,0,0,0,0,0|1,0,2]=4 495 B8R0.11 CCCCC(C=O)C=O Amb24365233 [1,0,0,0,0,0|0,0,2]=3 496 B8R0.11 CCCCC(C=O)CC Amb534281 [1,0,0,0,0,0|1,0,0]=2 497 B8R0.11 CCCCC(C=O)CO Amb28144205 [1,0,0,0,0,0|0,0,0]=1 498 B8R0.11 CCCCC(C=O)CS Amb27256571 [1,0,0,0,0,0|0,1,0]=2 499 B8R0.11 CCCCC(C=O)SC Amb18124546 [1,0,0,0,0,0|2,0,0]=3 500 B8R0.11 CCCCC(CBr)OC Amb28118948 [1,0,0,0,0,0|2,0,0]=3 501 B8R0.11 CCCCC(CC)CBr Amb3940082 [1,0,0,0,0,0|1,0,1]=3 502 B8R0.11 CCCCC(CC)CCl Amb2720449 [1,0,0,0,0,0|1,0,1]=3 503 B8R0.11 CCCCC(CC)CN Amb2720584 [1,0,0,0,0,0|1,0,1]=3 504 B8R0.11 CCCCC(CC)CO Amb3939324 [1,0,0,0,0,0|0,0,1]=2 505 B8R0.11 CCCCC(CC)ON Amb27978532 [1,0,0,0,0,0|2,0,1]=4 506 B8R0.11 CCCCC(CC)[Mg]Br Amb6300438 [1,0,0,0,0,0|2,0,1]=4 507 B8R0.11 CCCCC(CN)CO Amb27255723 [1,0,0,0,0,0|1,0,1]=3 508 B8R0.11 CCCCC(CN)NC Amb24120146 [1,0,0,0,0,0|2,0,0]=3 509 B8R0.11 CCCCC(CN)OC Amb26656345 [1,0,0,0,0,0|2,0,0]=3 510 B8R0.11 CCCCC(CO)NC Amb24120141 [1,0,0,0,0,0|1,0,0]=2 511 B8R0.11 CCCCC(CO)SC Amb27766567 [1,0,0,0,0,0|1,0,0]=2 512 B8R0.11 CCCCN(C=O)CO Amb28366870 [1,0,0,0,0,0|1,0,0]=2 513 B8R0.11 CCCCN(CC)N=O Amb22055949 [1,0,0,0,0,0|3,0,0]=4 514 B8R0.11 CCCCP(CO)CO Amb25887216 [1,0,0,0,0,0|1,0,2]=4 515 B8R0.11 CCCC[C@@H](CC)CBr Amb27477375 [1,0,0,0,0,0|1,0,1]=3 516 B8R0.11 CCCC[C@@H](CC)CO Amb27659806 [1,0,0,0,0,0|0,0,1]=2 517 B8R0.11 CCCC[C@@H](CO)NC Amb27596040 [1,0,0,0,0,0|1,0,0]=2 518 B8R0.11 CCCC[C@H](C=O)CC Amb27412091 [1,0,0,0,0,0|1,0,0]=2 519 B8R0.11 CCCC[C@H](CO)OC Amb27956602 [1,0,0,0,0,0|1,0,0]=2 520 B8R0.11 CCCC\C(=C\F)CN Amb28411484 [1,0,0,0,0,0|2,0,1]=4 521 B8R0.11 CCCC\C(C=O)=C/N Amb27778578 [1,0,0,0,0,0|1,0,2]=4 522 B8R0.11 CCCC\C(C=O)=C/O Amb27789093 [1,0,0,0,0,0|0,0,2]=3 523 B8R0.11 CCCC\C(C=O)=C\N Amb27389633 [1,0,0,0,0,0|1,0,2]=4 524 B8R0.11 CCCNC(C#N)CO Amb28313006 [1,0,0,0,0,0|2,0,1]=4 525 B8R0.11 CCCNC(CC)CC Amb22587057 [1,0,0,0,0,0|2,0,1]=4 526 B8R0.11 CCCNC(CC)CC Amb6269664 [1,0,0,0,0,0|2,0,1]=4 527 B8R0.11 CCCNC(CC)CO Amb6735190 [1,0,0,0,0,0|1,0,1]=3 528 B8R0.11 CCCNC(CN)CO Amb27593040 [1,0,0,0,0,0|2,0,1]=4 529 B8R0.11 CCCNC(CO)CO Amb27832798 [1,0,0,0,0,0|1,0,2]=4 530 B8R0.11 CCCN[C@@H](CC)CO Amb28079230 [1,0,0,0,0,0|1,0,1]=3 531 B8R0.11 CCCOC(CC)CBr Amb27858689 [1,0,0,0,0,0|2,0,1]=4 532 B8R0.11 CCCOC(CC)CN Amb21953836 [1,0,0,0,0,0|2,0,1]=4 533 B8R0.11 CCCOC(CC)CO Amb28065174 [1,0,0,0,0,0|1,0,1]=3 534 B8R0.11 CCCOC(CN)CO Amb32721463 [1,0,0,0,0,0|2,0,1]=4 535 B8R0.11 CCCOC(CO)CO Amb27485554 [1,0,0,0,0,0|1,0,2]=4 536 B8R0.11 CCCSC(CC)CC Amb27837629 [1,0,0,0,0,0|2,0,1]=4 537 B8R0.11 CCCSC(CC)CN Amb28240061 [1,0,0,0,0,0|2,0,1]=4 538 B8R0.11 CCC\C=C(/C=O)CC Amb24553023 [1,0,0,0,0,0|1,0,2]=4 539 B8R0.11 CCC\C=C(/CC)CO Amb4035898 [1,0,0,0,0,0|0,0,3]=4 540 B8R0.11 CCC\C=C(\C=O)CC Amb2721034 [1,0,0,0,0,0|1,0,2]=4 541 B8R0.11 CCC\C=C(\CC)CO Amb28059781 [1,0,0,0,0,0|0,0,3]=4 542 B8R0.11 CCC\C=C(\CO)OC Amb27443175 [1,0,0,0,0,0|1,0,2]=4 543 B8R0.11 CCNCC(CC)CC Amb6272760 [1,0,0,0,0,0|2,0,1]=4 544 B8R0.11 CCNCC(CC)OC Amb27877521 [1,0,0,0,0,0|3,0,0]=4 545 B8R0.11 CCOCC(C#N)C=O Amb27424726 [1,0,0,0,0,0|2,0,1]=4 546 B8R0.11 CCOCC(CC)CBr Amb26548762 [1,0,0,0,0,0|2,0,1]=4 547 B8R0.11 CCOCC(CC)CCl Amb25828325 [1,0,0,0,0,0|2,0,1]=4 548 B8R0.11 CCOCC(CC)CN Amb28248478 [1,0,0,0,0,0|2,0,1]=4 549 B8R0.11 CCSCC(CN)CO Amb33324014 [1,0,0,0,0,0|2,0,1]=4 550 B8R0.11 CCSCC(CO)OC Amb27835969 [1,0,0,0,0,0|2,0,0]=3 551 B8R0.11 CC[C@@H](CCCBr)OC Amb28343074 [1,0,0,0,0,0|3,0,0]=4 552 B8R0.11 CC[C@@H](CCCO)OC Amb28044111 [1,0,0,0,0,0|3,0,0]=4 553 B8R0.11 CC\C=C\C(C=O)CC Amb18642479 [1,0,0,0,0,0|1,0,2]=4 554 B8R0.11 CC\C=C\C(CC)CO Amb27976640 [1,0,0,0,0,0|0,0,3]=4 555 B8R0.11 CC\C=C\[C@H](CC)CO Amb28049125 [1,0,0,0,0,0|0,0,3]=4 556 B8R0.11 CNC(CCl)CCOC Amb27461735 [1,0,0,0,0,0|3,0,0]=4 557 B8R0.11 CNC(CO)CCOC Amb27423510 [1,0,0,0,0,0|2,0,0]=3 558 B8R0.11 COC(C=O)CCCCl Amb27810864 [1,0,0,0,0,0|3,0,0]=4 559 B8R0.11 COC(CN)CCSC Amb24685780 [1,0,0,0,0,0|3,0,0]=4 560 B8R0.11 COCCC(CN)CO Amb26986134 [1,0,0,0,0,0|2,0,1]=4 561 B8R0.11 COCCC(CO)CO Amb27989242 [1,0,0,0,0,0|1,0,2]=4 562 B8R0.11 CSCCC(CN)CO Amb27262205 [1,0,0,0,0,0|2,0,1]=4 563 B8R0.11 C\C=C\CC(C=O)CC Amb26516035 [1,0,0,0,0,0|1,0,2]=4 564 B8R0.11 C\C=C\CC(CC)CO Amb28315460 [1,0,0,0,0,0|0,0,3]=4 565 B8R0.11 O=CC(CO)NCCO Amb27488657 [1,0,0,0,0,0|2,0,0]=3 566 B8R0.11 O=CNC[C@@H](C=O)CO Amb27952044 [1,0,0,0,0,0|2,0,1]=4 567 B8R0.11 OCCCC(CO)CO Amb27598186 [1,0,0,0,0,0|1,0,2]=4 568 B8R0.15 C=C(C)C(CC)CCO Amb28321566 [1,0,0,0,0,0|3,0,0]=4 569 B8R0.15 C=C(C)C(CCC)NC Amb27667465 [1,0,0,0,0,0|3,0,0]=4 570 B8R0.15 C=C(C)C(CCC)NN Amb27603084 [1,0,0,0,0,0|3,0,0]=4 571 B8R0.15 C=C(C)C(CO)CCBr Amb28205734 [1,0,0,0,0,0|2,0,0]=3 572 B8R0.15 C=C(C)C(CO)OCC Amb27456665 [1,0,0,0,0,0|2,0,0]=3 573 B8R0.15 C=CC(OCC)C(C)=O Amb25691894 [1,0,0,0,0,0|2,0,1]=4 574 B8R0.15 C=CCC(CC)C(C)=O Amb28366808 [1,0,0,0,0,0|1,0,2]=4 575 B8R0.15 C=CC[C@@H](CO)C(=C)C Amb28065995 [1,0,0,0,0,0|1,0,2]=4 576 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [1,0,0,0,0,0|2,0,1]=4 577 B8R0.15 CC(=O)\C(CCO)=N\O Amb27256423 [1,0,0,0,0,0|2,0,1]=4 578 B8R0.15 CC(C)C(CO)CCN Amb27468732 [1,0,0,0,0,0|2,0,1]=4 579 B8R0.15 CC(C)[C@@H](CO)CCO Amb27472565 [1,0,0,0,0,0|2,0,1]=4 580 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [1,0,0,0,0,0|3,0,0]=4 581 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [1,0,0,0,0,0|3,0,0]=4 582 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [1,0,0,0,0,0|3,0,0]=4 583 B8R0.15 CCC(CCN)S(C)=O Amb27873664 [1,0,0,0,0,0|3,0,0]=4 584 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [1,0,0,0,0,0|3,0,0]=4 585 B8R0.15 CCC(COC)C(=O)O Amb18124352 [1,0,0,0,0,0|3,0,0]=4 586 B8R0.15 CCC(COC)C(C)=O Amb27593031 [1,0,0,0,0,0|2,0,0]=3 587 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [1,0,0,0,0,0|3,0,0]=4 588 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [1,0,0,0,0,0|1,0,1]=3 589 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [1,0,0,0,0,0|1,0,2]=4 590 B8R0.15 CCCC(CBr)C(=O)Cl Amb27639323 [1,0,0,0,0,0|2,0,0]=3 591 B8R0.15 CCCC(CBr)C(C)C Amb24478734 [1,0,0,0,0,0|2,0,1]=4 592 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [1,0,0,0,0,0|2,0,0]=3 593 B8R0.15 CCCC(CC)C(C)C Amb26444655 [1,0,0,0,0,0|2,0,1]=4 594 B8R0.15 CCCC(CC)C(C)Cl Amb27837438 [1,0,0,0,0,0|2,0,1]=4 595 B8R0.15 CCCC(CC)C(C)N Amb19007899 [1,0,0,0,0,0|2,0,1]=4 596 B8R0.15 CCCC(CC)S(=O)Cl Amb32720451 [1,0,0,0,0,0|3,0,0]=4 597 B8R0.15 CCCC(CC)S(=O)[O-] Amb32754970 [1,0,0,0,0,0|3,0,0]=4 598 B8R0.15 CCCC(CC)S(N)=O Amb32720452 [1,0,0,0,0,0|3,0,0]=4 599 B8R0.15 CCCC(CC)[C@@H](C)N Amb33738431 [1,0,0,0,0,0|2,0,1]=4 600 B8R0.15 CCCC(CC)[C@H](C)N Amb33743273 [1,0,0,0,0,0|2,0,1]=4 601 B8R0.15 CCCC(CCl)C(C)C Amb26843235 [1,0,0,0,0,0|2,0,1]=4 602 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [1,0,0,0,0,0|2,0,0]=3 603 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [1,0,0,0,0,0|2,0,0]=3 604 B8R0.15 CCCC(CN)C(C)C Amb19023863 [1,0,0,0,0,0|2,0,1]=4 605 B8R0.15 CCCC(CN)C(C)O Amb27253919 [1,0,0,0,0,0|1,0,2]=4 606 B8R0.15 CCCC(CN)N(C)C Amb1131010 [1,0,0,0,0,0|3,0,0]=4 607 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [1,0,0,0,0,0|1,0,0]=2 608 B8R0.15 CCCC(CO)C(C)C Amb27194873 [1,0,0,0,0,0|1,0,1]=3 609 B8R0.15 CCCC(CO)N(C)C Amb24116639 [1,0,0,0,0,0|2,0,0]=3 610 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [1,0,0,0,0,0|3,0,0]=4 611 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [1,0,0,0,0,0|3,0,0]=4 612 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [1,0,0,0,0,0|3,0,0]=4 613 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [1,0,0,0,0,0|3,0,0]=4 614 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [1,0,0,0,0,0|2,0,0]=3 615 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [1,0,0,0,0,0|3,0,0]=4 616 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [1,0,0,0,0,0|2,0,0]=3 617 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [1,0,0,0,0,0|3,0,0]=4 618 B8R0.15 CCCN(CC)C(=O)Cl Amb26023426 [1,0,0,0,0,0|3,0,0]=4 619 B8R0.15 CCCN(CO)C(C)=O Amb27956592 [1,0,0,0,0,0|1,0,0]=2 620 B8R0.15 CCCN(N=O)C(C)=O Amb27259134 [1,0,0,0,0,0|2,0,1]=4 621 B8R0.15 CCCN(OC)C(C)=O Amb27409304 [1,0,0,0,0,0|3,0,0]=4 622 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [1,0,0,0,0,0|1,0,0]=2 623 B8R0.15 CCC[C@@H](CO)[C@H](C)O Amb28315465 [1,0,0,0,0,0|0,0,2]=3 624 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [1,0,0,0,0,0|3,0,0]=4 625 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [1,0,0,0,0,0|3,0,0]=4 626 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [1,0,0,0,0,0|2,0,0]=3 627 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [1,0,0,0,0,0|1,0,0]=2 628 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [1,0,0,0,0,0|3,0,0]=4 629 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [1,0,0,0,0,0|3,0,0]=4 630 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [1,0,0,0,0,0|3,0,0]=4 631 B8R0.15 CCC\C(=C/Br)C(C)=O Amb28366544 [1,0,0,0,0,0|1,0,2]=4 632 B8R0.15 CCC\C(=N/O)C(C)=O Amb24687410 [1,0,0,0,0,0|1,0,1]=3 633 B8R0.15 CCC\C(=N/O)C(N)=O Amb25174964 [1,0,0,0,0,0|2,0,1]=4 634 B8R0.15 CCC\C(=N\O)C(C)=O Amb27599448 [1,0,0,0,0,0|1,0,1]=3 635 B8R0.15 CCN(CCCl)C(C)=O Amb27487959 [1,0,0,0,0,0|3,0,0]=4 636 B8R0.15 CCN(CCN)C(C)=O Amb17046897 [1,0,0,0,0,0|3,0,0]=4 637 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [1,0,0,0,0,0|3,0,0]=4 638 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [1,0,0,0,0,0|3,0,0]=4 639 B8R0.15 CCNC(CC)C(N)=O Amb19006590 [1,0,0,0,0,0|3,0,0]=4 640 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [1,0,0,0,0,0|3,0,0]=4 641 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [1,0,0,0,0,0|3,0,0]=4 642 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [1,0,0,0,0,0|3,0,0]=4 643 B8R0.15 CCOC(CC)C(N)=O Amb8073028 [1,0,0,0,0,0|3,0,0]=4 644 B8R0.15 CCOC(CCl)C(C)=O Amb27254122 [1,0,0,0,0,0|2,0,0]=3 645 B8R0.15 CCOC(CO)C(C)C Amb26631030 [1,0,0,0,0,0|2,0,1]=4 646 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [1,0,0,0,0,0|2,1,0]=4 647 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [1,0,0,0,0,0|3,0,0]=4 648 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [1,0,0,0,0,0|3,0,0]=4 649 B8R0.15 CN(C)C(CO)CCN Amb18203170 [1,0,0,0,0,0|3,0,0]=4 650 B8R0.15 CN(C)C(CO)CCO Amb26361325 [1,0,0,0,0,0|3,0,0]=4 651 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [1,0,0,0,0,0|2,0,0]=3 652 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [1,0,0,0,0,0|2,0,0]=3 653 B8R0.15 COCC(CN)C(=O)O Amb27219429 [1,0,0,0,0,0|3,0,0]=4 654 B8R0.15 COCC(CO)C(C)C Amb24638513 [1,0,0,0,0,0|2,0,1]=4 655 B8R0.15 COCC(NO)C(=O)O Amb27247213 [1,0,0,0,0,0|3,0,0]=4 656 B8R0.15 COC[C@@H](CO)N(C)C Amb27970818 [1,0,0,0,0,0|3,0,0]=4 657 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [1,0,0,0,0,0|3,0,0]=4 658 B8R0.15 C\C=C(/CCC)C(C)=O Amb27206702 [1,0,0,0,0,0|1,0,2]=4 659 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [1,0,0,0,0,0|2,0,1]=4 660 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [1,0,0,0,0,0|3,0,0]=4 661 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [1,0,0,0,0,0|2,0,0]=3 662 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [1,0,0,0,0,0|2,1,0]=4 663 B10R0.17 CC(=O)C(CCC#N)C(C)C Amb27672634 [0,1,0,0,0,0|2,0,1]=4 664 B10R0.17 CC(=O)N(CCCN)C(C)C Amb8829560 [0,1,0,0,0,0|3,0,0]=4 665 B10R0.17 CCCCC(C(=O)O)C(=O)O Amb2759447 [0,1,0,0,0,0|1,0,1]=3 666 B10R0.17 CCCCC(C(=O)O)C(C)C Amb18179821 [0,1,0,0,0,0|2,0,0]=3 667 B10R0.17 CCCCC(C(=O)O)N(C)C Amb18787861 [0,1,0,0,0,0|2,0,1]=4 668 B10R0.17 CCCCC(C(C)=O)=C(C)C Amb27672579 [0,1,0,0,0,0|1,0,2]=4 669 B10R0.17 CCCCC(C(N)=O)C(N)=O Amb341379 [0,1,0,0,0,0|1,0,2]=4 670 B10R0.17 CCCCC(C(N)=O)N(C)C Amb24116643 [0,1,0,0,0,0|3,0,0]=4 671 B10R0.17 CCCC[C@H](C(=O)O)N(C)C Amb32660269 [0,1,0,0,0,0|2,0,1]=4 672 B10R0.17 CCCC\C(C(C)=O)=C(\C)Cl Amb28080095 [0,1,0,0,0,0|1,0,2]=4 673 B10R0.17 CCCNC(C(=O)O)C(C)C Amb10199863 [0,1,0,0,0,0|3,0,0]=4 674 B10R0.17 CCCNC(C(=O)O)C(C)C Amb9703366 [0,1,0,0,0,0|3,0,0]=4 675 B10R0.17 CCCNC(C(N)=O)C(C)C Amb18183290 [0,1,0,0,0,0|3,0,0]=4 676 B10R0.17 CCSCC(C(=O)O)C(C)C Amb33324048 [0,1,0,0,0,0|3,0,0]=4 677 B10R0.17 CNCCN(C(C)=O)C(C)C Amb32696093 [0,1,0,0,0,0|3,0,0]=4 678 B10R0.17 COCCC(C(=O)O)C(C)C Amb18179972 [0,1,0,0,0,0|3,0,0]=4 679 B10R0.17 CSCCC(C(=O)O)C(C)C Amb33429469 [0,1,0,0,0,0|3,0,0]=4 680 B10R0.17 NCCCC(C(=O)O)C(=O)O Amb33621254 [0,1,0,0,0,0|2,0,1]=4 681 B10R0.17 NCCCC(C(=O)O)C(=O)O Amb5395772 [0,1,0,0,0,0|2,0,1]=4 682 B10R0.53 CCC(C)CC(CBr)C(C)C Amb32688740 [0,1,0,0,0,0|2,0,1]=4 683 B10R0.53 CCC(C)CC(CCl)C(C)C Amb32688833 [0,1,0,0,0,0|2,0,1]=4 684 B10R0.53 CCC(C)CC(OC)C(=O)O Amb33227722 [0,1,0,0,0,0|3,0,0]=4 685 B10R0.53 CCC(C)CC(ON)C(=O)O Amb32660232 [0,1,0,0,0,0|3,0,0]=4 686 B10R0.53 CCN(C)C\C(=N\O)C(C)=O Amb27672616 [0,1,0,0,0,0|2,0,1]=4 687 B10R0.53 C\C=C(/C)CC(CO)C(C)=O Amb28080254 [0,1,0,0,0,0|0,0,2]=3 688 B10R0.53 C\C=C(\C)CC(CO)C(C)=O Amb27673559 [0,1,0,0,0,0|0,0,2]=3 689 B10R0.84 C=C(C)[C@H](CO)CC=C(C)C Amb26990619 [0,1,0,0,0,0|1,0,2]=4 690 B10R0.84 CC(=O)\C(CCC(C)C)=N/O Amb27672607 [0,1,0,0,0,0|1,0,1]=3 691 B10R0.84 CC(=O)\C(COC(C)C)=N/O Amb27673813 [0,1,0,0,0,0|2,0,1]=4 692 B10R0.84 CC(C)=C(CO)CCC(C)C Amb4008290 [0,1,0,0,0,0|1,0,1]=3 693 B10R0.84 CC(C)CCC(C#N)C(N)=O Amb18125788 [0,1,0,0,0,0|2,0,1]=4 694 B10R0.84 CC(C)CCC(CBr)C(C)C Amb32688500 [0,1,0,0,0,0|2,0,1]=4 695 B10R0.84 CC(C)CCC(CCl)C(C)C Amb32688673 [0,1,0,0,0,0|2,0,1]=4 696 B10R0.84 CC(C)CCC(CO)C(C)C Amb22730505 [0,1,0,0,0,0|1,0,1]=3 697 B10R0.84 CC(C)CC\C(=N/O)C(=O)O Amb27990214 [0,1,0,0,0,0|2,0,1]=4 698 B10R0.84 CC(C)OCC(CN)C(=O)O Amb33274848 [0,1,0,0,0,0|3,0,0]=4 699 B10R0.84 CCC(CCN(C)C)C(=O)O Amb33273732 [0,1,0,0,0,0|3,0,0]=4 700 B10R0.84 CCC(COC(C)C)C(=O)O Amb32953727 [0,1,0,0,0,0|3,0,0]=4 701 B10R0.84 CCC(SCC(C)C)C(=O)O Amb9284743 [0,1,0,0,0,0|3,0,0]=4 702 B10R0.84 CN(C)CCC(CN)C(=O)O Amb33272650 [0,1,0,0,0,0|3,0,0]=4 703 B10R0.84 COC(CCC(C)C)C(=O)O Amb33359779 [0,1,0,0,0,0|3,0,0]=4 704 B10R0.85 CCCCC(C#N)C(=O)NN Amb27272429 [0,1,0,0,0,0|2,0,1]=4 705 B10R0.85 CCCCC(CC)C(=O)NN Amb7764758 [0,1,0,0,0,0|2,0,0]=3 706 B10R0.85 CCCCC(CC)C(=O)NO Amb7764759 [0,1,0,0,0,0|2,0,0]=3 707 B10R0.85 CCCCC(CC)C(=O)O[Na] Amb22411561 [0,1,0,0,0,0|2,0,0]=3 708 B10R0.85 CCCCC(CN)C(=O)OC Amb33428108 [0,1,0,0,0,0|1,0,0]=2 709 B10R0.85 CCCCC(CO)C(=O)OC Amb33036185 [0,1,0,0,0,0|0,0,0]=1 710 B10R0.85 CCCCC(NC)C(=O)OC Amb18787860 [0,1,0,0,0,0|2,0,0]=3 711 B10R0.85 CCCCN(CC)C(=O)CBr Amb17330722 [0,1,0,0,0,0|2,0,0]=3 712 B10R0.85 CCCCN(CC)C(=O)CCl Amb6279106 [0,1,0,0,0,0|2,0,0]=3 713 B10R0.85 CCCCN(CC)C(=O)CN Amb6266352 [0,1,0,0,0,0|2,0,0]=3 714 B10R0.85 CCCC\C(=N\O)C(=O)OC Amb22276954 [0,1,0,0,0,0|1,0,1]=3 715 B10R0.85 CCOCC(NC)C(=O)OC Amb18788062 [0,1,0,0,0,0|3,0,0]=4 716 B10R0.85 CCSCC(CN)C(=O)OC Amb33323720 [0,1,0,0,0,0|2,0,0]=3 717 B10R0.85 CC\C=C\C(CN)C(=O)OC Amb33267563 [0,1,0,0,0,0|1,0,2]=4 718 B10R0.85 CNC(=O)C(C#N)CCCCl Amb27990036 [0,1,0,0,0,0|2,0,1]=4 719 B10R0.85 COC(=O)C(CN)CCSC Amb33198268 [0,1,0,0,0,0|2,0,0]=3 720 B10R0.85 COCCC(CN)C(=O)OC Amb33377473 [0,1,0,0,0,0|2,0,0]=3 721 B10R0.86 CC#CCCC(CC)C(C)=O Amb27988392 [0,1,0,0,0,0|1,0,1]=3 722 B10R0.86 CCC(OCCCN)C(=O)O Amb18628658 [0,1,0,0,0,0|3,0,0]=4 723 B10R0.86 CCC(OCCNC)C(=O)O Amb18630743 [0,1,0,0,0,0|3,0,0]=4 724 B10R0.86 CCC(SCCCO)C(=O)O Amb17501362 [0,1,0,0,0,0|3,0,0]=4 725 B10R0.86 CCCCCC(CBr)C(C)C Amb32688839 [0,1,0,0,0,0|2,0,1]=4 726 B10R0.86 CCCCCC(CC)C(=O)O Amb18791930 [0,1,0,0,0,0|2,0,0]=3 727 B10R0.86 CCCCCC(CCl)C(C)C Amb32688910 [0,1,0,0,0,0|2,0,1]=4 728 B10R0.86 CCCCCC(OC)C(=O)O Amb32953478 [0,1,0,0,0,0|3,0,0]=4 729 B10R0.86 CCCCSC(CC)C(=O)O Amb9675509 [0,1,0,0,0,0|2,0,0]=3 730 B10R0.86 CCCOCC(CBr)C(C)C Amb32689854 [0,1,0,0,0,0|2,0,1]=4 731 B10R0.86 CCCOCC(CCl)C(C)C Amb32689900 [0,1,0,0,0,0|2,0,1]=4 732 B10R0.86 CCC\C=C\C(CC)C(=O)O Amb33327178 [0,1,0,0,0,0|2,0,1]=4 733 B10R0.86 CCC\C=C\C(CN)C(=O)O Amb33224469 [0,1,0,0,0,0|2,0,1]=4 734 B10R0.86 CCOCCC(CBr)C(C)C Amb32688447 [0,1,0,0,0,0|2,0,1]=4 735 B10R0.86 CCOCCC(CCl)C(C)C Amb32688440 [0,1,0,0,0,0|2,0,1]=4 736 B10R0.86 CCSCCC(CBr)C(C)C Amb32688918 [0,1,0,0,0,0|2,0,1]=4 737 B10R0.86 CCSCCC(CCl)C(C)C Amb32688957 [0,1,0,0,0,0|2,0,1]=4 738 B10R0.86 CCSCCC(OC)C(=O)O Amb33172115 [0,1,0,0,0,0|3,0,0]=4 739 B10R0.86 CN[C@@H](CCCCN)C(=O)O Amb33876452 [0,1,0,0,0,0|3,0,0]=4 740 B10R0.86 COC(CCCSC)C(=O)O Amb33359228 [0,1,0,0,0,0|3,0,0]=4 741 B10R0.86 COCCCC(CBr)C(C)C Amb32688512 [0,1,0,0,0,0|2,0,1]=4 742 B10R0.86 COCCCC(CCl)C(C)C Amb32688585 [0,1,0,0,0,0|2,0,1]=4 743 B10R0.86 COCCCC(OC)C(=O)O Amb33377469 [0,1,0,0,0,0|3,0,0]=4 744 B10R0.86 CSCCCC(CBr)C(C)C Amb32688998 [0,1,0,0,0,0|2,0,1]=4 745 B10R0.86 CSCCCC(CCl)C(C)C Amb32689044 [0,1,0,0,0,0|2,0,1]=4 746 B10R0.88 CCCC(CCCO)C(=O)O Amb33421979 [0,1,0,0,0,0|3,0,0]=4 747 B10R0.88 CCCC(CCCO)C(=O)[O-] Amb17615944 [0,1,0,0,0,0|3,0,0]=4 748 B10R0.88 CCCC(CCCO)C(=O)[O-] Amb33362238 [0,1,0,0,0,0|3,0,0]=4 749 B10R0.88 CCCCC(N=C=S)C(=O)O Amb33471522 [0,1,0,0,0,0|1,1,1]=4 750 B10R0.88 CCCCC(NC=O)C(=O)O Amb18179873 [0,1,0,0,0,0|1,0,2]=4 751 B10R0.88 CCCCC(OCC)C(=O)O Amb33624644 [0,1,0,0,0,0|2,0,0]=3 752 B10R0.88 CCCC[C@@H](N=C=O)C(=O)O Amb33471346 [0,1,0,0,0,0|1,0,2]=4 753 B10R0.88 CCCC[C@@H](N=C=S)C(=O)O Amb33471576 [0,1,0,0,0,0|1,1,1]=4 754 B10R0.88 CCCC[C@@H](NCC)C(=O)O Amb33347490 [0,1,0,0,0,0|2,0,0]=3 755 B10R0.88 CCCC[C@H](N=C=O)C(=O)O Amb33471343 [0,1,0,0,0,0|1,0,2]=4 756 B10R0.88 CCCC[C@H](N=C=S)C(=O)O Amb33471572 [0,1,0,0,0,0|1,1,1]=4 757 B10R0.88 CCCC[C@H](NC=O)C(=O)O Amb33774736 [0,1,0,0,0,0|1,0,2]=4 758 B10R0.88 CCCN(CCCO)C(C)=O Amb18928597 [0,1,0,0,0,0|3,0,0]=4 759 B10R0.88 CCN[C@@H](COCC)C(=O)O Amb33347504 [0,1,0,0,0,0|3,0,0]=4 760 B10R0.88 CCN[C@H](CCSC)C(=O)O Amb33347486 [0,1,0,0,0,0|3,0,0]=4 761 B10R0.88 COCC(CCCBr)C(C)C Amb32691387 [0,1,0,0,0,0|2,0,1]=4 762 B10R0.88 COCC(CCCCl)C(C)C Amb32691386 [0,1,0,0,0,0|2,0,1]=4 763 B10R0.88 COCCN(CCN)C(C)=O Amb32644975 [0,1,0,0,0,0|3,0,0]=4 764 B10R0.101 CCCC(=O)C(C#N)C(C)=O Amb27672445 [0,1,0,0,0,0|1,0,2]=4 765 B10R0.101 CCCC(C)C(C#N)C(=O)O Amb27670726 [0,1,0,0,0,0|2,0,1]=4 766 B10R0.101 CCCC(C)C(C#N)C(N)=O Amb25383194 [0,1,0,0,0,0|2,0,1]=4 767 B10R0.101 CCCC(C)C(CC)C(=O)O Amb33079161 [0,1,0,0,0,0|2,0,0]=3 768 B10R0.101 CCCC(C)C(CN)C(=O)O Amb31295625 [0,1,0,0,0,0|2,0,0]=3 769 B10R0.101 CCC\C(C)=C(/CC)C(C)=O Amb27673757 [0,1,0,0,0,0|1,0,2]=4 770 B10R0.101 CCC\C(C)=C(\CC)C(C)=O Amb28080303 [0,1,0,0,0,0|1,0,2]=4 771 B10R0.101 CCOC(=O)C(CC)C(C)=O Amb4605929 [0,1,0,0,0,0|2,0,1]=4 772 B10R0.101 CCOC(C)C(CC)C(=O)O Amb33427354 [0,1,0,0,0,0|3,0,0]=4 773 B10R0.101 CCOC(C)C(CN)C(=O)O Amb33425723 [0,1,0,0,0,0|3,0,0]=4 774 B10R0.101 CC\C=C(/C)C(CC)C(C)=O Amb28080136 [0,1,0,0,0,0|1,0,2]=4 775 B10R0.101 CC\C=C(\C)C(CC)C(C)=O Amb27672604 [0,1,0,0,0,0|1,0,2]=4 776 B10R0.110 CCCCC(CBr)C(C)(C)C Amb32688658 [0,1,0,0,0,0|2,0,1]=4 777 B10R0.110 CCCCC(CC)S(=O)(=O)Cl Amb32692855 [0,1,0,0,0,0|3,0,0]=4 778 B10R0.110 CCCCC(CC)S(=O)(=O)F Amb33352400 [0,1,0,0,0,0|3,0,0]=4 779 B10R0.110 CCCCC(CC)S(N)(=O)=O Amb32691774 [0,1,0,0,0,0|3,0,0]=4 780 B10R0.110 CCCCC(CCl)C(C)(C)C Amb32688655 [0,1,0,0,0,0|2,0,1]=4 781 B10R0.133 CCC(N)(CCCF)C(=O)O Amb32670158 [0,1,0,0,0,0|3,0,0]=4 782 B10R0.133 CCCCC(C)(C#N)C(C)=O Amb28388154 [0,1,0,0,0,0|1,0,1]=3 783 B10R0.133 CCCCC(C)(CBr)C(C)C Amb32688657 [0,1,0,0,0,0|2,0,1]=4 784 B10R0.133 CCCCC(C)(CCl)C(C)C Amb32688652 [0,1,0,0,0,0|2,0,1]=4 785 B10R0.133 COCCC(C)(C#N)C(C)=O Amb28388155 [0,1,0,0,0,0|2,0,1]=4 786 B10R0.133 CSCCC(C)(C#N)C(C)=O Amb27271795 [0,1,0,0,0,0|2,0,1]=4 787 B10R0.133 C\C=C\C[C@](C)(CO)C(C)=O Amb27672667 [0,1,0,0,0,0|0,0,2]=3 788 B10R0.133 NC(CO)(CCCF)C(=O)O Amb32670160 [0,1,0,0,0,0|2,0,0]=3 789 B10R1.13 C=C(C)C1C=CC(C)CC1 Amb27257923 [0,0,0,1,0,0|2,0,1]=4 790 B10R1.13 C=C(C)C1CC=C(C)CC1 Amb6891970 [0,0,0,1,0,0|2,0,1]=4 791 B10R1.13 C=C(C)C1CCC(O)CC1 Amb27219025 [0,0,0,1,0,0|3,0,0]=4 792 B10R1.13 C=C(C)[C@@H]1CC=C(C)CC1 Amb8514270 [0,0,0,1,0,0|2,0,1]=4 793 B10R1.13 C=C(C)[C@H]1C=C[C@H](C)CC1 Amb22232036 [0,0,0,1,0,0|2,0,1]=4 794 B10R1.13 C=C(C)[C@H]1CC=C(C)CC1 Amb533457 [0,0,0,1,0,0|2,0,1]=4 795 B10R1.13 CC(=N)C1CCC(N)CC1 Amb28246094 [0,0,0,1,0,0|3,0,0]=4 796 B10R1.13 CC(=N)N1CCC(C)CC1 Amb27970811 [0,0,0,1,0,0|3,0,0]=4 797 B10R1.13 CC(=O)C1=CCC(C)CC1 Amb27954211 [0,0,0,1,0,0|1,0,2]=4 798 B10R1.13 CC(=O)C1=NOC(O)CC1 Amb26359393 [0,0,0,1,0,0|2,0,1]=4 799 B10R1.13 CC(=O)C1CC=C(Br)CC1 Amb25756617 [0,0,0,1,0,0|2,0,1]=4 800 B10R1.13 CC(=O)C1CC=C(C)CC1 Amb4025836 [0,0,0,1,0,0|1,0,1]=3 801 B10R1.13 CC(=O)C1CCC(=O)CC1 Amb27597007 [0,0,0,1,0,0|2,0,1]=4 802 B10R1.13 CC(=O)C1CCC(C)CC1 Amb24518062 [0,0,0,1,0,0|1,0,0]=2 803 B10R1.13 CC(=O)C1CCC(C)NC1 Amb28067890 [0,0,0,1,0,0|1,0,0]=2 804 B10R1.13 CC(=O)C1CCC(C)OC1 Amb35732771 [0,0,0,1,0,0|0,0,0]=1 805 B10R1.13 CC(=O)C1CCC(Cl)CC1 Amb24433457 [0,0,0,1,0,0|2,0,0]=3 806 B10R1.13 CC(=O)C1CCC(F)CC1 Amb25127678 [0,0,0,1,0,0|2,0,0]=3 807 B10R1.13 CC(=O)C1CCC(N)CC1 Amb27404739 [0,0,0,1,0,0|2,0,0]=3 808 B10R1.13 CC(=O)C1CCC(O)CC1 Amb26910730 [0,0,0,1,0,0|2,0,0]=3 809 B10R1.13 CC(=O)C1CCN(C)CC1 Amb22756855 [0,0,0,1,0,0|2,0,0]=3 810 B10R1.13 CC(=O)C1CCN(C)CC1 Amb33528228 [0,0,0,1,0,0|2,0,0]=3 811 B10R1.13 CC(=O)N1CCC(Br)CC1 Amb17103718 [0,0,0,1,0,0|3,0,0]=4 812 B10R1.13 CC(=O)N1CCC(Cl)CC1 Amb17103085 [0,0,0,1,0,0|3,0,0]=4 813 B10R1.13 CC(=O)N1CCC(N)CC1 Amb1154254 [0,0,0,1,0,0|3,0,0]=4 814 B10R1.13 CC(=O)N1CCC(N)CC1 Amb2183330 [0,0,0,1,0,0|3,0,0]=4 815 B10R1.13 CC(=O)N1CCC(O)CC1 Amb9245319 [0,0,0,1,0,0|3,0,0]=4 816 B10R1.13 CC(=O)N1CCC(S)CC1 Amb25090984 [0,0,0,1,0,0|3,0,0]=4 817 B10R1.13 CC(=O)N1CCN(C)CC1 Amb22270033 [0,0,0,1,0,0|3,0,0]=4 818 B10R1.13 CC(=O)N1CCN(C)CC1 Amb3362929 [0,0,0,1,0,0|3,0,0]=4 819 B10R1.13 CC(=O)[C@H]1CC[C@@H](N)CC1 Amb33132950 [0,0,0,1,0,0|2,0,0]=3 820 B10R1.13 CC(=O)[C@H]1CC[C@H](N)CC1 Amb28055932 [0,0,0,1,0,0|2,0,0]=3 821 B10R1.13 CC(=O)[C@H]1CC[C@H](N)CC1 Amb30584740 [0,0,0,1,0,0|2,0,0]=3 822 B10R1.13 CC(C)[C@@H]1CO[C@H](C)SC1 Amb26562981 [0,0,0,1,0,0|2,0,1]=4 823 B10R1.13 CC(C)[C@H]1CC[C@@H](C)CC1 Amb22230417 [0,0,0,1,0,0|2,0,1]=4 824 B10R1.13 CC(C)[C@H]1CC[C@H](C)CC1 Amb22231657 [0,0,0,1,0,0|2,0,1]=4 825 B10R1.13 CC(C)[C@H]1CO[C@H](C)SC1 Amb24601778 [0,0,0,1,0,0|2,0,1]=4 826 B10R1.13 CC1=CCC(C(=O)O)CC1 Amb18124574 [0,0,0,1,0,0|2,0,1]=4 827 B10R1.13 CC1C=CC(C(=O)Cl)CC1 Amb25684699 [0,0,0,1,0,0|2,0,1]=4 828 B10R1.13 CC1CCC(C(=N)N)CC1 Amb20630201 [0,0,0,1,0,0|3,0,0]=4 829 B10R1.13 CC1CCC(C(=N)N)CC1 Amb22059037 [0,0,0,1,0,0|3,0,0]=4 830 B10R1.13 CC1CCC(C(=O)Cl)CC1 Amb28342369 [0,0,0,1,0,0|2,0,0]=3 831 B10R1.13 CC1CCC(C(=O)O)CC1 Amb6456606 [0,0,0,1,0,0|2,0,0]=3 832 B10R1.13 CC1CCC(C(=O)O)CN1 Amb18643999 [0,0,0,1,0,0|2,0,0]=3 833 B10R1.13 CC1CCC(C(=O)O)CN1 Amb33329255 [0,0,0,1,0,0|2,0,0]=3 834 B10R1.13 CC1CCC(C(=O)O)CO1 Amb29860383 [0,0,0,1,0,0|1,0,0]=2 835 B10R1.13 CC1CCC(C(=O)O)NC1 Amb25324436 [0,0,0,1,0,0|3,0,0]=4 836 B10R1.13 CC1CCC(C(=O)O)NC1 Amb33482831 [0,0,0,1,0,0|3,0,0]=4 837 B10R1.13 CC1CCC(C(=O)O)OC1 Amb27832232 [0,0,0,1,0,0|3,0,0]=4 838 B10R1.13 CC1CCC(C(C)Br)CC1 Amb27406445 [0,0,0,1,0,0|2,0,1]=4 839 B10R1.13 CC1CCC(C(C)Br)CO1 Amb35679308 [0,0,0,1,0,0|1,0,1]=3 840 B10R1.13 CC1CCC(C(C)C)CC1 Amb2721192 [0,0,0,1,0,0|2,0,1]=4 841 B10R1.13 CC1CCC(C(C)C)CN1 Amb27753482 [0,0,0,1,0,0|2,0,1]=4 842 B10R1.13 CC1CCC(C(C)Cl)CO1 Amb35679307 [0,0,0,1,0,0|1,0,1]=3 843 B10R1.13 CC1CCC(C(C)N)CC1 Amb18946301 [0,0,0,1,0,0|2,0,1]=4 844 B10R1.13 CC1CCC(C(C)N)CO1 Amb35686966 [0,0,0,1,0,0|1,0,1]=3 845 B10R1.13 CC1CCC(C(C)O)CC1 Amb28247007 [0,0,0,1,0,0|1,0,2]=4 846 B10R1.13 CC1CCC(C(C)O)CN1 Amb35740956 [0,0,0,1,0,0|1,0,2]=4 847 B10R1.13 CC1CCC(C(C)O)CO1 Amb35678926 [0,0,0,1,0,0|0,0,2]=3 848 B10R1.13 CC1CCC(C(N)=O)CC1 Amb27154534 [0,0,0,1,0,0|2,0,0]=3 849 B10R1.13 CC1CCC(C(N)=O)CN1 Amb6256393 [0,0,0,1,0,0|2,0,0]=3 850 B10R1.13 CC1CCC(C(N)=O)NC1 Amb33495759 [0,0,0,1,0,0|3,0,0]=4 851 B10R1.13 CC1CCC(C(N)=S)CC1 Amb18799860 [0,0,0,1,0,0|2,1,0]=4 852 B10R1.13 CC1CCC(N(C)C)CC1 Amb27402840 [0,0,0,1,0,0|3,0,0]=4 853 B10R1.13 CC1CCC(N(C)C)CN1 Amb23589914 [0,0,0,1,0,0|3,0,0]=4 854 B10R1.13 CC1CCC(N(C)N)CO1 Amb35713973 [0,0,0,1,0,0|2,0,0]=3 855 B10R1.13 CC1CCC(S(=O)Cl)CC1 Amb29857387 [0,0,0,1,0,0|3,0,0]=4 856 B10R1.13 CC1CCC(S(=O)O)CC1 Amb35683277 [0,0,0,1,0,0|3,0,0]=4 857 B10R1.13 CC1CCC(S(=O)[O-])CC1 Amb32754323 [0,0,0,1,0,0|3,0,0]=4 858 B10R1.13 CC1CCC(S(N)=O)CC1 Amb32720490 [0,0,0,1,0,0|3,0,0]=4 859 B10R1.13 CC1CCC([C@@H](C)N)CC1 Amb28369514 [0,0,0,1,0,0|2,0,1]=4 860 B10R1.13 CC1CCC([C@@H](C)O)CC1 Amb26502796 [0,0,0,1,0,0|1,0,2]=4 861 B10R1.13 CC1CCC([C@H](C)N)CC1 Amb25048061 [0,0,0,1,0,0|2,0,1]=4 862 B10R1.13 CC1CCC([C@H](C)O)CC1 Amb27946489 [0,0,0,1,0,0|1,0,2]=4 863 B10R1.13 CC1CCC([N+](=O)[O-])CC1 Amb33299027 [0,0,0,1,0,0|3,0,0]=4 864 B10R1.13 CC1CCN(C(=O)Cl)CC1 Amb17563077 [0,0,0,1,0,0|3,0,0]=4 865 B10R1.13 CC1CCN(C(N)=O)CC1 Amb1127671 [0,0,0,1,0,0|3,0,0]=4 866 B10R1.13 CC1CNC(C(=O)O)CN1 Amb28049378 [0,0,0,1,0,0|3,0,0]=4 867 B10R1.13 CC1CNC(C(=O)O)CO1 Amb26356239 [0,0,0,1,0,0|2,0,0]=3 868 B10R1.13 CC1CNC(C(=O)O)CO1 Amb32653486 [0,0,0,1,0,0|2,0,0]=3 869 B10R1.13 CC1CNC(C(N)=O)CO1 Amb27266230 [0,0,0,1,0,0|2,0,0]=3 870 B10R1.13 CC1COC(C(N)=O)CN1 Amb27475745 [0,0,0,1,0,0|3,0,0]=4 871 B10R1.13 CC1NCC(C(C)C)CO1 Amb33194043 [0,0,0,1,0,0|2,0,1]=4 872 B10R1.13 CC1OCC(C(=O)O)CO1 Amb25723862 [0,0,0,1,0,0|2,0,0]=3 873 B10R1.13 CN(C)[C@H]1CC[C@H](C)CC1 Amb35825294 [0,0,0,1,0,0|3,0,0]=4 874 B10R1.13 CN1CCC(C(=O)Cl)CC1 Amb22893501 [0,0,0,1,0,0|3,0,0]=4 875 B10R1.13 CN1CCC(C(=O)Cl)CC1 Amb33549903 [0,0,0,1,0,0|3,0,0]=4 876 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2236137 [0,0,0,1,0,0|3,0,0]=4 877 B10R1.13 CN1CCC(C(=O)O)CC1 Amb2237314 [0,0,0,1,0,0|3,0,0]=4 878 B10R1.13 CN1CCC(C(N)=O)CC1 Amb10067624 [0,0,0,1,0,0|3,0,0]=4 879 B10R1.13 CS(=O)C1CCC(N)CC1 Amb18280607 [0,0,0,1,0,0|3,0,0]=4 880 B10R1.13 C[C@@H]1C=C[C@H](C(=O)Cl)CC1 Amb27244719 [0,0,0,1,0,0|2,0,1]=4 881 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)CN1 Amb26919968 [0,0,0,1,0,0|2,0,0]=3 882 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33017682 [0,0,0,1,0,0|3,0,0]=4 883 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33299403 [0,0,0,1,0,0|3,0,0]=4 884 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb24620510 [0,0,0,1,0,0|2,0,0]=3 885 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)CN1 Amb35788844 [0,0,0,1,0,0|2,0,0]=3 886 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)NC1 Amb33804580 [0,0,0,1,0,0|3,0,0]=4 887 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33290243 [0,0,0,1,0,0|2,0,0]=3 888 B10R1.13 C[C@@H]1CC[C@H](C(N)=O)CN1 Amb33483115 [0,0,0,1,0,0|2,0,0]=3 889 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb25949341 [0,0,0,1,0,0|2,0,0]=3 890 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb31156297 [0,0,0,1,0,0|2,0,0]=3 891 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb24694579 [0,0,0,1,0,0|2,0,0]=3 892 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb32661059 [0,0,0,1,0,0|2,0,0]=3 893 B10R1.13 C[C@H]1C=C[C@@H](C(=O)Cl)CC1 Amb28388670 [0,0,0,1,0,0|2,0,1]=4 894 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CC1 Amb10843977 [0,0,0,1,0,0|2,0,0]=3 895 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CN1 Amb24580654 [0,0,0,1,0,0|2,0,0]=3 896 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)ON1 Amb27881757 [0,0,0,1,0,0|3,0,0]=4 897 B10R1.13 C[C@H]1CC[C@@H](C(N)=O)CN1 Amb28429822 [0,0,0,1,0,0|2,0,0]=3 898 B10R1.13 C[C@H]1CC[C@@H](C(N)=S)CC1 Amb32682341 [0,0,0,1,0,0|2,1,0]=4 899 B10R1.13 C[C@H]1CC[C@H](C(=O)Cl)CC1 Amb24052918 [0,0,0,1,0,0|2,0,0]=3 900 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 Amb3939943 [0,0,0,1,0,0|2,0,0]=3 901 B10R1.13 C[C@H]1CC[C@H](C(N)=O)CC1 Amb27874416 [0,0,0,1,0,0|2,0,0]=3 902 B10R1.13 C[C@H]1CC[C@H](C(N)=O)CN1 Amb27214664 [0,0,0,1,0,0|2,0,0]=3 903 B10R1.13 C[C@H]1CN[C@@H](C(=O)O)CO1 Amb28367492 [0,0,0,1,0,0|2,0,0]=3 904 B10R1.13 C[C@H]1CN[C@H](C(=O)O)CO1 Amb35746793 [0,0,0,1,0,0|2,0,0]=3 905 B10R1.13 NC(=O)C1CCC(Br)CC1 Amb28315658 [0,0,0,1,0,0|3,0,0]=4 906 B10R1.13 NC(=O)C1CCC(F)CC1 Amb32943786 [0,0,0,1,0,0|3,0,0]=4 907 B10R1.13 NC(=O)C1CCC(N)CC1 Amb1136988 [0,0,0,1,0,0|3,0,0]=4 908 B10R1.13 NC(=O)C1CCC(N)CC1 Amb19514796 [0,0,0,1,0,0|3,0,0]=4 909 B10R1.13 NC(=O)C1CCC(O)CC1 Amb13951716 [0,0,0,1,0,0|3,0,0]=4 910 B10R1.13 NC(=O)C1CCC(S)CC1 Amb25288304 [0,0,0,1,0,0|3,0,0]=4 911 B10R1.13 NC(=O)[C@H]1CC[C@@H](N)CC1 Amb27596404 [0,0,0,1,0,0|3,0,0]=4 912 B10R1.13 NC(=O)[C@H]1CC[C@@H](O)CC1 Amb26569223 [0,0,0,1,0,0|3,0,0]=4 913 B10R1.13 NC(=O)[C@H]1CC[C@H](N)CC1 Amb28047201 [0,0,0,1,0,0|3,0,0]=4 914 B10R1.13 NC(=O)[C@H]1CC[C@H](O)CC1 Amb24351197 [0,0,0,1,0,0|3,0,0]=4 915 B10R1.13 NC1CCC(C(=O)Cl)CC1 Amb27645321 [0,0,0,1,0,0|3,0,0]=4 916 B10R1.13 NC1CCC(C(=O)O)CC1 Amb2699182 [0,0,0,1,0,0|3,0,0]=4 917 B10R1.13 NC1CCC(C(=O)O)CC1 Amb6739811 [0,0,0,1,0,0|3,0,0]=4 918 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb10070763 [0,0,0,1,0,0|3,0,0]=4 919 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 Amb33524039 [0,0,0,1,0,0|3,0,0]=4 920 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb33524062 [0,0,0,1,0,0|3,0,0]=4 921 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Amb8631309 [0,0,0,1,0,0|3,0,0]=4 922 B10R1.13 O=C(Cl)C1CCC(Cl)CC1 Amb27425034 [0,0,0,1,0,0|3,0,0]=4 923 B10R1.13 O=C(Cl)C1CCC(O)CC1 Amb21961740 [0,0,0,1,0,0|3,0,0]=4 924 B10R1.13 O=C(Cl)[C@H]1CC[C@H](O)CC1 Amb27833620 [0,0,0,1,0,0|3,0,0]=4 925 B10R1.13 O=C(O)C1CCC(Br)CC1 Amb27239245 [0,0,0,1,0,0|3,0,0]=4 926 B10R1.13 O=C(O)C1CCC(Cl)CC1 Amb18126347 [0,0,0,1,0,0|3,0,0]=4 927 B10R1.13 O=C(O)C1CCC(F)CC1 Amb20670645 [0,0,0,1,0,0|3,0,0]=4 928 B10R1.13 O=C(O)C1CCC(I)CC1 Amb27443730 [0,0,0,1,0,0|3,0,0]=4 929 B10R1.13 O=C(O)C1CCC(O)CC1 Amb2720801 [0,0,0,1,0,0|3,0,0]=4 930 B10R1.13 O=C(O)C1CCC(S)CC1 Amb26844518 [0,0,0,1,0,0|3,0,0]=4 931 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 Amb28042515 [0,0,0,1,0,0|3,0,0]=4 932 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 Amb22387642 [0,0,0,1,0,0|3,0,0]=4 933 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 Amb27786373 [0,0,0,1,0,0|3,0,0]=4 934 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 Amb22387641 [0,0,0,1,0,0|3,0,0]=4 935 B10R1.19 C#CC1CCCCCC1=O Amb27458674 [0,0,0,1,0,0|1,0,1]=3 936 B10R1.19 C=C1CCCCCC1CC Amb35681185 [0,0,0,1,0,0|2,0,0]=3 937 B10R1.19 C=CN1CCCCCC1=O Amb3997272 [0,0,0,1,0,0|2,0,1]=4 938 B10R1.19 CC1=C(CO)CCCCC1 Amb28249117 [0,0,0,1,0,0|1,0,1]=3 939 B10R1.19 CC1CCCCCC1CBr Amb35721304 [0,0,0,1,0,0|2,0,1]=4 940 B10R1.19 CC1CCCCCC1CCl Amb35721303 [0,0,0,1,0,0|2,0,1]=4 941 B10R1.19 CC1CCCCCC1CO Amb27978202 [0,0,0,1,0,0|1,0,1]=3 942 B10R1.19 CC1CCCCCC1NO Amb35726891 [0,0,0,1,0,0|2,0,1]=4 943 B10R1.19 CC1CCNCCC1CO Amb27633588 [0,0,0,1,0,0|2,0,1]=4 944 B10R1.19 CCC1CCCCCC1=O Amb25948482 [0,0,0,1,0,0|1,0,0]=2 945 B10R1.19 CCC1CCCCCC1Br Amb27197752 [0,0,0,1,0,0|2,0,1]=4 946 B10R1.19 CCC1CCCCCC1Cl Amb18800488 [0,0,0,1,0,0|2,0,1]=4 947 B10R1.19 CCC1CCCCCC1N Amb18279403 [0,0,0,1,0,0|2,0,1]=4 948 B10R1.19 CCC1CCCCCC1O Amb27972743 [0,0,0,1,0,0|1,0,2]=4 949 B10R1.19 CCC1CCCCCC1S Amb32788876 [0,0,0,1,0,0|1,1,1]=4 950 B10R1.19 CCC1CNCCNC1=O Amb27877963 [0,0,0,1,0,0|3,0,0]=4 951 B10R1.19 CCC1NCCCNC1=O Amb26546872 [0,0,0,1,0,0|3,0,0]=4 952 B10R1.19 CCN1CCCNCC1=O Amb24524558 [0,0,0,1,0,0|3,0,0]=4 953 B10R1.19 CCN1CCCNCC1=O Amb33212644 [0,0,0,1,0,0|3,0,0]=4 954 B10R1.19 CCN1CCNCCC1=O Amb21959077 [0,0,0,1,0,0|3,0,0]=4 955 B10R1.19 CCN1CCNCCC1=O Amb32410399 [0,0,0,1,0,0|3,0,0]=4 956 B10R1.19 CC[C@@H]1CCCCC[C@@H]1N Amb27421958 [0,0,0,1,0,0|2,0,1]=4 957 B10R1.19 CC[C@@H]1CCCCC[C@H]1O Amb33213860 [0,0,0,1,0,0|1,0,2]=4 958 B10R1.19 CC[C@@H]1NCCCNC1=O Amb32671416 [0,0,0,1,0,0|3,0,0]=4 959 B10R1.19 CC[C@H]1CCCCCC1=O Amb27951448 [0,0,0,1,0,0|1,0,0]=2 960 B10R1.19 CC[C@H]1NCCCNC1=O Amb25726155 [0,0,0,1,0,0|3,0,0]=4 961 B10R1.19 CN1CCCCCC1CBr Amb27477574 [0,0,0,1,0,0|3,0,0]=4 962 B10R1.19 CN1CCCCCC1CCl Amb27813801 [0,0,0,1,0,0|3,0,0]=4 963 B10R1.19 CN1CCCCCC1CN Amb8010482 [0,0,0,1,0,0|3,0,0]=4 964 B10R1.19 CN1CCCCCC1CO Amb28343208 [0,0,0,1,0,0|2,0,0]=3 965 B10R1.19 CN1CCCOCC1CO Amb28132742 [0,0,0,1,0,0|3,0,0]=4 966 B10R1.19 CN1CCSCCC1CO Amb27877576 [0,0,0,1,0,0|3,0,0]=4 967 B10R1.19 CNC1CCCCNC1=O Amb9721933 [0,0,0,1,0,0|3,0,0]=4 968 B10R1.19 COC1CCCCCC1=O Amb26329265 [0,0,0,1,0,0|2,0,0]=3 969 B10R1.19 CO[C@H]1CCCCNC1=O Amb27950636 [0,0,0,1,0,0|3,0,0]=4 970 B10R1.19 C\C=C1\CCCCCC1=O Amb24698888 [0,0,0,1,0,0|1,0,2]=4 971 B10R1.19 N#CC1CCCCCC1=O Amb17593482 [0,0,0,1,0,0|1,0,1]=3 972 B10R1.19 NC1CCCCCC1CO Amb20668019 [0,0,0,1,0,0|1,0,1]=3 973 B10R1.19 NC1CCCCCC1CO Amb2695457 [0,0,0,1,0,0|1,0,1]=3 974 B10R1.19 NCC1CCCCCC1=O Amb27965542 [0,0,0,1,0,0|1,0,0]=2 975 B10R1.19 NCC1CCCCCC1F Amb27958677 [0,0,0,1,0,0|2,0,1]=4 976 B10R1.19 NCC1CCCCNC1=O Amb33097714 [0,0,0,1,0,0|2,0,0]=3 977 B10R1.19 NCC1CCCCNC1=O Amb6667851 [0,0,0,1,0,0|2,0,0]=3 978 B10R1.19 NCC1OCCCNC1=O Amb28350300 [0,0,0,1,0,0|3,0,0]=4 979 B10R1.19 NC[C@@H]1CCCCC[C@@H]1O Amb6336648 [0,0,0,1,0,0|1,0,2]=4 980 B10R1.19 NC[C@@H]1CCCCC[C@H]1O Amb27788301 [0,0,0,1,0,0|1,0,2]=4 981 B10R1.19 NN1CCCCCC1CO Amb28126847 [0,0,0,1,0,0|2,0,0]=3 982 B10R1.19 NOC1CCCCNC1=O Amb27410321 [0,0,0,1,0,0|3,0,0]=4 983 B10R1.19 N[C@@H]1CCCCC[C@@H]1CO Amb32944721 [0,0,0,1,0,0|1,0,1]=3 984 B10R1.19 N[C@@H]1CCCCC[C@H]1CO Amb27851992 [0,0,0,1,0,0|1,0,1]=3 985 B10R1.19 N[C@H]1CCCCC[C@H]1CBr Amb27782729 [0,0,0,1,0,0|2,0,1]=4 986 B10R1.19 N[C@H]1CCCCC[C@H]1CO Amb27467767 [0,0,0,1,0,0|1,0,1]=3 987 B10R1.19 O=C1CCCCCC1CO Amb27944951 [0,0,0,1,0,0|0,0,0]=1 988 B10R1.19 O=C1CCCCCN1CCl Amb17949681 [0,0,0,1,0,0|2,0,0]=3 989 B10R1.19 O=C1CCCCCN1CO Amb1038986 [0,0,0,1,0,0|1,0,0]=2 990 B10R1.19 O=C1NCCCCC1CBr Amb32675168 [0,0,0,1,0,0|2,0,0]=3 991 B10R1.19 O=C1NCCCCC1CCl Amb33457891 [0,0,0,1,0,0|2,0,0]=3 992 B10R1.19 O=C1NCCCCC1CO Amb26391477 [0,0,0,1,0,0|1,0,0]=2 993 B10R1.19 O=C1NCCCC\C1=N/O Amb28128409 [0,0,0,1,0,0|2,0,1]=4 994 B10R1.19 O=C=C1CCCCCC1=O Amb27948690 [0,0,0,1,0,0|0,0,3]=4 995 B10R1.19 O=CC1CCCCCC1=O Amb33539530 [0,0,0,1,0,0|0,0,2]=3 996 B10R1.19 O=CN1CCCCCC1=O Amb24374197 [0,0,0,1,0,0|1,0,2]=4 997 B10R1.19 OCC1CCCNCC1O Amb27670220 [0,0,0,1,0,0|1,0,2]=4 998 B10R1.19 OCC1CCNCCC1O Amb25053975 [0,0,0,1,0,0|1,0,2]=4 999 B10R1.19 OCC1CCNCCC1O Amb35750583 [0,0,0,1,0,0|1,0,2]=4 1000 B10R1.19 OCC1CNCCCC1F Amb27445808 [0,0,0,1,0,0|2,0,1]=4 1001 B10R1.19 OCC1OCCCCC1O Amb27945340 [0,0,0,1,0,0|1,0,2]=4 1002 B10R1.19 OC[C@H]1CCNCC[C@@H]1O Amb27779159 [0,0,0,1,0,0|1,0,2]=4 1003 B10R1.19 S=C1CCCCCN1CS Amb24641502 [0,0,0,1,0,0|1,2,0]=4 1004 B10R1.19 [N-]=[N+]=C1CCCCCC1=O Amb17593499 [0,0,0,1,0,0|2,0,1]=4 1005 B10R1.25 C=C1C[C@H](O)OC[C@@H]1CO Amb27207414 [0,0,0,1,0,0|3,0,0]=4 1006 B10R1.25 CC1=CC(C)C(CO)CC1 Amb3372047 [0,0,0,1,0,0|1,0,2]=4 1007 B10R1.25 CC1=CC(O)CCC1CO Amb27593927 [0,0,0,1,0,0|2,0,0]=3 1008 B10R1.25 CC1CC(O)CCC1CO Amb27647895 [0,0,0,1,0,0|2,0,1]=4 1009 B10R1.25 CC1CCC(C#N)C(=O)N1 Amb27627460 [0,0,0,1,0,0|2,0,1]=4 1010 B10R1.25 CC1CCC(CCl)C(C)C1 Amb27453008 [0,0,0,1,0,0|2,0,1]=4 1011 B10R1.25 CC1CCC(CN)C(=O)N1 Amb23590134 [0,0,0,1,0,0|2,0,0]=3 1012 B10R1.25 CC1CCC(CN)C(C)C1 Amb28344611 [0,0,0,1,0,0|2,0,1]=4 1013 B10R1.25 CC1CCC(CN)C(C)N1 Amb33500872 [0,0,0,1,0,0|2,0,1]=4 1014 B10R1.25 CC1CCC(CN)C(C)O1 Amb27768738 [0,0,0,1,0,0|1,0,2]=4 1015 B10R1.25 CC1CCC(CN)C(N)C1 Amb27394649 [0,0,0,1,0,0|2,0,1]=4 1016 B10R1.25 CC1CCC(CN)N(C)C1 Amb27653730 [0,0,0,1,0,0|3,0,0]=4 1017 B10R1.25 CC1CCC(CO)C(=O)C1 Amb27261926 [0,0,0,1,0,0|0,0,0]=1 1018 B10R1.25 CC1CCC(CO)C(C)C1 Amb598419 [0,0,0,1,0,0|1,0,1]=3 1019 B10R1.25 CC1CCC(CO)C(C)N1 Amb26065404 [0,0,0,1,0,0|1,0,1]=3 1020 B10R1.25 CC1CCC(CO)C(C)O1 Amb27406502 [0,0,0,1,0,0|0,0,2]=3 1021 B10R1.25 CC1CCC(CO)C(O)C1 Amb28065300 [0,0,0,1,0,0|0,0,2]=3 1022 B10R1.25 CC1CC\C(=C/O)C(=O)C1 Amb25853192 [0,0,0,1,0,0|0,0,2]=3 1023 B10R1.25 CC1CC\C(=C/O)C(=O)O1 Amb25941158 [0,0,0,1,0,0|1,0,2]=4 1024 B10R1.25 CC1CC\C(=C\O)C(=O)C1 Amb24661725 [0,0,0,1,0,0|0,0,2]=3 1025 B10R1.25 CC1CNC(CO)C(=O)N1 Amb26587308 [0,0,0,1,0,0|2,0,0]=3 1026 B10R1.25 CC1COC(CO)C(C)C1 Amb27486312 [0,0,0,1,0,0|2,0,1]=4 1027 B10R1.25 CCC1CCC(C)=CC1=O Amb28131975 [0,0,0,1,0,0|1,0,2]=4 1028 B10R1.25 CCC1CCC(C)CC1=O Amb26909683 [0,0,0,1,0,0|1,0,0]=2 1029 B10R1.25 CCC1CCC(C)NC1=O Amb24619256 [0,0,0,1,0,0|2,0,0]=3 1030 B10R1.25 CCC1NCC(C)NC1=O Amb28423230 [0,0,0,1,0,0|3,0,0]=4 1031 B10R1.25 CCN1CCC(N)CC1=O Amb25999089 [0,0,0,1,0,0|3,0,0]=4 1032 B10R1.25 CC[C@@H]1CC[C@@H](C)NC1=O Amb28722655 [0,0,0,1,0,0|2,0,0]=3 1033 B10R1.25 CC[C@@H]1CC[C@H](C)NC1=O Amb28722660 [0,0,0,1,0,0|2,0,0]=3 1034 B10R1.25 CC[C@H]1CC[C@@H](C)NC1=O Amb32665080 [0,0,0,1,0,0|2,0,0]=3 1035 B10R1.25 CN1CCC(C#N)C(=O)C1 Amb18832196 [0,0,0,1,0,0|2,0,1]=4 1036 B10R1.25 CN1CC[C@H](CO)[C@H](O)C1 Amb28319962 [0,0,0,1,0,0|1,0,2]=4 1037 B10R1.25 C[C@@H]1CCC(C=O)C(=O)C1 Amb27750219 [0,0,0,1,0,0|0,0,2]=3 1038 B10R1.25 C[C@@H]1CCC(CO)C(=O)N1 Amb27839099 [0,0,0,1,0,0|1,0,0]=2 1039 B10R1.25 C[C@@H]1CO[C@@H](CO)[C@H](C)C1 Amb27457890 [0,0,0,1,0,0|2,0,1]=4 1040 B10R1.25 C[C@@H]1N[C@H](C)CC[C@@H]1CO Amb28072924 [0,0,0,1,0,0|1,0,1]=3 1041 B10R1.25 C[C@H]1CCC(CO)[C@@H](C)O1 Amb27978473 [0,0,0,1,0,0|0,0,2]=3 1042 B10R1.25 C[C@H]1CC[C@H](CO)[C@@H](C)O1 Amb27184479 [0,0,0,1,0,0|0,0,2]=3 1043 B10R1.25 C[C@H]1C[C@@H](F)[C@H](CO)CO1 Amb27452103 [0,0,0,1,0,0|2,0,1]=4 1044 B10R1.25 C\C=C1\CCC(C)CC1=O Amb27195870 [0,0,0,1,0,0|1,0,2]=4 1045 B10R1.25 NC1CC(O)CCC1CO Amb27491461 [0,0,0,1,0,0|2,0,1]=4 1046 B10R1.25 O=C1CC(O)OCC1CO Amb27614911 [0,0,0,1,0,0|2,0,0]=3 1047 B10R1.25 O=C1CCC(CO)C(=O)N1 Amb27851412 [0,0,0,1,0,0|2,0,1]=4 1048 B10R1.29 C#CCCC1COCC1=O Amb35639024 [0,0,0,1,0,0|0,0,2]=3 1049 B10R1.29 C=CCCC1CCCC1=O Amb26474240 [0,0,0,1,0,0|1,0,2]=4 1050 B10R1.29 C=CCCC1COCC1=O Amb29883601 [0,0,0,1,0,0|0,0,2]=3 1051 B10R1.29 C=CCCC1CSCC1=O Amb27753177 [0,0,0,1,0,0|0,1,2]=4 1052 B10R1.29 CC#CCC1CCCC1=O Amb28388198 [0,0,0,1,0,0|1,0,2]=4 1053 B10R1.29 CC#CCC1COCC1=O Amb35639025 [0,0,0,1,0,0|0,0,2]=3 1054 B10R1.29 CCCCC1CCCC1=O Amb19301037 [0,0,0,1,0,0|1,0,0]=2 1055 B10R1.29 CCCCC1CCCC1N Amb18977599 [0,0,0,1,0,0|2,0,1]=4 1056 B10R1.29 CCCCC1CCCC1O Amb27188610 [0,0,0,1,0,0|1,0,2]=4 1057 B10R1.29 CCCCC1CCNC1C Amb27772735 [0,0,0,1,0,0|2,0,1]=4 1058 B10R1.29 CCCCC1CNCC1O Amb28077183 [0,0,0,1,0,0|1,0,2]=4 1059 B10R1.29 CCCCC1COCC1=O Amb29885828 [0,0,0,1,0,0|0,0,0]=1 1060 B10R1.29 CCCCC1COCC1Br Amb29866241 [0,0,0,1,0,0|1,0,1]=3 1061 B10R1.29 CCCCC1COCC1N Amb30025739 [0,0,0,1,0,0|1,0,1]=3 1062 B10R1.29 CCCCC1COCC1O Amb27981737 [0,0,0,1,0,0|0,0,2]=3 1063 B10R1.29 CCCCC1CSCC1Br Amb27753176 [0,0,0,1,0,0|1,1,1]=4 1064 B10R1.29 CCCCC1CSCC1N Amb27594264 [0,0,0,1,0,0|1,1,1]=4 1065 B10R1.29 CCCCN1CCCC1=N Amb7777898 [0,0,0,1,0,0|3,0,0]=4 1066 B10R1.29 CCCCN1CCCC1=O Amb4605894 [0,0,0,1,0,0|2,0,0]=3 1067 B10R1.29 CCCCN1CCCC1=S Amb26564122 [0,0,0,1,0,0|2,1,0]=4 1068 B10R1.29 CCCCN1CNCC1=O Amb28139296 [0,0,0,1,0,0|2,0,0]=3 1069 B10R1.29 CCCC[C@@H]1CCC[C@H]1O Amb26393355 [0,0,0,1,0,0|1,0,2]=4 1070 B10R1.29 CCCC[C@@H]1CCN[C@H]1C Amb27422037 [0,0,0,1,0,0|2,0,1]=4 1071 B10R1.29 CCCC[C@@H]1CNC[C@@H]1N Amb32709346 [0,0,0,1,0,0|2,0,1]=4 1072 B10R1.29 CCCC[C@@H]1CNC[C@H]1O Amb28203928 [0,0,0,1,0,0|1,0,2]=4 1073 B10R1.29 CCCC[C@@H]1COC[C@H]1O Amb32944880 [0,0,0,1,0,0|0,0,2]=3 1074 B10R1.29 CCCC[C@H]1CNC[C@@H]1O Amb28283631 [0,0,0,1,0,0|1,0,2]=4 1075 B10R1.29 CCCNC1COCC1C Amb29882747 [0,0,0,1,0,0|2,0,1]=4 1076 B10R1.29 CCCNC1CONC1=O Amb28128946 [0,0,0,1,0,0|2,0,0]=3 1077 B10R1.29 CCCOC1COCC1Br Amb28050488 [0,0,0,1,0,0|2,0,1]=4 1078 B10R1.29 CCCOC1COCC1I Amb25886325 [0,0,0,1,0,0|2,0,1]=4 1079 B10R1.29 CCCS[C@@H]1COC[C@H]1O Amb35632205 [0,0,0,1,0,0|1,0,2]=4 1080 B10R1.29 CCC\C=C1/CCCC1=O Amb25936513 [0,0,0,1,0,0|1,0,2]=4 1081 B10R1.29 CCC\C=C1\CCCC1=O Amb27432602 [0,0,0,1,0,0|1,0,2]=4 1082 B10R1.29 CCNCC1COCC1C Amb30033866 [0,0,0,1,0,0|2,0,1]=4 1083 B10R1.29 CCOCC1CCCC1=O Amb24431926 [0,0,0,1,0,0|2,0,0]=3 1084 B10R1.29 CCOCC1COCC1=O Amb35639027 [0,0,0,1,0,0|1,0,0]=2 1085 B10R1.29 CCOCC1COCC1Br Amb35736893 [0,0,0,1,0,0|2,0,1]=4 1086 B10R1.29 CCOCC1COCC1Cl Amb35736799 [0,0,0,1,0,0|2,0,1]=4 1087 B10R1.29 CCOCC1COCC1N Amb30026791 [0,0,0,1,0,0|2,0,1]=4 1088 B10R1.29 CCOCC1COCC1O Amb32944919 [0,0,0,1,0,0|1,0,2]=4 1089 B10R1.29 CCOC[C@@H]1COC[C@H]1O Amb33213424 [0,0,0,1,0,0|1,0,2]=4 1090 B10R1.29 CNCCN1CCCC1=O Amb18292044 [0,0,0,1,0,0|3,0,0]=4 1091 B10R1.29 CNCCN1CCCC1=O Amb19515123 [0,0,0,1,0,0|3,0,0]=4 1092 B10R1.29 COCCC1CCCC1=O Amb27665846 [0,0,0,1,0,0|2,0,0]=3 1093 B10R1.29 COCCC1CCNC1=O Amb25824666 [0,0,0,1,0,0|3,0,0]=4 1094 B10R1.29 COCCN1CCCC1=O Amb20621492 [0,0,0,1,0,0|3,0,0]=4 1095 B10R1.29 COCCN1CNCC1=O Amb25246117 [0,0,0,1,0,0|3,0,0]=4 1096 B10R1.29 COCOC1CCCC1=O Amb25319346 [0,0,0,1,0,0|3,0,0]=4 1097 B10R1.29 CSCCC1CCCC1=O Amb27794162 [0,0,0,1,0,0|2,0,0]=3 1098 B10R1.29 CSCCC1CCOC1=O Amb27467850 [0,0,0,1,0,0|3,0,0]=4 1099 B10R1.29 CSCCC1CSCC1=O Amb27166207 [0,0,0,1,0,0|1,1,0]=3 1100 B10R1.29 CSCCC1NCCC1=O Amb27192382 [0,0,0,1,0,0|3,0,0]=4 1101 B10R1.29 CSCC[C@@H]1NCCC1=O Amb18830317 [0,0,0,1,0,0|3,0,0]=4 1102 B10R1.29 CSCOC1CCCC1=O Amb25236984 [0,0,0,1,0,0|3,0,0]=4 1103 B10R1.29 N#CCCC1CCCC1=O Amb4477198 [0,0,0,1,0,0|2,0,1]=4 1104 B10R1.29 NCCCC1CCNC1=O Amb27860538 [0,0,0,1,0,0|3,0,0]=4 1105 B10R1.29 NCCCC1CCOC1=O Amb32668910 [0,0,0,1,0,0|3,0,0]=4 1106 B10R1.29 NCCCC1CCOC1=O Amb32674869 [0,0,0,1,0,0|3,0,0]=4 1107 B10R1.29 NCCCN1CCCC1=O Amb534575 [0,0,0,1,0,0|3,0,0]=4 1108 B10R1.29 O=C1CCCC1CCCF Amb26876720 [0,0,0,1,0,0|2,0,0]=3 1109 B10R1.29 O=C1CCCN1CCCCl Amb1141152 [0,0,0,1,0,0|3,0,0]=4 1110 B10R1.29 O=C1CCCN1CCCO Amb3939639 [0,0,0,1,0,0|3,0,0]=4 1111 B10R1.29 O=C1CCCN1CCCS Amb27837899 [0,0,0,1,0,0|3,0,0]=4 1112 B10R1.29 O=C1CCC[C@@H]1CCCBr Amb27233151 [0,0,0,1,0,0|2,0,0]=3 1113 B10R1.29 O=C1CNCN1CCCF Amb27848424 [0,0,0,1,0,0|3,0,0]=4 1114 B10R1.29 O=C1CSCC1CCCF Amb27487070 [0,0,0,1,0,0|1,1,0]=3 1115 B10R1.29 O=C1CSCC1CCCO Amb27218665 [0,0,0,1,0,0|1,1,0]=3 1116 B10R1.29 O=C1CSCN1CCCCl Amb28137860 [0,0,0,1,0,0|2,1,0]=4 1117 B10R1.29 O=C1NCCC1CCCO Amb27460992 [0,0,0,1,0,0|3,0,0]=4 1118 B10R1.29 O=C1NCCC1CCCO Amb32667562 [0,0,0,1,0,0|3,0,0]=4 1119 B10R1.29 O=C1OCCC1CCCO Amb27977861 [0,0,0,1,0,0|3,0,0]=4 1120 B10R1.29 O=C1OCC[C@H]1CCCF Amb27949209 [0,0,0,1,0,0|3,0,0]=4 1121 B10R1.31 CC(=O)C1=NOC(CBr)C1 Amb28240309 [0,0,0,1,0,0|2,0,1]=4 1122 B10R1.31 CC(=O)C1CCC(CN)O1 Amb27831696 [0,0,0,1,0,0|3,0,0]=4 1123 B10R1.31 CC(=O)C1CC[C@H](CBr)O1 Amb27772033 [0,0,0,1,0,0|3,0,0]=4 1124 B10R1.31 CC(=O)C1COC(CN)C1 Amb33132393 [0,0,0,1,0,0|1,0,0]=2 1125 B10R1.31 CC(=O)N1CCC(CN)C1 Amb18278707 [0,0,0,1,0,0|3,0,0]=4 1126 B10R1.31 CC(=O)N1CCC(CN)C1 Amb33552523 [0,0,0,1,0,0|3,0,0]=4 1127 B10R1.31 CC(=O)N1CCC(CO)C1 Amb33530059 [0,0,0,1,0,0|3,0,0]=4 1128 B10R1.31 CC(=O)N1CC[C@@H](CN)C1 Amb28282653 [0,0,0,1,0,0|3,0,0]=4 1129 B10R1.31 CC(=O)[C@@H]1CC[C@H](C=O)C1 Amb28052707 [0,0,0,1,0,0|2,0,1]=4 1130 B10R1.31 CC(=O)[C@@H]1CO[C@H](CN)C1 Amb33132409 [0,0,0,1,0,0|1,0,0]=2 1131 B10R1.31 CC(C)C1COC(CBr)C1 Amb32660776 [0,0,0,1,0,0|2,0,1]=4 1132 B10R1.31 CC(C)C1COC(CI)C1 Amb32660830 [0,0,0,1,0,0|2,0,1]=4 1133 B10R1.31 CC(C)C1COC(CN)C1 Amb32660890 [0,0,0,1,0,0|2,0,1]=4 1134 B10R1.31 CC(C)C1COC(CO)C1 Amb24748355 [0,0,0,1,0,0|2,0,1]=4 1135 B10R1.31 CC(C)[C@@H]1CO[C@@H](CO)C1 Amb28205981 [0,0,0,1,0,0|2,0,1]=4 1136 B10R1.31 CCC1=NCC(C(C)=O)C1 Amb26516480 [0,0,0,1,0,0|1,0,1]=3 1137 B10R1.31 CCC1=NOC(C(C)=O)C1 Amb24408362 [0,0,0,1,0,0|2,0,1]=4 1138 B10R1.31 CCC1CC(C(C)=O)CO1 Amb29870601 [0,0,0,1,0,0|0,0,0]=1 1139 B10R1.31 CCC1CC(C(C)Br)CO1 Amb35637592 [0,0,0,1,0,0|1,0,1]=3 1140 B10R1.31 CCC1CC(C(C)Cl)CO1 Amb29883069 [0,0,0,1,0,0|1,0,1]=3 1141 B10R1.31 CCC1CC(C(C)N)CO1 Amb35626536 [0,0,0,1,0,0|1,0,1]=3 1142 B10R1.31 CCC1CC(C(C)O)CO1 Amb35637590 [0,0,0,1,0,0|0,0,2]=3 1143 B10R1.31 CCC1CC(N(C)N)CO1 Amb35634257 [0,0,0,1,0,0|2,0,0]=3 1144 B10R1.31 CCC1CCC(C(=O)O)N1 Amb24694112 [0,0,0,1,0,0|3,0,0]=4 1145 B10R1.31 CCC1CCC(C(=O)O)N1 Amb28555622 [0,0,0,1,0,0|3,0,0]=4 1146 B10R1.31 CCC1CCC(C(=O)O)O1 Amb20668759 [0,0,0,1,0,0|3,0,0]=4 1147 B10R1.31 CCC1CCC(C(C)=O)C1 Amb27490849 [0,0,0,1,0,0|1,0,0]=2 1148 B10R1.31 CCC1CCC(C(C)Cl)C1 Amb27772507 [0,0,0,1,0,0|2,0,1]=4 1149 B10R1.31 CCC1CCN(C(=O)Cl)C1 Amb27966015 [0,0,0,1,0,0|3,0,0]=4 1150 B10R1.31 CCC1CCN(C(N)=O)C1 Amb25377715 [0,0,0,1,0,0|3,0,0]=4 1151 B10R1.31 CCC1CNC(C(=O)O)C1 Amb22496300 [0,0,0,1,0,0|3,0,0]=4 1152 B10R1.31 CCC1CNC(C(N)=O)C1 Amb27852411 [0,0,0,1,0,0|3,0,0]=4 1153 B10R1.31 CCC1CN[C@H](C(=O)O)C1 Amb27168235 [0,0,0,1,0,0|3,0,0]=4 1154 B10R1.31 CCC1NC(C(=O)O)CS1 Amb32409625 [0,0,0,1,0,0|2,1,0]=4 1155 B10R1.31 CCC1NC(C(=O)O)CS1 Amb9723340 [0,0,0,1,0,0|2,1,0]=4 1156 B10R1.31 CCC1N[C@@H](C(=O)O)CS1 Amb8515134 [0,0,0,1,0,0|2,1,0]=4 1157 B10R1.31 CCC1N[C@H](C(=O)O)CS1 Amb18792350 [0,0,0,1,0,0|2,1,0]=4 1158 B10R1.31 CCN1CCC(C(=O)O)C1 Amb10607746 [0,0,0,1,0,0|3,0,0]=4 1159 B10R1.31 CCN1CC[C@H](C(=O)O)C1 Amb27406792 [0,0,0,1,0,0|3,0,0]=4 1160 B10R1.31 CC[C@@H]1CC[C@@H](C(=O)O)O1 Amb35750180 [0,0,0,1,0,0|3,0,0]=4 1161 B10R1.31 CC[C@@H]1CC[C@@H](C(N)=O)N1 Amb27782933 [0,0,0,1,0,0|3,0,0]=4 1162 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747486 [0,0,0,1,0,0|3,0,0]=4 1163 B10R1.31 CC[C@@H]1CN[C@H](C(=O)O)C1 Amb35747917 [0,0,0,1,0,0|3,0,0]=4 1164 B10R1.31 CC[C@H]1CC[C@@H](C(=O)O)N1 Amb28053433 [0,0,0,1,0,0|3,0,0]=4 1165 B10R1.31 CNC1CCC(C(=O)O)C1 Amb23454119 [0,0,0,1,0,0|3,0,0]=4 1166 B10R1.31 CNC1CCN(C(C)=O)C1 Amb21861187 [0,0,0,1,0,0|3,0,0]=4 1167 B10R1.31 CN[C@@H]1CCN(C(C)=O)C1 Amb22227499 [0,0,0,1,0,0|3,0,0]=4 1168 B10R1.31 CN[C@H]1CCN(C(C)=O)C1 Amb22227535 [0,0,0,1,0,0|3,0,0]=4 1169 B10R1.31 COC1CCC(C(=O)O)C1 Amb24399167 [0,0,0,1,0,0|3,0,0]=4 1170 B10R1.31 COC1CNC(C(C)=O)C1 Amb27390642 [0,0,0,1,0,0|3,0,0]=4 1171 B10R1.31 CO[C@@H]1CCN(C(C)=O)C1 Amb27827252 [0,0,0,1,0,0|3,0,0]=4 1172 B10R1.31 CO[C@H]1CC[C@@H](C(=O)O)C1 Amb26657399 [0,0,0,1,0,0|3,0,0]=4 1173 B10R1.31 CSC1=NCC(C(C)=O)C1 Amb24736358 [0,0,0,1,0,0|2,0,1]=4 1174 B10R1.31 NC(=O)C1CCC(CO)C1 Amb26317542 [0,0,0,1,0,0|3,0,0]=4 1175 B10R1.31 NC(=O)C1CSC(CS)C1 Amb27215970 [0,0,0,1,0,0|2,1,0]=4 1176 B10R1.31 NC(=O)[C@@H]1CC[C@H](CO)C1 Amb25708732 [0,0,0,1,0,0|3,0,0]=4 1177 B10R1.31 NC(=O)[C@@H]1CS[C@@H](CS)C1 Amb27964547 [0,0,0,1,0,0|2,1,0]=4 1178 B10R1.31 NCC1CC(C(N)=O)CO1 Amb19373933 [0,0,0,1,0,0|2,0,0]=3 1179 B10R1.31 NCC1CC(C(N)=O)CO1 Amb33276230 [0,0,0,1,0,0|2,0,0]=3 1180 B10R1.31 NCC1CCC(C(=O)O)C1 Amb28202595 [0,0,0,1,0,0|3,0,0]=4 1181 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066932 [0,0,0,1,0,0|3,0,0]=4 1182 B10R1.31 O=C(Cl)C1CCC(CO)C1 Amb27660986 [0,0,0,1,0,0|3,0,0]=4 1183 B10R1.31 O=C(O)[C@H]1CS[C@H](CS)C1 Amb28458525 [0,0,0,1,0,0|2,1,0]=4 1184 B10R1.35 CCC1CC(=O)C(CC)C1 Amb27227070 [0,0,0,1,0,0|1,0,0]=2 1185 B10R1.35 CCC1CC(C=O)C(=O)O1 Amb27863811 [0,0,0,1,0,0|1,0,2]=4 1186 B10R1.35 CCC1CC(CO)NC1=O Amb2695753 [0,0,0,1,0,0|3,0,0]=4 1187 B10R1.35 CCC1CC(CO)OC1=O Amb4043959 [0,0,0,1,0,0|3,0,0]=4 1188 B10R1.35 CCC1C[C@@H](CO)OC1=O Amb27484598 [0,0,0,1,0,0|3,0,0]=4 1189 B10R1.35 CCC1C\C(=C/O)C(=O)O1 Amb26548561 [0,0,0,1,0,0|1,0,2]=4 1190 B10R1.35 CCN1CC(=O)C(C#N)C1 Amb22271025 [0,0,0,1,0,0|2,0,1]=4 1191 B10R1.35 CCN1CC(=O)N(CC)C1 Amb28126419 [0,0,0,1,0,0|3,0,0]=4 1192 B10R1.35 CCN1CC(CN)CC1=O Amb8009791 [0,0,0,1,0,0|3,0,0]=4 1193 B10R1.35 CCN1CC(CO)CC1=O Amb13783613 [0,0,0,1,0,0|3,0,0]=4 1194 B10R1.35 CCN1CC(NC)CC1=O Amb25777005 [0,0,0,1,0,0|3,0,0]=4 1195 B10R1.35 CCN1CC(O)C(CO)C1 Amb27764963 [0,0,0,1,0,0|1,0,2]=4 1196 B10R1.35 CC[C@@H]1C[C@@H](C=O)C(=O)O1 Amb28140673 [0,0,0,1,0,0|1,0,2]=4 1197 B10R1.35 CC[C@@H]1C[C@@H](CO)NC1=O Amb27810476 [0,0,0,1,0,0|3,0,0]=4 1198 B10R1.35 CC[C@@H]1O[C@H](CO)CC1=O Amb27861225 [0,0,0,1,0,0|3,0,0]=4 1199 B10R1.35 CC[C@H]1C[C@@H](CO)OC1=O Amb27206706 [0,0,0,1,0,0|3,0,0]=4 1200 B10R1.35 CC[C@H]1C[C@@H](O)[C@H](CO)N1 Amb28065854 [0,0,0,1,0,0|1,0,2]=4 1201 B10R1.35 COC1CC(CO)N(C)C1 Amb27615006 [0,0,0,1,0,0|3,0,0]=4 1202 B10R1.35 COC1CC(CO)N(N)C1 Amb27174307 [0,0,0,1,0,0|3,0,0]=4 1203 B10R1.35 CO[C@H]1C[C@@H](CO)N(C)C1 Amb28351080 [0,0,0,1,0,0|3,0,0]=4 1204 B10R1.35 O=C1NC(CO)CC1CO Amb27859017 [0,0,0,1,0,0|2,0,0]=3 1205 B10R1.35 O=C1N[C@@H](CO)C[C@H]1CO Amb27439606 [0,0,0,1,0,0|2,0,0]=3 1206 B10R1.35 OC[C@@H]1C[C@H](O)[C@H](CO)C1 Amb27218247 [0,0,0,1,0,0|1,0,2]=4 1207 B10R1.38 CC1(C)CCCCC1CBr Amb27837760 [0,0,0,1,0,0|2,0,1]=4 1208 B10R1.38 CC1(C)CCCCC1CN Amb28282671 [0,0,0,1,0,0|2,0,1]=4 1209 B10R1.38 CC1(C)CCCCC1CO Amb25373450 [0,0,0,1,0,0|1,0,1]=3 1210 B10R1.38 CC1(C)CCCCC1NO Amb28191879 [0,0,0,1,0,0|2,0,1]=4 1211 B10R1.38 CC1(C)CCNCC1CO Amb26391503 [0,0,0,1,0,0|2,0,1]=4 1212 B10R1.38 CC1(F)CCCCC1CN Amb28246374 [0,0,0,1,0,0|2,0,1]=4 1213 B10R1.38 CC1(N)CCCCC1CN Amb28121228 [0,0,0,1,0,0|2,0,1]=4 1214 B10R1.38 CC1(N)CCCCC1CO Amb25951090 [0,0,0,1,0,0|1,0,1]=3 1215 B10R1.38 CC1(O)CCCCC1CN Amb27831546 [0,0,0,1,0,0|1,0,2]=4 1216 B10R1.38 CCC1CCCCC1(C)C Amb27800790 [0,0,0,1,0,0|2,0,1]=4 1217 B10R1.38 CCC1CCCCC1(C)O Amb25353397 [0,0,0,1,0,0|1,0,2]=4 1218 B10R1.38 CC[C@@H]1CCCC[C@@]1(C)O Amb32950509 [0,0,0,1,0,0|1,0,2]=4 1219 B10R1.38 C[C@@]1(N)CCCC[C@@H]1CO Amb27862953 [0,0,0,1,0,0|1,0,1]=3 1220 B10R1.38 C[C@@]1(O)CCCC[C@H]1CN Amb35669189 [0,0,0,1,0,0|1,0,2]=4 1221 B10R1.38 C[C@@]1(O)CCOC[C@H]1CO Amb27220627 [0,0,0,1,0,0|1,0,2]=4 1222 B10R1.38 C[C@]1(N)CCCC[C@H]1CO Amb1993799 [0,0,0,1,0,0|1,0,1]=3 1223 B10R1.38 C[C@]1(O)CCCC[C@H]1CN Amb1993804 [0,0,0,1,0,0|1,0,2]=4 1224 B10R1.38 NCC1CCCCS1(=O)=O Amb20669086 [0,0,0,1,0,0|3,0,0]=4 1225 B10R1.38 NCC1CCCCS1(=O)=O Amb28555607 [0,0,0,1,0,0|3,0,0]=4 1226 B10R1.38 O=S1(=O)CCCCC1CI Amb35732752 [0,0,0,1,0,0|3,0,0]=4 1227 B10R1.38 O=S1(=O)CCCCC1CO Amb20669085 [0,0,0,1,0,0|2,0,0]=3 1228 B10R1.38 O=S1(=O)CCCCC1CS Amb35673161 [0,0,0,1,0,0|2,1,0]=4 1229 B10R1.38 O=S1(=O)CCNCC1CO Amb25364393 [0,0,0,1,0,0|3,0,0]=4 1230 B10R1.38 OCC1CCCCC1(F)F Amb27151759 [0,0,0,1,0,0|2,0,1]=4 1231 B10R1.61 C=C(C)C1CCCCC1O Amb27664166 [0,0,0,1,0,0|1,0,0]=2 1232 B10R1.61 C=C(C)C1CNCCC1O Amb8392597 [0,0,0,1,0,0|2,0,0]=3 1233 B10R1.61 C=C(C)C1COCCC1O Amb28050632 [0,0,0,1,0,0|2,0,0]=3 1234 B10R1.61 C=C(C)[C@@H]1CCCC[C@H]1O Amb25215695 [0,0,0,1,0,0|1,0,0]=2 1235 B10R1.61 C=C(C)[C@@H]1CCOC[C@@H]1O Amb28287694 [0,0,0,1,0,0|2,0,0]=3 1236 B10R1.61 C=C(C)[C@H]1CCCC[C@@H]1O Amb28208460 [0,0,0,1,0,0|1,0,0]=2 1237 B10R1.61 C=C(C)[C@H]1CNCC[C@@H]1O Amb28346850 [0,0,0,1,0,0|2,0,0]=3 1238 B10R1.61 C=C(C)[C@H]1COCC[C@H]1O Amb28198052 [0,0,0,1,0,0|2,0,0]=3 1239 B10R1.61 C=C1CCCCC1C(C)=O Amb17593515 [0,0,0,1,0,0|1,0,1]=3 1240 B10R1.61 CC(=O)C1=C(Cl)CCCC1 Amb27410834 [0,0,0,1,0,0|1,0,2]=4 1241 B10R1.61 CC(=O)C1=C(N)CCCC1 Amb22893525 [0,0,0,1,0,0|1,0,2]=4 1242 B10R1.61 CC(=O)C1=C(S)CCCC1 Amb27267186 [0,0,0,1,0,0|0,1,2]=4 1243 B10R1.61 CC(=O)C1=CCCCC1C Amb24480506 [0,0,0,1,0,0|1,0,2]=4 1244 B10R1.61 CC(=O)C1=CCCCC1O Amb27425119 [0,0,0,1,0,0|0,0,2]=3 1245 B10R1.61 CC(=O)C1=CCCC[C@H]1O Amb27255579 [0,0,0,1,0,0|0,0,2]=3 1246 B10R1.61 CC(=O)C1=NCCCC1C Amb26972106 [0,0,0,1,0,0|2,0,1]=4 1247 B10R1.61 CC(=O)C1CCC=CC1C Amb27409478 [0,0,0,1,0,0|1,0,2]=4 1248 B10R1.61 CC(=O)C1CCCCC1=O Amb422729 [0,0,0,1,0,0|0,0,2]=3 1249 B10R1.61 CC(=O)C1CCCCC1Br Amb25926848 [0,0,0,1,0,0|1,0,0]=2 1250 B10R1.61 CC(=O)C1CCCCC1C Amb26021911 [0,0,0,1,0,0|1,0,0]=2 1251 B10R1.61 CC(=O)C1CCCCC1F Amb27755308 [0,0,0,1,0,0|1,0,0]=2 1252 B10R1.61 CC(=O)C1CCCCC1N Amb18124599 [0,0,0,1,0,0|1,0,0]=2 1253 B10R1.61 CC(=O)C1CCCCC1N Amb33447090 [0,0,0,1,0,0|1,0,0]=2 1254 B10R1.61 CC(=O)C1CCCCC1O Amb25735279 [0,0,0,1,0,0|0,0,0]=1 1255 B10R1.61 CC(=O)C1CCCCN1C Amb25763077 [0,0,0,1,0,0|2,0,0]=3 1256 B10R1.61 CC(=O)C1CCCNC1=O Amb22491980 [0,0,0,1,0,0|1,0,2]=4 1257 B10R1.61 CC(=O)C1CCCNC1C Amb26040936 [0,0,0,1,0,0|2,0,0]=3 1258 B10R1.61 CC(=O)C1CCNCC1C Amb26849111 [0,0,0,1,0,0|2,0,0]=3 1259 B10R1.61 CC(=O)C1CCOCC1C Amb28041252 [0,0,0,1,0,0|2,0,0]=3 1260 B10R1.61 CC(=O)C1CNCCC1C Amb30007896 [0,0,0,1,0,0|2,0,0]=3 1261 B10R1.61 CC(=O)C1CNCCN1C Amb18831626 [0,0,0,1,0,0|3,0,0]=4 1262 B10R1.61 CC(=O)C1COCCC1=O Amb27395668 [0,0,0,1,0,0|1,0,2]=4 1263 B10R1.61 CC(=O)C1COCCN1C Amb35666649 [0,0,0,1,0,0|3,0,0]=4 1264 B10R1.61 CC(=O)C1NCCCC1C Amb32410373 [0,0,0,1,0,0|2,0,0]=3 1265 B10R1.61 CC(=O)C1NCCOC1C Amb24516077 [0,0,0,1,0,0|3,0,0]=4 1266 B10R1.61 CC(=O)N1CCCCC1=O Amb8631224 [0,0,0,1,0,0|1,0,2]=4 1267 B10R1.61 CC(=O)N1CCNCC1C Amb18278177 [0,0,0,1,0,0|3,0,0]=4 1268 B10R1.61 CC(=O)N1CCNC[C@H]1C Amb27780517 [0,0,0,1,0,0|3,0,0]=4 1269 B10R1.61 CC(=O)N1CCOCC1C Amb26456170 [0,0,0,1,0,0|3,0,0]=4 1270 B10R1.61 CC(=O)N1CCOCC1Cl Amb27232748 [0,0,0,1,0,0|3,0,0]=4 1271 B10R1.61 CC(=O)N1CCOC[C@@H]1C Amb28184783 [0,0,0,1,0,0|3,0,0]=4 1272 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1C Amb28131403 [0,0,0,1,0,0|1,0,0]=2 1273 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307705 [0,0,0,1,0,0|1,0,0]=2 1274 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1C Amb25948878 [0,0,0,1,0,0|1,0,0]=2 1275 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1O Amb26451216 [0,0,0,1,0,0|0,0,0]=1 1276 B10R1.61 CC(=O)[C@H]1CC=CC[C@@H]1Cl Amb27965037 [0,0,0,1,0,0|1,0,2]=4 1277 B10R1.61 CC(=O)[C@H]1CCC=C[C@@H]1C Amb28457319 [0,0,0,1,0,0|1,0,2]=4 1278 B10R1.61 CC(=O)[C@H]1CCC=C[C@H]1O Amb28246556 [0,0,0,1,0,0|0,0,2]=3 1279 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1C Amb28052336 [0,0,0,1,0,0|1,0,0]=2 1280 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1O Amb28196697 [0,0,0,1,0,0|0,0,0]=1 1281 B10R1.61 CC(=O)[C@H]1CCCN[C@H]1C Amb33307649 [0,0,0,1,0,0|2,0,0]=3 1282 B10R1.61 CC(=O)[C@H]1CSCC[C@H]1O Amb27230577 [0,0,0,1,0,0|1,0,0]=2 1283 B10R1.61 CC(C)C1CCCCC1N Amb18946313 [0,0,0,1,0,0|2,0,1]=4 1284 B10R1.61 CC(C)C1CCCCC1O Amb33530995 [0,0,0,1,0,0|1,0,1]=3 1285 B10R1.61 CC(C)C1CCCCC1S Amb27217833 [0,0,0,1,0,0|1,1,1]=4 1286 B10R1.61 CC(C)C1COCCC1O Amb27489253 [0,0,0,1,0,0|2,0,1]=4 1287 B10R1.61 CC(C)[C@@H]1CCCC[C@@H]1N Amb27447249 [0,0,0,1,0,0|2,0,1]=4 1288 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1N Amb27461156 [0,0,0,1,0,0|2,0,1]=4 1289 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1O Amb27664233 [0,0,0,1,0,0|1,0,1]=3 1290 B10R1.61 CC(C)[C@H]1CCCC[C@@H]1O Amb17779717 [0,0,0,1,0,0|1,0,1]=3 1291 B10R1.61 CC(C)[C@H]1CCCC[C@H]1O Amb28053556 [0,0,0,1,0,0|1,0,1]=3 1292 B10R1.61 CC(C)[C@H]1COCC[C@@H]1O Amb27443632 [0,0,0,1,0,0|2,0,1]=4 1293 B10R1.61 CC(C)[C@H]1NCCC[C@H]1O Amb27783042 [0,0,0,1,0,0|2,0,1]=4 1294 B10R1.61 CC(N)C1CCCCC1C Amb26396102 [0,0,0,1,0,0|2,0,1]=4 1295 B10R1.61 CC(N)C1CCCCC1O Amb9776221 [0,0,0,1,0,0|1,0,1]=3 1296 B10R1.61 CC(O)C1CCCCC1O Amb4016395 [0,0,0,1,0,0|0,0,2]=3 1297 B10R1.61 CC(O)[C@@H]1CCCC[C@H]1C Amb27660322 [0,0,0,1,0,0|1,0,2]=4 1298 B10R1.61 CC(O)[C@H]1CCCC[C@@H]1N Amb27258616 [0,0,0,1,0,0|1,0,2]=4 1299 B10R1.61 CC(O)[C@H]1CCCC[C@@H]1O Amb28344918 [0,0,0,1,0,0|0,0,2]=3 1300 B10R1.61 CC1CCCCC1C(=O)Br Amb27635544 [0,0,0,1,0,0|2,0,0]=3 1301 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [0,0,0,1,0,0|2,0,0]=3 1302 B10R1.61 CC1CCCCC1C(N)=O Amb4035366 [0,0,0,1,0,0|2,0,0]=3 1303 B10R1.61 CC1CCCCC1N(C)C Amb27834490 [0,0,0,1,0,0|3,0,0]=4 1304 B10R1.61 CC1CCCCC1S(=O)Cl Amb35681055 [0,0,0,1,0,0|3,0,0]=4 1305 B10R1.61 CC1CCCCC1S(=O)O Amb35683280 [0,0,0,1,0,0|3,0,0]=4 1306 B10R1.61 CC1CCCCC1S(=O)[O-] Amb35683282 [0,0,0,1,0,0|3,0,0]=4 1307 B10R1.61 CC1CCCCC1[C@@H](C)N Amb25944621 [0,0,0,1,0,0|2,0,1]=4 1308 B10R1.61 CC1CCCCC1[C@H](C)N Amb24557311 [0,0,0,1,0,0|2,0,1]=4 1309 B10R1.61 CC1CCCCN1C(=O)Cl Amb17563085 [0,0,0,1,0,0|3,0,0]=4 1310 B10R1.61 CC1CCCNC1C(=O)O Amb18644006 [0,0,0,1,0,0|3,0,0]=4 1311 B10R1.61 CC1CCCNC1C(=O)O Amb33421964 [0,0,0,1,0,0|3,0,0]=4 1312 B10R1.61 CC1CCCNC1C(N)=O Amb18279452 [0,0,0,1,0,0|3,0,0]=4 1313 B10R1.61 CC1CCNCC1C(=O)O Amb18124644 [0,0,0,1,0,0|3,0,0]=4 1314 B10R1.61 CC1CCNCC1C(=O)O Amb33330563 [0,0,0,1,0,0|3,0,0]=4 1315 B10R1.61 CC1CCNCC1C(N)=O Amb35673225 [0,0,0,1,0,0|3,0,0]=4 1316 B10R1.61 CC1CNCCC1C(=O)O Amb2694911 [0,0,0,1,0,0|3,0,0]=4 1317 B10R1.61 CC1CNCCC1C(=O)O Amb28555510 [0,0,0,1,0,0|3,0,0]=4 1318 B10R1.61 CC1COCCC1C(=O)Cl Amb27752623 [0,0,0,1,0,0|3,0,0]=4 1319 B10R1.61 CC1COCCC1C(=O)O Amb27975751 [0,0,0,1,0,0|3,0,0]=4 1320 B10R1.61 CC1COCCC1C(N)=O Amb27837972 [0,0,0,1,0,0|3,0,0]=4 1321 B10R1.61 CC1CSCCC1C(=O)O Amb27214025 [0,0,0,1,0,0|3,0,0]=4 1322 B10R1.61 CC1NCCCC1C(=O)O Amb18124643 [0,0,0,1,0,0|3,0,0]=4 1323 B10R1.61 CC1NCCCC1C(=O)O Amb33548991 [0,0,0,1,0,0|3,0,0]=4 1324 B10R1.61 CC1OCCCC1C(=O)O Amb26904538 [0,0,0,1,0,0|3,0,0]=4 1325 B10R1.61 CC1OCCCC1C(N)=O Amb27665082 [0,0,0,1,0,0|3,0,0]=4 1326 B10R1.61 CN(C)C1CCCCC1N Amb17872464 [0,0,0,1,0,0|3,0,0]=4 1327 B10R1.61 CN(C)C1CCCCC1N Amb6660835 [0,0,0,1,0,0|3,0,0]=4 1328 B10R1.61 CN(C)C1CCCCC1O Amb19650709 [0,0,0,1,0,0|2,0,0]=3 1329 B10R1.61 CN(C)C1CCNCC1O Amb28126777 [0,0,0,1,0,0|3,0,0]=4 1330 B10R1.61 CN(C)C1CCOCC1O Amb25204957 [0,0,0,1,0,0|3,0,0]=4 1331 B10R1.61 CN(C)C1CNCCC1O Amb27863668 [0,0,0,1,0,0|3,0,0]=4 1332 B10R1.61 CN(C)C1COCCC1O Amb27768599 [0,0,0,1,0,0|3,0,0]=4 1333 B10R1.61 CN(C)[C@@H]1CCCC[C@@H]1O Amb28061629 [0,0,0,1,0,0|2,0,0]=3 1334 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1N Amb22746367 [0,0,0,1,0,0|3,0,0]=4 1335 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1O Amb16230284 [0,0,0,1,0,0|2,0,0]=3 1336 B10R1.61 CN(C)[C@@H]1CCNC[C@H]1O Amb22757864 [0,0,0,1,0,0|3,0,0]=4 1337 B10R1.61 CN(C)[C@@H]1CNCC[C@@H]1O Amb32434786 [0,0,0,1,0,0|3,0,0]=4 1338 B10R1.61 CN(C)[C@@H]1CNCC[C@H]1O Amb32434849 [0,0,0,1,0,0|3,0,0]=4 1339 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1Br Amb27205685 [0,0,0,1,0,0|3,0,0]=4 1340 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1N Amb8396718 [0,0,0,1,0,0|3,0,0]=4 1341 B10R1.61 CN(C)[C@H]1CCCC[C@@H]1O Amb28140319 [0,0,0,1,0,0|2,0,0]=3 1342 B10R1.61 CN(C)[C@H]1CCCC[C@H]1N Amb24641454 [0,0,0,1,0,0|3,0,0]=4 1343 B10R1.61 CN(C)[C@H]1CCNC[C@@H]1O Amb26397105 [0,0,0,1,0,0|3,0,0]=4 1344 B10R1.61 CN(C)[C@H]1CNCC[C@@H]1O Amb28131913 [0,0,0,1,0,0|3,0,0]=4 1345 B10R1.61 CN(N)C1CCCCC1O Amb27872992 [0,0,0,1,0,0|2,0,0]=3 1346 B10R1.61 CN(N)[C@@H]1CCCC[C@H]1O Amb26079997 [0,0,0,1,0,0|2,0,0]=3 1347 B10R1.61 CN1CCCCC1C(=O)O Amb1102591 [0,0,0,1,0,0|3,0,0]=4 1348 B10R1.61 CN1CCCCC1C(=O)O Amb2694386 [0,0,0,1,0,0|3,0,0]=4 1349 B10R1.61 CN1CCCCC1C(N)=O Amb16233756 [0,0,0,1,0,0|3,0,0]=4 1350 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb22744921 [0,0,0,1,0,0|3,0,0]=4 1351 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb30594706 [0,0,0,1,0,0|3,0,0]=4 1352 B10R1.61 CN1CCCC[C@H]1C(=O)O Amb27171753 [0,0,0,1,0,0|3,0,0]=4 1353 B10R1.61 CS(=O)C1CCCCC1=O Amb27753893 [0,0,0,1,0,0|1,0,2]=4 1354 B10R1.61 CS(=O)C1CCCCC1N Amb27838995 [0,0,0,1,0,0|2,0,0]=3 1355 B10R1.61 C[C@@H]1CCCCN1C(=O)Cl Amb25349193 [0,0,0,1,0,0|3,0,0]=4 1356 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [0,0,0,1,0,0|2,0,0]=3 1357 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb13886260 [0,0,0,1,0,0|3,0,0]=4 1358 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb31177924 [0,0,0,1,0,0|3,0,0]=4 1359 B10R1.61 C[C@@H]1CCCN[C@@H]1C(N)=O Amb24392330 [0,0,0,1,0,0|3,0,0]=4 1360 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb25911818 [0,0,0,1,0,0|3,0,0]=4 1361 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb32967641 [0,0,0,1,0,0|3,0,0]=4 1362 B10R1.61 C[C@@H]1CNCC[C@@H]1C(=O)O Amb33715674 [0,0,0,1,0,0|3,0,0]=4 1363 B10R1.61 C[C@@H]1COCC[C@H]1C(N)=O Amb28130095 [0,0,0,1,0,0|3,0,0]=4 1364 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb27881535 [0,0,0,1,0,0|3,0,0]=4 1365 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb32656204 [0,0,0,1,0,0|3,0,0]=4 1366 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O Amb18202482 [0,0,0,1,0,0|3,0,0]=4 1367 B10R1.61 C[C@@H]1OCCC[C@@H]1C(=O)O Amb27160030 [0,0,0,1,0,0|3,0,0]=4 1368 B10R1.61 C[C@H](O)[C@@H]1CCCC[C@@H]1O Amb28345285 [0,0,0,1,0,0|0,0,2]=3 1369 B10R1.61 C[C@H](O)[C@H]1CCCC[C@@H]1O Amb28455332 [0,0,0,1,0,0|0,0,2]=3 1370 B10R1.61 C[C@H]1CCCN[C@@H]1C(=O)O Amb27814735 [0,0,0,1,0,0|3,0,0]=4 1371 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb2695237 [0,0,0,1,0,0|3,0,0]=4 1372 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb28593755 [0,0,0,1,0,0|3,0,0]=4 1373 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O Amb26419672 [0,0,0,1,0,0|3,0,0]=4 1374 B10R1.61 C[C@H]1NCCC[C@H]1C(N)=O Amb27945004 [0,0,0,1,0,0|3,0,0]=4 1375 B10R1.61 C[SiH](C)C1CCCCC1O Amb25266683 [0,0,0,1,0,0|1,1,0]=3 1376 B10R1.61 C[SiH](C)[C@H]1CCCC[C@H]1O Amb27978495 [0,0,0,1,0,0|1,1,0]=3 1377 B10R1.61 C\C(Cl)=C1\CCCCC1Cl Amb28193710 [0,0,0,1,0,0|2,0,1]=4 1378 B10R1.61 NC(=O)C1CCCCC1=O Amb590784 [0,0,0,1,0,0|1,0,2]=4 1379 B10R1.61 NC(=O)C1CCCCC1Cl Amb27180588 [0,0,0,1,0,0|2,0,0]=3 1380 B10R1.61 NC(=O)C1CCCCC1F Amb32943802 [0,0,0,1,0,0|2,0,0]=3 1381 B10R1.61 NC(=O)C1CCCCC1N Amb1125131 [0,0,0,1,0,0|2,0,0]=3 1382 B10R1.61 NC(=O)C1CCCCC1N Amb20623397 [0,0,0,1,0,0|2,0,0]=3 1383 B10R1.61 NC(=O)C1CCCCC1O Amb25724469 [0,0,0,1,0,0|1,0,0]=2 1384 B10R1.61 NC(=O)C1CNCCC1F Amb27813452 [0,0,0,1,0,0|3,0,0]=4 1385 B10R1.61 NC(=O)C1NCCCC1O Amb27632369 [0,0,0,1,0,0|2,0,0]=3 1386 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N Amb8515028 [0,0,0,1,0,0|2,0,0]=3 1387 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1O Amb8515026 [0,0,0,1,0,0|1,0,0]=2 1388 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1N Amb1994026 [0,0,0,1,0,0|2,0,0]=3 1389 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1O Amb6356272 [0,0,0,1,0,0|1,0,0]=2 1390 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1Cl Amb27983650 [0,0,0,1,0,0|2,0,0]=3 1391 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb10608207 [0,0,0,1,0,0|2,0,0]=3 1392 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb22757841 [0,0,0,1,0,0|2,0,0]=3 1393 B10R1.61 NC(=O)[C@H]1NCCC[C@@H]1O Amb28423484 [0,0,0,1,0,0|2,0,0]=3 1394 B10R1.61 NC1CCCCC1C(=O)O Amb20626164 [0,0,0,1,0,0|2,0,0]=3 1395 B10R1.61 NC1CCCCC1C(=O)O Amb2694788 [0,0,0,1,0,0|2,0,0]=3 1396 B10R1.61 NC1CCCCC1[N+](=O)[O-] Amb27843413 [0,0,0,1,0,0|3,0,0]=4 1397 B10R1.61 NC1CCCNC1C(=O)O Amb35750913 [0,0,0,1,0,0|3,0,0]=4 1398 B10R1.61 NC1CCCNC1C(=O)O Amb35751901 [0,0,0,1,0,0|3,0,0]=4 1399 B10R1.61 NC1CCCOC1C(=O)O Amb18202149 [0,0,0,1,0,0|3,0,0]=4 1400 B10R1.61 NC1CCNCC1C(=O)O Amb13886611 [0,0,0,1,0,0|3,0,0]=4 1401 B10R1.61 NC1CCOCC1C(=O)O Amb18202373 [0,0,0,1,0,0|3,0,0]=4 1402 B10R1.61 NC1CNCCC1C(=O)O Amb27790638 [0,0,0,1,0,0|3,0,0]=4 1403 B10R1.61 NS(=O)C1CCCCC1Cl Amb32720369 [0,0,0,1,0,0|3,0,0]=4 1404 B10R1.61 NS(=O)C1CCCCC1O Amb32720364 [0,0,0,1,0,0|2,0,0]=3 1405 B10R1.61 NS(=O)[C@@H]1CCCC[C@@H]1F Amb32720976 [0,0,0,1,0,0|3,0,0]=4 1406 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb19148605 [0,0,0,1,0,0|2,0,0]=3 1407 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb22224856 [0,0,0,1,0,0|2,0,0]=3 1408 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993721 [0,0,0,1,0,0|2,0,0]=3 1409 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993765 [0,0,0,1,0,0|2,0,0]=3 1410 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb23399726 [0,0,0,1,0,0|3,0,0]=4 1411 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb33484156 [0,0,0,1,0,0|3,0,0]=4 1412 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O Amb22224868 [0,0,0,1,0,0|2,0,0]=3 1413 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb1993720 [0,0,0,1,0,0|2,0,0]=3 1414 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb6365686 [0,0,0,1,0,0|2,0,0]=3 1415 B10R1.61 N[C@H]1CNCC[C@H]1C(=O)O Amb28345659 [0,0,0,1,0,0|3,0,0]=4 1416 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb26014626 [0,0,0,1,0,0|3,0,0]=4 1417 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb33482769 [0,0,0,1,0,0|3,0,0]=4 1418 B10R1.61 O=C(Cl)C1CCCCC1Cl Amb26539683 [0,0,0,1,0,0|2,0,0]=3 1419 B10R1.61 O=C(Cl)C1CCCCC1F Amb27663686 [0,0,0,1,0,0|2,0,0]=3 1420 B10R1.61 O=C(O)C1=CCCCC1O Amb27792988 [0,0,0,1,0,0|1,0,2]=4 1421 B10R1.61 O=C(O)C1CCCCC1=O Amb16230759 [0,0,0,1,0,0|1,0,2]=4 1422 B10R1.61 O=C(O)C1CCCCC1=S Amb27657573 [0,0,0,1,0,0|1,1,1]=4 1423 B10R1.61 O=C(O)C1CCCCC1Br Amb27425110 [0,0,0,1,0,0|2,0,0]=3 1424 B10R1.61 O=C(O)C1CCCCC1Cl Amb18126348 [0,0,0,1,0,0|2,0,0]=3 1425 B10R1.61 O=C(O)C1CCCCC1F Amb32667613 [0,0,0,1,0,0|2,0,0]=3 1426 B10R1.61 O=C(O)C1CCCCC1O Amb2694762 [0,0,0,1,0,0|1,0,0]=2 1427 B10R1.61 O=C(O)C1CCCCN1O Amb24445203 [0,0,0,1,0,0|2,0,0]=3 1428 B10R1.61 O=C(O)C1CCNCC1F Amb24077319 [0,0,0,1,0,0|3,0,0]=4 1429 B10R1.61 O=C(O)C1CCNCC1F Amb25287074 [0,0,0,1,0,0|3,0,0]=4 1430 B10R1.61 O=C(O)C1CCOCC1F Amb27968266 [0,0,0,1,0,0|3,0,0]=4 1431 B10R1.61 O=C(O)C1CCSCC1F Amb28290523 [0,0,0,1,0,0|3,0,0]=4 1432 B10R1.61 O=C(O)C1CNCCC1F Amb24331967 [0,0,0,1,0,0|3,0,0]=4 1433 B10R1.61 O=C(O)C1NCCCC1O Amb18124725 [0,0,0,1,0,0|2,0,0]=3 1434 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1Cl Amb28288041 [0,0,0,1,0,0|2,0,0]=3 1435 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1O Amb16204296 [0,0,0,1,0,0|1,0,0]=2 1436 B10R1.61 O=C(O)[C@@H]1CCNC[C@H]1O Amb22748902 [0,0,0,1,0,0|2,0,0]=3 1437 B10R1.61 O=C(O)[C@@H]1NCCC[C@@H]1O Amb25214386 [0,0,0,1,0,0|2,0,0]=3 1438 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O Amb28411494 [0,0,0,1,0,0|2,0,0]=3 1439 B10R1.61 O=C(O)[C@H]1CCCC[C@@H]1Cl Amb27634391 [0,0,0,1,0,0|2,0,0]=3 1440 B10R1.61 O=C(O)[C@H]1CCCC[C@H]1O Amb4022448 [0,0,0,1,0,0|1,0,0]=2 1441 B10R1.61 O=C(O)[C@H]1CNCC[C@@H]1S Amb28199242 [0,0,0,1,0,0|2,1,0]=4 1442 B10R1.61 O=C(O)[C@H]1CNCC[C@H]1S Amb27444152 [0,0,0,1,0,0|2,1,0]=4 1443 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O Amb25340376 [0,0,0,1,0,0|2,0,0]=3 1444 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O Amb25912162 [0,0,0,1,0,0|2,0,0]=3 1445 B10R1.61 O=C(O)[C@H]1NNCC[C@H]1O Amb27470751 [0,0,0,1,0,0|3,0,0]=4 1446 B10R1.61 O=C([O-])C1CCCCN1O Amb33735074 [0,0,0,1,0,0|2,0,0]=3 1447 B10R1.61 O=C([O-])C1NCCCC1O Amb32683394 [0,0,0,1,0,0|2,0,0]=3 1448 B10R1.61 O=C([O-])[C@@H]1NCCC[C@@H]1O Amb32687469 [0,0,0,1,0,0|2,0,0]=3 1449 B10R1.61 O=S(Cl)C1CCCCC1Cl Amb32720368 [0,0,0,1,0,0|3,0,0]=4 1450 B10R1.61 O=S(Cl)C1CCCCC1O Amb32720365 [0,0,0,1,0,0|2,0,0]=3 1451 B10R1.61 O=S(Cl)[C@@H]1CCCC[C@@H]1F Amb32720975 [0,0,0,1,0,0|3,0,0]=4 1452 B10R1.61 O=S([O-])C1CCCCC1Cl Amb32754272 [0,0,0,1,0,0|3,0,0]=4 1453 B10R1.61 O=S([O-])C1CCCCC1O Amb32754265 [0,0,0,1,0,0|2,0,0]=3 1454 B10R1.61 O=S([O-])[C@@H]1CCCC[C@@H]1F Amb32755713 [0,0,0,1,0,0|3,0,0]=4 1455 B10R1.61 O=[N+]([O-])C1CCCCC1F Amb24433329 [0,0,0,1,0,0|3,0,0]=4 1456 B10R1.61 O=[N+]([O-])C1CCCCC1O Amb18831474 [0,0,0,1,0,0|2,0,0]=3 1457 B10R1.61 OC1CCCCC1=C(F)F Amb27651917 [0,0,0,1,0,0|2,0,1]=4 1458 B10R1.61 OC1CCCCC1C(F)F Amb33213772 [0,0,0,1,0,0|2,0,1]=4 1459 B10R1.61 O[C@@H]1CCCC[C@H]1C(F)F Amb32944754 [0,0,0,1,0,0|2,0,1]=4 1460 B10R1.86 C=C(C)[C@@H]1CC[C@@H]1CCO Amb27207528 [0,0,0,1,0,0|3,0,0]=4 1461 B10R1.86 CCCC1CCN1C(N)=O Amb27223621 [0,0,0,1,0,0|3,0,0]=4 1462 B10R1.86 CCCC1NCC1C(C)C Amb27184683 [0,0,0,1,0,0|2,0,1]=4 1463 B10R1.86 CCCN1CCC1C(=O)O Amb22011891 [0,0,0,1,0,0|3,0,0]=4 1464 B10R1.86 CCCN1CC[C@@H]1C(=O)O Amb30869401 [0,0,0,1,0,0|3,0,0]=4 1465 B10R1.86 CCCN1CC[C@H]1C(=O)O Amb33801596 [0,0,0,1,0,0|3,0,0]=4 1466 B10R1.86 CNCC1CCN1C(C)=O Amb27778316 [0,0,0,1,0,0|3,0,0]=4 1467 B10R1.86 O=C(O)C1CCC1CCF Amb27229342 [0,0,0,1,0,0|3,0,0]=4 1468 B10R1.91 CCCC1C(C)C1C(=O)O Amb28421897 [0,0,0,1,0,0|2,0,0]=3 1469 B10R1.91 CCC[C@@H]1[C@H](C)[C@H]1C(=O)O Amb28067787 [0,0,0,1,0,0|2,0,0]=3 1470 B10R1.91 CCOC1C(C)C1C(=O)O Amb9677558 [0,0,0,1,0,0|3,0,0]=4 1471 B10R1.160 CC(C)C1(CO)CC1CO Amb33133223 [0,0,0,1,0,0|2,0,1]=4 1472 B10R1.160 CCC1(C(=O)O)CC1CO Amb32947163 [0,0,0,1,0,0|3,0,0]=4 1473 B10R1.160 CCC1CC1(C#N)C(=O)O Amb27400849 [0,0,0,1,0,0|2,0,1]=4 1474 B10R1.160 CCC1CC1(CC)C(C)=O Amb27607235 [0,0,0,1,0,0|1,0,0]=2 1475 B10R1.160 CCC1CC1(CN)C(=O)O Amb25888057 [0,0,0,1,0,0|2,0,0]=3 1476 B10R1.160 CCC1CC1(SC)C(=O)O Amb25276918 [0,0,0,1,0,0|3,0,0]=4 1477 B10R1.160 CCC1OC1(CC)C(N)=O Amb25055487 [0,0,0,1,0,0|3,0,0]=4 1478 B10R1.160 NC(=O)C1(CO)CC1CO Amb26627430 [0,0,0,1,0,0|2,0,0]=3 1479 B10R1.160 NC(=O)[C@@]1(CO)C[C@@H]1CO Amb27878485 [0,0,0,1,0,0|2,0,0]=3 1480 B10R1.160 NC(=O)[C@]1(CO)C[C@H]1CO Amb27421993 [0,0,0,1,0,0|2,0,0]=3 1481 B10R1.160 NCC1(C(=O)O)CC1CO Amb25228881 [0,0,0,1,0,0|3,0,0]=4 1482 B10R1.163 O=C(O)C1NC(CO)C1O Amb28143118 [0,0,0,1,0,0|3,0,0]=4 1483 B10R1.163 O=C(O)C1OC(CO)C1O Amb27168739 [0,0,0,1,0,0|3,0,0]=4 1484 B10R1.188 CC1(C)C(CO)C1CCBr Amb27424818 [0,0,0,1,0,0|2,0,1]=4 1485 B10R1.188 CCCC1C(CN)C1(C)C Amb25346853 [0,0,0,1,0,0|2,0,1]=4 1486 B10R1.188 CCC[C@@H]1[C@@H](CN)C1(C)C Amb33374812 [0,0,0,1,0,0|2,0,1]=4 1487 B10R1.194 C=C(C)[C@@H]1CC[C@H](C)C1=O Amb27854628 [0,0,0,1,0,0|1,0,2]=4 1488 B10R1.194 C=C(C)[C@H]1CC[C@@H](C)[C@@H]1O Amb27439852 [0,0,0,1,0,0|1,0,0]=2 1489 B10R1.194 C=C(C)[C@H]1CC[C@H](O)[C@@H]1C Amb27857951 [0,0,0,1,0,0|3,0,0]=4 1490 B10R1.194 C=C(C)[C@H]1CC[C@H](O)[C@H]1C Amb28401117 [0,0,0,1,0,0|3,0,0]=4 1491 B10R1.194 CC(=O)C1=C(C)C(C)CC1 Amb28067496 [0,0,0,1,0,0|1,0,2]=4 1492 B10R1.194 CC(=O)C1CCC(C)=C1C Amb27476269 [0,0,0,1,0,0|1,0,2]=4 1493 B10R1.194 CC(=O)C1COC(C)C1C Amb35732634 [0,0,0,1,0,0|2,0,0]=3 1494 B10R1.194 CC(=O)C1COC(O)C1C Amb27607619 [0,0,0,1,0,0|3,0,0]=4 1495 B10R1.194 CC(=O)C1NCC(C)C1C Amb25684648 [0,0,0,1,0,0|2,0,0]=3 1496 B10R1.194 CC(=O)C1NCC(O)C1O Amb27234084 [0,0,0,1,0,0|2,0,0]=3 1497 B10R1.194 CC(=O)C1NC[C@@H](O)[C@@H]1O Amb27483158 [0,0,0,1,0,0|2,0,0]=3 1498 B10R1.194 CC(=O)C1SCC(O)C1O Amb27953832 [0,0,0,1,0,0|2,0,0]=3 1499 B10R1.194 CC(=O)C1SC[C@@H](O)[C@H]1O Amb27973089 [0,0,0,1,0,0|2,0,0]=3 1500 B10R1.194 CC(=O)N1CCC(N)C1C Amb27825833 [0,0,0,1,0,0|3,0,0]=4 1501 B10R1.194 CC(=O)[C@@H]1COC(O)[C@@H]1C Amb27428191 [0,0,0,1,0,0|3,0,0]=4 1502 B10R1.194 CC(=O)[C@@H]1COC(O)[C@H]1C Amb26555749 [0,0,0,1,0,0|3,0,0]=4 1503 B10R1.194 CC(=O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb27626038 [0,0,0,1,0,0|2,0,0]=3 1504 B10R1.194 CC(=O)[C@H]1COC(O)[C@@H]1C Amb28052107 [0,0,0,1,0,0|3,0,0]=4 1505 B10R1.194 CC(=O)[C@H]1CO[C@H](O)[C@H]1C Amb27626851 [0,0,0,1,0,0|3,0,0]=4 1506 B10R1.194 CC(C)[C@H]1CC[C@@H](C)[C@@H]1O Amb27451580 [0,0,0,1,0,0|1,0,1]=3 1507 B10R1.194 CC(C)[C@H]1CC[C@@H](C)[C@H]1O Amb27268417 [0,0,0,1,0,0|1,0,1]=3 1508 B10R1.194 CC(O)C1CCC(C)C1C Amb27190824 [0,0,0,1,0,0|1,0,2]=4 1509 B10R1.194 CC(O)C1CCC(O)C1O Amb28069583 [0,0,0,1,0,0|1,0,2]=4 1510 B10R1.194 CC1C(C(=O)O)CCN1C Amb28050081 [0,0,0,1,0,0|3,0,0]=4 1511 B10R1.194 CC1C(C(=O)O)CCN1C Amb28555552 [0,0,0,1,0,0|3,0,0]=4 1512 B10R1.194 CC1CCC(C(=O)O)C1N Amb20623936 [0,0,0,1,0,0|2,0,0]=3 1513 B10R1.194 CC1CCC(C(N)=O)C1C Amb26365871 [0,0,0,1,0,0|2,0,0]=3 1514 B10R1.194 CC1CCN(C(N)=O)C1C Amb28063773 [0,0,0,1,0,0|3,0,0]=4 1515 B10R1.194 CC1CC[C@@H](C(=O)O)N1C Amb27242545 [0,0,0,1,0,0|3,0,0]=4 1516 B10R1.194 CC1CC[C@@H](C(=O)O)[C@H]1N Amb27789618 [0,0,0,1,0,0|2,0,0]=3 1517 B10R1.194 CC1CC[C@H](C(=O)O)C1C Amb28347215 [0,0,0,1,0,0|2,0,0]=3 1518 B10R1.194 CC1OCC(C(=O)O)C1C Amb30018712 [0,0,0,1,0,0|3,0,0]=4 1519 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)N1C Amb24715908 [0,0,0,1,0,0|3,0,0]=4 1520 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb27874070 [0,0,0,1,0,0|2,0,0]=3 1521 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)N1C Amb33714494 [0,0,0,1,0,0|3,0,0]=4 1522 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@@H]1C Amb27217301 [0,0,0,1,0,0|2,0,0]=3 1523 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@H]1N Amb24618144 [0,0,0,1,0,0|2,0,0]=3 1524 B10R1.194 C[C@@H]1CN[C@@H](C(=O)O)[C@@H]1O Amb24540945 [0,0,0,1,0,0|2,0,0]=3 1525 B10R1.194 C[C@@H]1[C@@H](C(=O)O)CCN1C Amb18202481 [0,0,0,1,0,0|3,0,0]=4 1526 B10R1.194 C[C@@H]1[C@H](C(=O)O)CCN1C Amb28721110 [0,0,0,1,0,0|3,0,0]=4 1527 B10R1.194 C[C@H]1CC[C@@H](C(=O)O)N1C Amb32643970 [0,0,0,1,0,0|3,0,0]=4 1528 B10R1.194 C[C@H]1CC[C@H](C(=O)O)[C@@H]1C Amb28067785 [0,0,0,1,0,0|2,0,0]=3 1529 B10R1.194 C[C@H]1CNC(C(=O)O)[C@H]1O Amb27216674 [0,0,0,1,0,0|2,0,0]=3 1530 B10R1.194 NC(=O)[C@@H]1OC[C@@H](O)[C@H]1O Amb24683290 [0,0,0,1,0,0|3,0,0]=4 1531 B10R1.194 NC1C(O)CCC1C(=O)O Amb28077395 [0,0,0,1,0,0|3,0,0]=4 1532 B10R1.194 NC1CNC(C(=O)O)C1O Amb27838148 [0,0,0,1,0,0|3,0,0]=4 1533 B10R1.194 N[C@@H]1CN[C@H](C(=O)O)[C@H]1O Amb25912150 [0,0,0,1,0,0|3,0,0]=4 1534 B10R1.194 N[C@H]1[C@@H](O)CC[C@@H]1C(=O)O Amb27473358 [0,0,0,1,0,0|3,0,0]=4 1535 B10R1.194 O=C(O)C1CCC(O)C1O Amb24480401 [0,0,0,1,0,0|2,0,0]=3 1536 B10R1.194 O=C(O)C1NCC(O)C1O Amb24120646 [0,0,0,1,0,0|3,0,0]=4 1537 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@@H]1O Amb28248507 [0,0,0,1,0,0|2,0,0]=3 1538 B10R1.194 O=C(O)[C@@H]1CC[C@@H](O)[C@H]1O Amb27482063 [0,0,0,1,0,0|2,0,0]=3 1539 B10R1.194 O=C(O)[C@@H]1CC[C@H](O)[C@@H]1O Amb27438244 [0,0,0,1,0,0|2,0,0]=3 1540 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@@H]1O Amb27258648 [0,0,0,1,0,0|3,0,0]=4 1541 B10R1.194 O=C(O)[C@@H]1NC[C@@H](O)[C@H]1O Amb24546981 [0,0,0,1,0,0|3,0,0]=4 1542 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@@H]1O Amb24605220 [0,0,0,1,0,0|3,0,0]=4 1543 B10R1.194 O=C(O)[C@@H]1NC[C@H](O)[C@H]1O Amb25259269 [0,0,0,1,0,0|3,0,0]=4 1544 B10R1.194 O=C(O)[C@H]1NCC(O)C1O Amb27647851 [0,0,0,1,0,0|3,0,0]=4 1545 B10R1.194 O=C(O)[C@H]1NCC(O)[C@@H]1O Amb28203927 [0,0,0,1,0,0|3,0,0]=4 1546 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27252019 [0,0,0,1,0,0|3,0,0]=4 1547 B10R1.194 O=C(O)[C@H]1NC[C@@H](O)[C@H]1O Amb27246425 [0,0,0,1,0,0|3,0,0]=4 1548 B10R1.194 O=C(O)[C@H]1NC[C@H](O)[C@@H]1O Amb24120647 [0,0,0,1,0,0|3,0,0]=4 1549 B10R1.195 CCCCC(CC)C1CO1 Amb27405711 [0,0,0,1,0,0|1,0,2]=4 1550 B10R1.195 CNCCC(CO)C1CC1 Amb33133712 [0,0,0,1,0,0|2,0,1]=4 1551 B10R1.214 CC1CC1C(CN)C(=O)O Amb33145043 [0,0,0,1,0,0|2,0,0]=3 1552 B10R1.214 CCC(C(=O)O)C1CC1C Amb26951804 [0,0,0,1,0,0|2,0,0]=3 1553 B10R1.219 CC(=O)C(CN)C1CCC1 Amb33132192 [0,0,0,1,0,0|1,0,0]=2 1554 B10R1.219 CC(C)C(CBr)C1CCC1 Amb27603734 [0,0,0,1,0,0|2,0,1]=4 1555 B10R1.219 CC(C)C(CCl)C1CCC1 Amb24464067 [0,0,0,1,0,0|2,0,1]=4 1556 B10R1.219 CC(C)C(CO)C1COC1 Amb27962705 [0,0,0,1,0,0|2,0,1]=4 1557 B10R1.219 CC(C)C(CO)C1CSC1 Amb27612894 [0,0,0,1,0,0|2,0,1]=4 1558 B10R1.219 CC(N)C(CO)C1CCC1 Amb27777482 [0,0,0,1,0,0|1,0,1]=3 1559 B10R1.219 CC(O)C(CN)C1CCC1 Amb35665972 [0,0,0,1,0,0|1,0,2]=4 1560 B10R1.219 CCC(C(=O)O)C1CCC1 Amb23590271 [0,0,0,1,0,0|2,0,0]=3 1561 B10R1.219 CCC(C(=O)O)C1COC1 Amb33165629 [0,0,0,1,0,0|3,0,0]=4 1562 B10R1.219 CCC(C(=O)O)C1CSC1 Amb32685726 [0,0,0,1,0,0|3,0,0]=4 1563 B10R1.219 CCN(C(C)=O)C1CCC1 Amb28125591 [0,0,0,1,0,0|2,0,0]=3 1564 B10R1.219 CN(C)C(CN)C1CCC1 Amb28049658 [0,0,0,1,0,0|3,0,0]=4 1565 B10R1.219 CNC(C(=O)O)C1CCC1 Amb28049636 [0,0,0,1,0,0|3,0,0]=4 1566 B10R1.219 COC(C(=O)O)C1CCC1 Amb25027993 [0,0,0,1,0,0|3,0,0]=4 1567 B10R1.219 COC(C(C)=O)C1CCC1 Amb35718497 [0,0,0,1,0,0|2,0,0]=3 1568 B10R1.219 COC(C(N)=O)C1CCC1 Amb35611159 [0,0,0,1,0,0|3,0,0]=4 1569 B10R1.219 NCC(C(=O)O)C1CCC1 Amb25977788 [0,0,0,1,0,0|2,0,0]=3 1570 B10R1.219 NCC(C(=O)O)C1CCC1 Amb30868145 [0,0,0,1,0,0|2,0,0]=3 1571 B10R1.219 NCC(C(=O)O)N1CCC1 Amb27648289 [0,0,0,1,0,0|3,0,0]=4 1572 B10R1.219 NCC(C(N)=O)C1CCC1 Amb27636639 [0,0,0,1,0,0|2,0,0]=3 1573 B10R1.219 O=C(O)C(CF)C1CCC1 Amb27624605 [0,0,0,1,0,0|2,0,0]=3 1574 B10R1.219 O=C(O)C(CO)C1CNC1 Amb27964722 [0,0,0,1,0,0|2,0,0]=3 1575 B10R1.229 CC1CCC1(C#N)C(=O)O Amb27185761 [0,0,0,1,0,0|2,0,1]=4 1576 B10R1.229 CC1CCC1(CN)C(=O)O Amb26976234 [0,0,0,1,0,0|2,0,0]=3 1577 B10R1.229 CC1CCC1(CN)C(=O)O Amb32789664 [0,0,0,1,0,0|2,0,0]=3 1578 B10R1.229 CC1CCC1(CO)C(F)F Amb33041463 [0,0,0,1,0,0|2,0,1]=4 1579 B10R1.229 CNC1(C(=O)O)CCC1C Amb27632510 [0,0,0,1,0,0|3,0,0]=4 1580 B10R1.229 CSC1(C(=O)O)CCC1C Amb27812983 [0,0,0,1,0,0|3,0,0]=4 1581 B10R1.229 NC1CCC1(CO)C(=O)O Amb27607782 [0,0,0,1,0,0|2,0,0]=3 1582 B10R1.229 N[C@@H]1CC[C@]1(CO)C(=O)O Amb27494021 [0,0,0,1,0,0|2,0,0]=3 1583 B10R1.259 CC1CCC(CBr)C1(C)C Amb27768838 [0,0,0,1,0,0|2,0,1]=4 1584 B10R1.259 CC1CCC(CN)C1(C)C Amb28314784 [0,0,0,1,0,0|2,0,1]=4 1585 B10R1.259 CC1COC(CO)C1(C)O Amb27396478 [0,0,0,1,0,0|1,0,2]=4 1586 B10R1.259 C[C@H]1CC[C@@H](CO)C1(C)C Amb27207427 [0,0,0,1,0,0|1,0,1]=3 1587 B10R1.260 C=CC[C@H]1CC(=O)N1CO Amb27456681 [0,0,0,1,0,0|1,0,2]=4 1588 B10R1.260 CCC1C(=O)NC1CCO Amb27873936 [0,0,0,1,0,0|3,0,0]=4 1589 B10R1.260 CCC[C@@H]1NC(=O)[C@H]1CC Amb27440229 [0,0,0,1,0,0|2,0,0]=3 1590 B10R1.260 CCOC1CC(=O)C1CC Amb27838948 [0,0,0,1,0,0|2,0,0]=3 1591 B10R1.260 CCOC1CC(=O)C1OC Amb25320142 [0,0,0,1,0,0|3,0,0]=4 1592 B10R1.260 CCOC1CC(=O)C1SC Amb24407824 [0,0,0,1,0,0|3,0,0]=4 1593 B10R1.260 CCO[C@@H]1CC(=O)[C@H]1CC Amb27432637 [0,0,0,1,0,0|2,0,0]=3 1594 B10R1.260 CCO[C@@H]1CC(=O)[C@H]1OC Amb24633626 [0,0,0,1,0,0|3,0,0]=4 1595 B10R1.260 CCO[C@@H]1C[C@H](C)[C@H]1CO Amb27978326 [0,0,0,1,0,0|2,0,1]=4 1596 B10R1.260 CCO[C@H]1CC(=O)[C@@H]1OC Amb32663789 [0,0,0,1,0,0|3,0,0]=4 1597 B10R1.260 CCO[C@H]1CC(=O)[C@H]1CC Amb28134327 [0,0,0,1,0,0|2,0,0]=3 1598 B10R1.348 CC(=O)C1=CSCCCC1 Amb26322340 [0,0,0,1,0,0|0,1,2]=4 1599 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|1,0,0]=2 1600 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,0]=3 1601 B10R1.348 CC(=O)C1CCCOCC1 Amb27772516 [0,0,0,1,0,0|2,0,0]=3 1602 B10R1.348 CC(=O)C1CCCSCC1 Amb30031083 [0,0,0,1,0,0|2,0,0]=3 1603 B10R1.348 CC(=O)C1CNCCOC1 Amb33132256 [0,0,0,1,0,0|1,0,0]=2 1604 B10R1.348 CC(=O)C1COCCOC1 Amb27949270 [0,0,0,1,0,0|1,0,0]=2 1605 B10R1.348 CC(=O)N1CCCCCC1 Amb6340881 [0,0,0,1,0,0|2,0,0]=3 1606 B10R1.348 CC(=O)N1CCCNCC1 Amb1157142 [0,0,0,1,0,0|3,0,0]=4 1607 B10R1.348 CC(=O)N1CCCNCC1 Amb19959942 [0,0,0,1,0,0|3,0,0]=4 1608 B10R1.348 CC(=O)N1CCCNCC1 Amb22587131 [0,0,0,1,0,0|3,0,0]=4 1609 B10R1.348 CC(=O)N1CCCOCC1 Amb28126728 [0,0,0,1,0,0|3,0,0]=4 1610 B10R1.348 CC(C)=C1CCCCCC1 Amb25048552 [0,0,0,1,0,0|2,0,1]=4 1611 B10R1.348 CC(C)C1CCCCNC1 Amb27210646 [0,0,0,1,0,0|2,0,1]=4 1612 B10R1.348 CC(C)C1CNCCOC1 Amb27472181 [0,0,0,1,0,0|2,0,1]=4 1613 B10R1.348 CC(N)C1CCCCCC1 Amb18202669 [0,0,0,1,0,0|2,0,1]=4 1614 B10R1.348 CC(N)C1CCCCCC1 Amb32666063 [0,0,0,1,0,0|2,0,1]=4 1615 B10R1.348 CC(N)C1COCCOC1 Amb27642839 [0,0,0,1,0,0|2,0,1]=4 1616 B10R1.348 CC(O)C1CCCCCC1 Amb24712689 [0,0,0,1,0,0|1,0,2]=4 1617 B10R1.348 CC(O)C1COCCOC1 Amb27234825 [0,0,0,1,0,0|1,0,2]=4 1618 B10R1.348 CN(C)C1CCCCCC1 Amb27460632 [0,0,0,1,0,0|3,0,0]=4 1619 B10R1.348 CN(C)C1CCCCNC1 Amb17040622 [0,0,0,1,0,0|3,0,0]=4 1620 B10R1.348 CN(C)[C@H]1CCCCNC1 Amb19517015 [0,0,0,1,0,0|3,0,0]=4 1621 B10R1.348 CS(=O)C1CCCNCC1 Amb35630144 [0,0,0,1,0,0|3,0,0]=4 1622 B10R1.348 C[C@@H](N)C1CCCCCC1 Amb27948161 [0,0,0,1,0,0|2,0,1]=4 1623 B10R1.348 C[C@@H](N)C1CCCCCC1 Amb32932451 [0,0,0,1,0,0|2,0,1]=4 1624 B10R1.348 C[C@@H](O)C1CCCCCC1 Amb27801050 [0,0,0,1,0,0|1,0,2]=4 1625 B10R1.348 C[C@H](N)C1CCCCCC1 Amb26068799 [0,0,0,1,0,0|2,0,1]=4 1626 B10R1.348 C[C@H](N)C1CCCCCC1 Amb32932450 [0,0,0,1,0,0|2,0,1]=4 1627 B10R1.348 C[C@H](O)C1CCCCCC1 Amb27248256 [0,0,0,1,0,0|1,0,2]=4 1628 B10R1.348 N=C(N)C1CCCCCC1 Amb2696076 [0,0,0,1,0,0|3,0,0]=4 1629 B10R1.348 N=C(N)C1CCCCCC1 Amb33803881 [0,0,0,1,0,0|3,0,0]=4 1630 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|2,0,0]=3 1631 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|3,0,0]=4 1632 B10R1.348 NC(=O)C1CCCCNC1 Amb27483476 [0,0,0,1,0,0|2,0,0]=3 1633 B10R1.348 NC(=O)C1CCCSCC1 Amb30030983 [0,0,0,1,0,0|3,0,0]=4 1634 B10R1.348 NC(=O)C1CNCCNC1 Amb27475768 [0,0,0,1,0,0|3,0,0]=4 1635 B10R1.348 NC(=O)C1CNCCOC1 Amb20062256 [0,0,0,1,0,0|2,0,0]=3 1636 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [0,0,0,1,0,0|3,0,0]=4 1637 B10R1.348 NC(=S)C1CCCCCC1 Amb27787519 [0,0,0,1,0,0|2,1,0]=4 1638 B10R1.348 NS(=O)C1CCCCCC1 Amb32720551 [0,0,0,1,0,0|3,0,0]=4 1639 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|2,0,0]=3 1640 B10R1.348 O=C(Cl)C1CCCSCC1 Amb35649671 [0,0,0,1,0,0|3,0,0]=4 1641 B10R1.348 O=C(Cl)N1CCCCCC1 Amb17563067 [0,0,0,1,0,0|3,0,0]=4 1642 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [0,0,0,1,0,0|2,0,0]=3 1643 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [0,0,0,1,0,0|3,0,0]=4 1644 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [0,0,0,1,0,0|3,0,0]=4 1645 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [0,0,0,1,0,0|3,0,0]=4 1646 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [0,0,0,1,0,0|2,0,0]=3 1647 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [0,0,0,1,0,0|2,0,0]=3 1648 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [0,0,0,1,0,0|3,0,0]=4 1649 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|3,0,0]=4 1650 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [0,0,0,1,0,0|3,0,0]=4 1651 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|3,0,0]=4 1652 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|3,0,0]=4 1653 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [0,0,0,1,0,0|3,0,0]=4 1654 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [0,0,0,1,0,0|3,0,0]=4 1655 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|3,0,0]=4 1656 B10R1.348 O=C(O)C1CNCCOC1 Amb27600407 [0,0,0,1,0,0|2,0,0]=3 1657 B10R1.348 O=C(O)C1CNCCOC1 Amb32664315 [0,0,0,1,0,0|2,0,0]=3 1658 B10R1.348 O=C(O)C1CNCCSC1 Amb27813931 [0,0,0,1,0,0|2,1,0]=4 1659 B10R1.348 O=C(O)C1COCCOC1 Amb26443379 [0,0,0,1,0,0|2,0,0]=3 1660 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [0,0,0,1,0,0|3,0,0]=4 1661 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [0,0,0,1,0,0|3,0,0]=4 1662 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [0,0,0,1,0,0|3,0,0]=4 1663 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [0,0,0,1,0,0|3,0,0]=4 1664 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [0,0,0,1,0,0|2,1,0]=4 1665 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [0,0,0,1,0,0|3,0,0]=4 1666 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [0,0,0,1,0,0|3,0,0]=4 1667 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|3,0,0]=4 1668 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [0,0,0,1,0,0|3,0,0]=4 1669 B10R1.348 O=S(Cl)C1CCCCCC1 Amb32720550 [0,0,0,1,0,0|3,0,0]=4 1670 B10R1.348 O=S([O-])C1CCCCCC1 Amb32754517 [0,0,0,1,0,0|3,0,0]=4 1671 B10R1.348 O=[N+]([O-])C1CCCCCC1 Amb4036167 [0,0,0,1,0,0|3,0,0]=4 1672 B10R1.348 OB(O)C1CCCCOC1 Amb24314282 [0,0,0,1,0,0|2,0,1]=4 1673 B10R1.406 CCCCC1=C(N)CC1=O Amb28040918 [0,0,0,1,0,0|1,0,2]=4 1674 B10R1.406 CCCCC1C(=O)CC1C Amb27802538 [0,0,0,1,0,0|1,0,0]=2 1675 B10R1.406 CCCCC1C(=O)NC1C Amb27816027 [0,0,0,1,0,0|2,0,0]=3 1676 B10R1.406 CCCC[C@@H]1C(=O)C[C@@H]1C Amb28142264 [0,0,0,1,0,0|1,0,0]=2 1677 B10R1.406 CC\C=C\C1C(=O)CC1C Amb27599429 [0,0,0,1,0,0|1,0,2]=4 1678 B10R1.407 CCCCC1C(N)C1(C)C Amb33428089 [0,0,0,1,0,0|2,0,1]=4 1679 B10R1.407 CCCC[C@@H]1[C@@H](N)C1(C)C Amb33428088 [0,0,0,1,0,0|2,0,1]=4 1680 B10R1.437 C=CCCC1(C(C)=O)CC1 Amb27600413 [0,0,0,1,0,0|1,0,2]=4 1681 B10R1.437 CCCCC1(C(=O)O)CC1 Amb18062336 [0,0,0,1,0,0|2,0,0]=3 1682 B10R1.437 CCCCC1(C(C)=O)CC1 Amb18560520 [0,0,0,1,0,0|1,0,0]=2 1683 B10R1.437 CCCCC1(C(C)N)CC1 Amb23449235 [0,0,0,1,0,0|2,0,1]=4 1684 B10R1.437 CCCCC1(C(C)O)CC1 Amb24417859 [0,0,0,1,0,0|1,0,2]=4 1685 B10R1.437 CCCNC1(C(N)=O)CC1 Amb27663700 [0,0,0,1,0,0|3,0,0]=4 1686 B10R1.437 CCOCC1(C(=O)O)CC1 Amb23556059 [0,0,0,1,0,0|3,0,0]=4 1687 B10R1.437 CCSCC1(C(=O)O)CC1 Amb27795003 [0,0,0,1,0,0|3,0,0]=4 1688 B10R1.437 CCSCC1(C(C)=O)CC1 Amb33323690 [0,0,0,1,0,0|2,0,0]=3 1689 B10R1.437 CC\C=C\C1(C(C)=O)CC1 Amb31295293 [0,0,0,1,0,0|1,0,2]=4 1690 B10R1.437 CNCCC1(C(N)=O)CC1 Amb27634284 [0,0,0,1,0,0|3,0,0]=4 1691 B10R1.437 COCCC1(C(=O)O)CC1 Amb20622891 [0,0,0,1,0,0|3,0,0]=4 1692 B10R1.437 COCCC1(C(C)=O)CC1 Amb25090542 [0,0,0,1,0,0|2,0,0]=3 1693 B10R1.437 CSCCC1(C(=O)O)CC1 Amb24732629 [0,0,0,1,0,0|3,0,0]=4 1694 B10R1.437 CSCCC1(C(C)=O)CC1 Amb25990330 [0,0,0,1,0,0|2,0,0]=3 1695 B10R1.437 O=C(O)C1(CCCCl)CC1 Amb27817083 [0,0,0,1,0,0|3,0,0]=4 1696 B10R1.437 O=C(O)C1(CCCF)CC1 Amb28049561 [0,0,0,1,0,0|3,0,0]=4 1697 B10R1.437 O=C(O)C1(CCCO)CC1 Amb27874075 [0,0,0,1,0,0|3,0,0]=4 1698 B10R1.438 CCCCC1(CBr)CC1C Amb32690929 [0,0,0,1,0,0|2,0,1]=4 1699 B10R1.438 CCCCC1(CC)CC1N Amb27249421 [0,0,0,1,0,0|2,0,1]=4 1700 B10R1.438 CCCCC1(CCl)CC1C Amb32690861 [0,0,0,1,0,0|2,0,1]=4 1701 B10R1.455 CC1(C)C(CN)CC1CO Amb27758785 [0,0,0,1,0,0|2,0,1]=4 1702 B10R1.455 CC1(C)[C@@H](CO)C[C@H]1CO Amb28138608 [0,0,0,1,0,0|2,0,1]=4 1703 B10R1.455 CCC1CC(CN)C1(C)C Amb27393948 [0,0,0,1,0,0|2,0,1]=4 1704 B10R1.455 CCC1CC(CO)C1(C)C Amb28281815 [0,0,0,1,0,0|1,0,1]=3 1705 B10R1.455 CC[C@@H]1C[C@H](CO)C1(C)C Amb28065260 [0,0,0,1,0,0|1,0,1]=3 1706 B10R1.469 C=C(C)C(CC1CC1)NC Amb27604737 [0,0,0,1,0,0|3,0,0]=4 1707 B10R1.469 C=C(C)C(CC1CC1)NN Amb27866674 [0,0,0,1,0,0|3,0,0]=4 1708 B10R1.469 CC(=O)C(CN)CC1CC1 Amb33308002 [0,0,0,1,0,0|1,0,0]=2 1709 B10R1.469 CCC(CC1CC1)C(=O)O Amb18831634 [0,0,0,1,0,0|2,0,0]=3 1710 B10R1.469 CCC(CC1CC1)C(C)=O Amb27250010 [0,0,0,1,0,0|1,0,0]=2 1711 B10R1.469 CCC(SC1CC1)C(=O)O Amb27960276 [0,0,0,1,0,0|3,0,0]=4 1712 B10R1.469 CCN(CC1CC1)C(=O)Cl Amb32863946 [0,0,0,1,0,0|3,0,0]=4 1713 B10R1.469 CCN(CC1CC1)C(N)=O Amb28250338 [0,0,0,1,0,0|3,0,0]=4 1714 B10R1.469 CN[C@H](CC1CC1)C(=O)O Amb33347474 [0,0,0,1,0,0|3,0,0]=4 1715 B10R1.469 COC(CC1CC1)C(=O)O Amb25243296 [0,0,0,1,0,0|3,0,0]=4 1716 B10R1.469 N#CC(CC1CC1)C(=O)O Amb25216051 [0,0,0,1,0,0|2,0,1]=4 1717 B10R1.469 NC(=O)C(CO)NC1CC1 Amb27760575 [0,0,0,1,0,0|2,0,0]=3 1718 B10R1.469 NCC(CC1CC1)C(=O)O Amb19021768 [0,0,0,1,0,0|2,0,0]=3 1719 B10R1.469 NCC(CC1CC1)C(=O)O Amb28555450 [0,0,0,1,0,0|2,0,0]=3 1720 B10R1.469 NCC(CC1CC1)C(N)=O Amb27424967 [0,0,0,1,0,0|2,0,0]=3 1721 B10R1.469 NOC(CC1CC1)C(=O)O Amb32660233 [0,0,0,1,0,0|3,0,0]=4 1722 B10R1.469 O=C(O)C(CO)NC1CC1 Amb27266189 [0,0,0,1,0,0|2,0,0]=3 1723 B10R1.477 C#CC1(C(=O)O)CCCC1 Amb26515640 [0,0,0,1,0,0|2,0,1]=4 1724 B10R1.477 C#CC1(C(C)=O)CCCC1 Amb24666884 [0,0,0,1,0,0|1,0,1]=3 1725 B10R1.477 C=C(C)C1(CC)CCCN1 Amb28348061 [0,0,0,1,0,0|3,0,0]=4 1726 B10R1.477 C=C(C)C1(CN)CCCC1 Amb33199962 [0,0,0,1,0,0|2,0,0]=3 1727 B10R1.477 C=CC1(C(=O)O)CCCC1 Amb27955011 [0,0,0,1,0,0|2,0,1]=4 1728 B10R1.477 CC(=O)C1(C#N)CCCC1 Amb17593485 [0,0,0,1,0,0|1,0,1]=3 1729 B10R1.477 CC(=O)C1(C=O)CCCC1 Amb25770520 [0,0,0,1,0,0|0,0,2]=3 1730 B10R1.477 CC(=O)C1(CN)CCCC1 Amb33447092 [0,0,0,1,0,0|1,0,0]=2 1731 B10R1.477 CC(C)C1(CBr)CCCC1 Amb24427204 [0,0,0,1,0,0|2,0,1]=4 1732 B10R1.477 CC(C)C1(CCl)CCCC1 Amb26621745 [0,0,0,1,0,0|2,0,1]=4 1733 B10R1.477 CC(C)C1(CN)CCCC1 Amb25364781 [0,0,0,1,0,0|2,0,1]=4 1734 B10R1.477 CC(C)C1(CO)CCCC1 Amb27866928 [0,0,0,1,0,0|1,0,1]=3 1735 B10R1.477 CC(C)C1(CO)CCNC1 Amb24716550 [0,0,0,1,0,0|2,0,1]=4 1736 B10R1.477 CC(C)C1(CO)CCOC1 Amb27389658 [0,0,0,1,0,0|2,0,1]=4 1737 B10R1.477 CC(O)C1(CN)CCCC1 Amb25213912 [0,0,0,1,0,0|1,0,2]=4 1738 B10R1.477 CCC1(C(=O)O)CCCC1 Amb33531419 [0,0,0,1,0,0|2,0,0]=3 1739 B10R1.477 CCC1(C(=O)O)CCCN1 Amb15701408 [0,0,0,1,0,0|3,0,0]=4 1740 B10R1.477 CCC1(C(=O)O)CCCN1 Amb21959768 [0,0,0,1,0,0|3,0,0]=4 1741 B10R1.477 CCC1(C(=O)O)CCCO1 Amb24455991 [0,0,0,1,0,0|3,0,0]=4 1742 B10R1.477 CCC1(C(=O)O)CCNC1 Amb22059208 [0,0,0,1,0,0|3,0,0]=4 1743 B10R1.477 CCC1(C(=O)O)CCNC1 Amb32658029 [0,0,0,1,0,0|3,0,0]=4 1744 B10R1.477 CCC1(C(=O)O)CCOC1 Amb18964298 [0,0,0,1,0,0|3,0,0]=4 1745 B10R1.477 CCC1(C(C)=O)CCCC1 Amb27389662 [0,0,0,1,0,0|1,0,0]=2 1746 B10R1.477 CCC1(C(C)=O)CCCN1 Amb28341272 [0,0,0,1,0,0|2,0,0]=3 1747 B10R1.477 CCC1(C(C)=O)CCNC1 Amb25757356 [0,0,0,1,0,0|2,0,0]=3 1748 B10R1.477 CCC1(C(C)=O)NCCS1 Amb28384642 [0,0,0,1,0,0|3,0,0]=4 1749 B10R1.477 CCC1(C(C)=O)OCCO1 Amb27658781 [0,0,0,1,0,0|3,0,0]=4 1750 B10R1.477 CCC1(C(C)N)CCCC1 Amb27494333 [0,0,0,1,0,0|2,0,1]=4 1751 B10R1.477 CCC1(C(N)=O)CCCC1 Amb27948170 [0,0,0,1,0,0|2,0,0]=3 1752 B10R1.477 CCC1(C(N)=O)CCCN1 Amb28194366 [0,0,0,1,0,0|3,0,0]=4 1753 B10R1.477 CC[C@@]1(C(=O)O)CCCN1 Amb27617134 [0,0,0,1,0,0|3,0,0]=4 1754 B10R1.477 CC[C@@]1(C(=O)O)CCNC1 Amb27633957 [0,0,0,1,0,0|3,0,0]=4 1755 B10R1.477 CC[C@]1(C(=O)O)CCCN1 Amb24625134 [0,0,0,1,0,0|3,0,0]=4 1756 B10R1.477 CC[C@]1(C(=O)O)CCCN1 Amb32405295 [0,0,0,1,0,0|3,0,0]=4 1757 B10R1.477 CN(C)C1(CN)CCCC1 Amb32410131 [0,0,0,1,0,0|3,0,0]=4 1758 B10R1.477 CN(C)C1(CN)CCCC1 Amb6257389 [0,0,0,1,0,0|3,0,0]=4 1759 B10R1.477 CN(C)C1(CO)CCCC1 Amb24116817 [0,0,0,1,0,0|2,0,0]=3 1760 B10R1.477 CN(C)C1(CO)CCNC1 Amb28051658 [0,0,0,1,0,0|3,0,0]=4 1761 B10R1.477 CN(C)C1(CO)CCSC1 Amb24116838 [0,0,0,1,0,0|3,0,0]=4 1762 B10R1.477 CNC1(C(=O)O)CCCC1 Amb22587341 [0,0,0,1,0,0|3,0,0]=4 1763 B10R1.477 CNC1(C(=O)O)CCCC1 Amb9619694 [0,0,0,1,0,0|3,0,0]=4 1764 B10R1.477 CNC1(C(C)=O)CCCC1 Amb25782620 [0,0,0,1,0,0|2,0,0]=3 1765 B10R1.477 CNC1(C(N)=O)CCCC1 Amb18950554 [0,0,0,1,0,0|3,0,0]=4 1766 B10R1.477 COC1(C(=O)Cl)CCCC1 Amb27838850 [0,0,0,1,0,0|3,0,0]=4 1767 B10R1.477 COC1(C(=O)O)CCCC1 Amb33538130 [0,0,0,1,0,0|3,0,0]=4 1768 B10R1.477 COC1(C(C)=O)CCCC1 Amb24730344 [0,0,0,1,0,0|2,0,0]=3 1769 B10R1.477 COC1(C(C)=O)CCNC1 Amb33132297 [0,0,0,1,0,0|3,0,0]=4 1770 B10R1.477 COC1(C(C)=O)CCOC1 Amb27663929 [0,0,0,1,0,0|3,0,0]=4 1771 B10R1.477 COC1(C(C)=O)CCSC1 Amb27206875 [0,0,0,1,0,0|3,0,0]=4 1772 B10R1.477 CSC1(C(=O)O)CCCC1 Amb18953834 [0,0,0,1,0,0|3,0,0]=4 1773 B10R1.477 N#CC1(C(=O)O)CCCC1 Amb445430 [0,0,0,1,0,0|2,0,1]=4 1774 B10R1.477 N=C(N)C1(CO)CCCC1 Amb35720107 [0,0,0,1,0,0|2,0,0]=3 1775 B10R1.477 NC(=S)C1(CO)CCCC1 Amb35689523 [0,0,0,1,0,0|1,1,0]=3 1776 B10R1.477 NCC1(C(=O)O)CCCC1 Amb21955748 [0,0,0,1,0,0|2,0,0]=3 1777 B10R1.477 NCC1(C(=O)O)CCCC1 Amb9902139 [0,0,0,1,0,0|2,0,0]=3 1778 B10R1.477 NCC1(C(=O)O)CCOC1 Amb25839450 [0,0,0,1,0,0|3,0,0]=4 1779 B10R1.477 NCC1(C(N)=O)CCCC1 Amb18957372 [0,0,0,1,0,0|2,0,0]=3 1780 B10R1.477 NCC1(C(N)=O)CCOC1 Amb27238499 [0,0,0,1,0,0|3,0,0]=4 1781 B10R1.477 NCC1(C(N)=O)CCSC1 Amb27612995 [0,0,0,1,0,0|3,0,0]=4 1782 B10R1.477 NOC1(C(=O)O)CCCC1 Amb32660231 [0,0,0,1,0,0|3,0,0]=4 1783 B10R1.477 O=C(O)C1(CBr)CCCC1 Amb27857310 [0,0,0,1,0,0|2,0,0]=3 1784 B10R1.477 O=C(O)C1(CF)CCCC1 Amb27623733 [0,0,0,1,0,0|2,0,0]=3 1785 B10R1.477 O=C(O)C1(CO)CC=CC1 Amb35733624 [0,0,0,1,0,0|1,0,2]=4 1786 B10R1.477 O=C(O)C1(CO)CCCC1 Amb17399884 [0,0,0,1,0,0|1,0,0]=2 1787 B10R1.477 O=C(O)C1(CO)CCCN1 Amb28367641 [0,0,0,1,0,0|2,0,0]=3 1788 B10R1.477 O=C(O)C1(CO)CCCO1 Amb24453901 [0,0,0,1,0,0|2,0,0]=3 1789 B10R1.477 O=C(O)C1(CO)CCNC1 Amb26328041 [0,0,0,1,0,0|2,0,0]=3 1790 B10R1.477 O=C(O)C1(CO)CCNC1 Amb33743454 [0,0,0,1,0,0|2,0,0]=3 1791 B10R1.477 O=C(O)C1(CO)CCOC1 Amb26961454 [0,0,0,1,0,0|2,0,0]=3 1792 B10R1.477 O=C(O)C1(CO)CCSC1 Amb32946220 [0,0,0,1,0,0|2,0,0]=3 1793 B10R1.477 O=C(O)C1(CS)CCCC1 Amb28042748 [0,0,0,1,0,0|1,1,0]=3 1794 B10R1.477 OCC1(C(F)F)CCCC1 Amb32681221 [0,0,0,1,0,0|2,0,1]=4 1795 B10R0.87 CC(=O)OC(CBr)CCCBr Amb2721018 [0,0,0,0,0,1|2,0,0]=3 1796 B10R0.87 CCCCC(CBr)CC(C)C Amb32688659 [0,0,0,0,0,1|2,0,1]=4 1797 B10R0.87 CCCCC(CC)CC(=O)O Amb18797358 [0,0,0,0,0,1|2,0,0]=3 1798 B10R0.87 CCCCC(CC)OC(C)=O Amb31291624 [0,0,0,0,0,1|1,0,0]=2 1799 B10R0.87 CCCCC(CCl)CC(C)C Amb32688654 [0,0,0,0,0,1|2,0,1]=4 1800 B10R0.87 CCCCC(CN)CC(=O)O Amb33171809 [0,0,0,0,0,1|2,0,0]=3 1801 B10R0.87 CCCCC(CN)OC(C)C Amb33035087 [0,0,0,0,0,1|2,0,1]=4 1802 B10R0.87 CCCCN(CC)CC(=O)Cl Amb17142968 [0,0,0,0,0,1|3,0,0]=4 1803 B10R0.87 CCSCC(CN)CC(=O)O Amb33224190 [0,0,0,0,0,1|3,0,0]=4 1804 B10R0.87 COCCC(CN)CC(=O)O Amb33377833 [0,0,0,0,0,1|3,0,0]=4 1805 B10R0.87 CSCCC(CN)CC(=O)O Amb33199122 [0,0,0,0,0,1|3,0,0]=4 1806 B10R0.87 C\C=C\CC(CO)NC(C)=O Amb28326470 [0,0,0,0,0,1|0,0,2]=3 1807 B10R0.87 C\C=C\CC(CO)NC(N)=O Amb28326471 [0,0,0,0,0,1|1,0,2]=4 1808 B7R0.3 C#CC(C)CCCC Amb33169085 [2,0,0,0,0,0|0,0,2]=4 1809 B7R0.3 C#CCCC(C)C=O Amb28054858 [2,0,0,0,0,0|0,0,2]=4 1810 B7R0.3 C#CCCC(O)C=O Amb28246623 [2,0,0,0,0,0|0,0,2]=4 1811 B7R0.3 C=C(C=O)CCCC Amb4025817 [2,0,0,0,0,0|0,0,2]=4 1812 B7R0.3 C=C(CBr)CCCC Amb25249105 [2,0,0,0,0,0|1,0,1]=4 1813 B7R0.3 C=C(CC)CCCC Amb9787281 [2,0,0,0,0,0|1,0,1]=4 1814 B7R0.3 C=C(CCl)CCCC Amb25889368 [2,0,0,0,0,0|1,0,1]=4 1815 B7R0.3 C=C(CN)CCCC Amb27630595 [2,0,0,0,0,0|1,0,1]=4 1816 B7R0.3 C=CC(Br)CCCC Amb25758328 [2,0,0,0,0,0|1,0,1]=4 1817 B7R0.3 C=CC(C)CCCC Amb22641469 [2,0,0,0,0,0|0,0,1]=3 1818 B7R0.3 C=CC(C)CCCCl Amb27412986 [2,0,0,0,0,0|1,0,1]=4 1819 B7R0.3 C=CC(C)CCCO Amb22641468 [2,0,0,0,0,0|1,0,1]=4 1820 B7R0.3 C=CC(O)CCOC Amb27868318 [2,0,0,0,0,0|1,0,1]=4 1821 B7R0.3 C=CC(O)CCSC Amb28123529 [2,0,0,0,0,0|1,0,1]=4 1822 B7R0.3 C=CC(O)COCC Amb28316201 [2,0,0,0,0,0|1,0,1]=4 1823 B7R0.3 C=CC(O)CSCC Amb24543994 [2,0,0,0,0,0|1,0,1]=4 1824 B7R0.3 C=CCCC(C)C=O Amb25100921 [2,0,0,0,0,0|0,0,2]=4 1825 B7R0.3 C=CCCC(C)CO Amb27760347 [2,0,0,0,0,0|0,0,2]=4 1826 B7R0.3 C=CCCC(O)C=O Amb27863605 [2,0,0,0,0,0|0,0,2]=4 1827 B7R0.3 C=CCC[C@H](C)C=O Amb27799770 [2,0,0,0,0,0|0,0,2]=4 1828 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [2,0,0,0,0,0|1,0,1]=4 1829 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [2,0,0,0,0,0|1,0,1]=4 1830 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [2,0,0,0,0,0|1,0,1]=4 1831 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [2,0,0,0,0,0|1,0,1]=4 1832 B7R0.3 CC(C=N)CCCN Amb27640100 [2,0,0,0,0,0|2,0,0]=4 1833 B7R0.3 CC(C=O)CCC#N Amb26607829 [2,0,0,0,0,0|1,0,1]=4 1834 B7R0.3 CC(C=O)CCCBr Amb26526795 [2,0,0,0,0,0|1,0,0]=3 1835 B7R0.3 CC(C=O)SCCO Amb27827864 [2,0,0,0,0,0|2,0,0]=4 1836 B7R0.3 CC(CCl)CCCN Amb27472589 [2,0,0,0,0,0|2,0,0]=4 1837 B7R0.3 CC(CCl)CCCO Amb27439284 [2,0,0,0,0,0|2,0,0]=4 1838 B7R0.3 CC(CN)CCCBr Amb28246470 [2,0,0,0,0,0|2,0,0]=4 1839 B7R0.3 CC(CN)CCCO Amb17569906 [2,0,0,0,0,0|2,0,0]=4 1840 B7R0.3 CC(CN)CCCO Amb28934846 [2,0,0,0,0,0|2,0,0]=4 1841 B7R0.3 CC(CO)CCC#N Amb28128191 [2,0,0,0,0,0|1,0,1]=4 1842 B7R0.3 CC(CO)CCCN Amb17569904 [2,0,0,0,0,0|1,0,0]=3 1843 B7R0.3 CC(CO)CCCN Amb32686956 [2,0,0,0,0,0|1,0,0]=3 1844 B7R0.3 CC(CO)CCCO Amb25098490 [2,0,0,0,0,0|1,0,0]=3 1845 B7R0.3 CC(CO)NCCN Amb27805491 [2,0,0,0,0,0|2,0,0]=4 1846 B7R0.3 CC(CO)NCCO Amb9360025 [2,0,0,0,0,0|2,0,0]=4 1847 B7R0.3 CC(CO)OCCCl Amb27788349 [2,0,0,0,0,0|2,0,0]=4 1848 B7R0.3 CC(CO)OCCO Amb27594177 [2,0,0,0,0,0|2,0,0]=4 1849 B7R0.3 CC(CO)SCCO Amb27440688 [2,0,0,0,0,0|2,0,0]=4 1850 B7R0.3 CCC(C)CCCBr Amb18184302 [2,0,0,0,0,0|1,0,1]=4 1851 B7R0.3 CCC(C)CCCCl Amb25094579 [2,0,0,0,0,0|1,0,1]=4 1852 B7R0.3 CCC(C)CCCN Amb17569898 [2,0,0,0,0,0|1,0,1]=4 1853 B7R0.3 CCC(C)CCCO Amb28070020 [2,0,0,0,0,0|1,0,1]=4 1854 B7R0.3 CCC(C)CCCS Amb33318441 [2,0,0,0,0,0|1,0,1]=4 1855 B7R0.3 CCC(C)CCNC Amb18523839 [2,0,0,0,0,0|1,0,1]=4 1856 B7R0.3 CCC(O)CCCN Amb18202667 [2,0,0,0,0,0|1,0,1]=4 1857 B7R0.3 CCC(O)CCCN Amb19374975 [2,0,0,0,0,0|1,0,1]=4 1858 B7R0.3 CCC(O)CCCO Amb17593216 [2,0,0,0,0,0|1,0,1]=4 1859 B7R0.3 CCC(O)CCOC Amb22058972 [2,0,0,0,0,0|1,0,1]=4 1860 B7R0.3 CCCCC(=O)CBr Amb24563421 [2,0,0,0,0,0|1,0,1]=4 1861 B7R0.3 CCCCC(=O)CC Amb4605999 [2,0,0,0,0,0|1,0,1]=4 1862 B7R0.3 CCCCC(=O)CCl Amb17593420 [2,0,0,0,0,0|1,0,1]=4 1863 B7R0.3 CCCCC(=O)CN Amb24473062 [2,0,0,0,0,0|1,0,1]=4 1864 B7R0.3 CCCCC(=O)CO Amb26073501 [2,0,0,0,0,0|0,0,1]=3 1865 B7R0.3 CCCCC(=O)NO Amb6269796 [2,0,0,0,0,0|1,0,1]=4 1866 B7R0.3 CCCCC(Br)C=O Amb17594581 [2,0,0,0,0,0|1,0,0]=3 1867 B7R0.3 CCCCC(Br)CBr Amb8517633 [2,0,0,0,0,0|2,0,0]=4 1868 B7R0.3 CCCCC(Br)CC Amb18804679 [2,0,0,0,0,0|1,0,1]=4 1869 B7R0.3 CCCCC(Br)CF Amb28410717 [2,0,0,0,0,0|2,0,0]=4 1870 B7R0.3 CCCCC(C)C#N Amb18641663 [2,0,0,0,0,0|1,0,1]=4 1871 B7R0.3 CCCCC(C)C=O Amb17593191 [2,0,0,0,0,0|0,0,0]=2 1872 B7R0.3 CCCCC(C)CBr Amb22227886 [2,0,0,0,0,0|1,0,0]=3 1873 B7R0.3 CCCCC(C)CC Amb10071971 [2,0,0,0,0,0|0,0,1]=3 1874 B7R0.3 CCCCC(C)CCl Amb24481359 [2,0,0,0,0,0|1,0,0]=3 1875 B7R0.3 CCCCC(C)CN Amb18311071 [2,0,0,0,0,0|1,0,0]=3 1876 B7R0.3 CCCCC(C)CO Amb17593205 [2,0,0,0,0,0|0,0,0]=2 1877 B7R0.3 CCCCC(C)NC Amb9620956 [2,0,0,0,0,0|1,0,0]=3 1878 B7R0.3 CCCCC(C)ON Amb33428411 [2,0,0,0,0,0|2,0,0]=4 1879 B7R0.3 CCCCC(Cl)CBr Amb27490970 [2,0,0,0,0,0|2,0,0]=4 1880 B7R0.3 CCCCC(Cl)CC Amb25361621 [2,0,0,0,0,0|1,0,1]=4 1881 B7R0.3 CCCCC(Cl)CCl Amb9787250 [2,0,0,0,0,0|2,0,0]=4 1882 B7R0.3 CCCCC(Cl)CN Amb31030967 [2,0,0,0,0,0|2,0,0]=4 1883 B7R0.3 CCCCC(F)C=O Amb27838938 [2,0,0,0,0,0|1,0,0]=3 1884 B7R0.3 CCCCC(F)CBr Amb27758689 [2,0,0,0,0,0|2,0,0]=4 1885 B7R0.3 CCCCC(F)CN Amb24117055 [2,0,0,0,0,0|2,0,0]=4 1886 B7R0.3 CCCCC(N)C=O Amb28422291 [2,0,0,0,0,0|1,0,0]=3 1887 B7R0.3 CCCCC(N)CC Amb33527796 [2,0,0,0,0,0|1,0,1]=4 1888 B7R0.3 CCCCC(N)CC Amb9031866 [2,0,0,0,0,0|1,0,1]=4 1889 B7R0.3 CCCCC(N)CN Amb19009750 [2,0,0,0,0,0|2,0,0]=4 1890 B7R0.3 CCCCC(N)CO Amb3939373 [2,0,0,0,0,0|1,0,0]=3 1891 B7R0.3 CCCCC(N)CS Amb27961155 [2,0,0,0,0,0|1,1,0]=4 1892 B7R0.3 CCCCC(O)CBr Amb25233429 [2,0,0,0,0,0|1,0,1]=4 1893 B7R0.3 CCCCC(O)CC Amb10844720 [2,0,0,0,0,0|0,0,1]=3 1894 B7R0.3 CCCCC(O)CCl Amb24481415 [2,0,0,0,0,0|1,0,1]=4 1895 B7R0.3 CCCCC(O)CF Amb27807497 [2,0,0,0,0,0|1,0,1]=4 1896 B7R0.3 CCCCC(O)CN Amb8630130 [2,0,0,0,0,0|1,0,1]=4 1897 B7R0.3 CCCCC(O)CO Amb8390318 [2,0,0,0,0,0|0,0,1]=3 1898 B7R0.3 CCCCC(S)CC Amb25314909 [2,0,0,0,0,0|0,1,1]=4 1899 B7R0.3 CCCCC(S)CN Amb27643759 [2,0,0,0,0,0|1,1,0]=4 1900 B7R0.3 CCCCN(C)C=O Amb26967032 [2,0,0,0,0,0|1,0,0]=3 1901 B7R0.3 CCCCN(C)N=O Amb22231185 [2,0,0,0,0,0|2,0,0]=4 1902 B7R0.3 CCCCN(O)CC Amb27230146 [2,0,0,0,0,0|1,0,1]=4 1903 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [2,0,0,0,0,0|1,0,0]=3 1904 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [2,0,0,0,0,0|1,0,0]=3 1905 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [2,0,0,0,0,0|0,0,0]=2 1906 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [2,0,0,0,0,0|1,0,0]=3 1907 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [2,0,0,0,0,0|1,0,1]=4 1908 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [2,0,0,0,0,0|1,0,0]=3 1909 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [2,0,0,0,0,0|1,0,1]=4 1910 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [2,0,0,0,0,0|1,0,1]=4 1911 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [2,0,0,0,0,0|0,0,0]=2 1912 B7R0.3 CCCC[C@H](C)CN Amb25889982 [2,0,0,0,0,0|1,0,0]=3 1913 B7R0.3 CCCC[C@H](C)CO Amb26370424 [2,0,0,0,0,0|0,0,0]=2 1914 B7R0.3 CCCC[C@H](F)CO Amb28315208 [2,0,0,0,0,0|1,0,0]=3 1915 B7R0.3 CCCC[C@H](N)CO Amb3941478 [2,0,0,0,0,0|1,0,0]=3 1916 B7R0.3 CCCC[C@H](O)CF Amb27656199 [2,0,0,0,0,0|1,0,1]=4 1917 B7R0.3 CCCC[C@H](O)CN Amb33428416 [2,0,0,0,0,0|1,0,1]=4 1918 B7R0.3 CCCC[C@H](S)CO Amb27804425 [2,0,0,0,0,0|0,1,0]=3 1919 B7R0.3 CCCNC(=O)CO Amb5798169 [2,0,0,0,0,0|1,0,1]=4 1920 B7R0.3 CCCNC(C)CC Amb3939844 [2,0,0,0,0,0|1,0,1]=4 1921 B7R0.3 CCCNC(C)CO Amb9359690 [2,0,0,0,0,0|1,0,0]=3 1922 B7R0.3 CCCOC(=O)CO Amb25964379 [2,0,0,0,0,0|1,0,1]=4 1923 B7R0.3 CCCOC(C)CC Amb27250865 [2,0,0,0,0,0|1,0,1]=4 1924 B7R0.3 CCCOC(C)CN Amb10608199 [2,0,0,0,0,0|2,0,0]=4 1925 B7R0.3 CCCOC(C)CN Amb21956046 [2,0,0,0,0,0|2,0,0]=4 1926 B7R0.3 CCCOC(C)CO Amb26370350 [2,0,0,0,0,0|1,0,0]=3 1927 B7R0.3 CCCSC(C)C=O Amb18124367 [2,0,0,0,0,0|1,0,0]=3 1928 B7R0.3 CCCSC(C)CC Amb4017932 [2,0,0,0,0,0|1,0,1]=4 1929 B7R0.3 CCCSC(C)CCl Amb27817405 [2,0,0,0,0,0|2,0,0]=4 1930 B7R0.3 CCCSC(C)CN Amb17485962 [2,0,0,0,0,0|2,0,0]=4 1931 B7R0.3 CCCSC(C)CO Amb27593226 [2,0,0,0,0,0|1,0,0]=3 1932 B7R0.3 CCNCC(C)CC Amb20623802 [2,0,0,0,0,0|1,0,1]=4 1933 B7R0.3 CCNCC(C)CC Amb6719189 [2,0,0,0,0,0|1,0,1]=4 1934 B7R0.3 CCNCC(C)CCl Amb28254657 [2,0,0,0,0,0|2,0,0]=4 1935 B7R0.3 CCNCC(C)CN Amb18314895 [2,0,0,0,0,0|2,0,0]=4 1936 B7R0.3 CCNCC(C)OC Amb19025030 [2,0,0,0,0,0|2,0,0]=4 1937 B7R0.3 CCNCC(C)SC Amb19025520 [2,0,0,0,0,0|2,0,0]=4 1938 B7R0.3 CCNCC(O)CC Amb9870468 [2,0,0,0,0,0|1,0,1]=4 1939 B7R0.3 CCNCC(O)CO Amb8856483 [2,0,0,0,0,0|1,0,1]=4 1940 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [2,0,0,0,0,0|1,0,1]=4 1941 B7R0.3 CCNC[C@H](C)NC Amb28049316 [2,0,0,0,0,0|2,0,0]=4 1942 B7R0.3 CCNC[C@H](O)CC Amb26984963 [2,0,0,0,0,0|1,0,1]=4 1943 B7R0.3 CCNC[C@H](O)CO Amb27830790 [2,0,0,0,0,0|1,0,1]=4 1944 B7R0.3 CCOCC(=O)CO Amb28066809 [2,0,0,0,0,0|1,0,1]=4 1945 B7R0.3 CCOCC(Br)CO Amb27791752 [2,0,0,0,0,0|2,0,0]=4 1946 B7R0.3 CCOCC(C)CBr Amb26847509 [2,0,0,0,0,0|2,0,0]=4 1947 B7R0.3 CCOCC(C)CCl Amb26887689 [2,0,0,0,0,0|2,0,0]=4 1948 B7R0.3 CCOCC(C)CN Amb8868817 [2,0,0,0,0,0|2,0,0]=4 1949 B7R0.3 CCOCC(C)CO Amb25823989 [2,0,0,0,0,0|1,0,0]=3 1950 B7R0.3 CCOCC(Cl)CO Amb27974227 [2,0,0,0,0,0|2,0,0]=4 1951 B7R0.3 CCOCC(N)CO Amb25890491 [2,0,0,0,0,0|2,0,0]=4 1952 B7R0.3 CCOCC(N)CO Amb32666301 [2,0,0,0,0,0|2,0,0]=4 1953 B7R0.3 CCOCC(O)C=O Amb27883256 [2,0,0,0,0,0|1,0,0]=3 1954 B7R0.3 CCOCC(O)CO Amb19148881 [2,0,0,0,0,0|1,0,1]=4 1955 B7R0.3 CCOC[C@@H](C)CN Amb33748152 [2,0,0,0,0,0|2,0,0]=4 1956 B7R0.3 CCOC[C@@H](C)CO Amb33735552 [2,0,0,0,0,0|1,0,0]=3 1957 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [2,0,0,0,0,0|2,0,0]=4 1958 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [2,0,0,0,0,0|2,0,0]=4 1959 B7R0.3 CCOC[C@H](C)CN Amb33747417 [2,0,0,0,0,0|2,0,0]=4 1960 B7R0.3 CCOC[C@H](C)CO Amb25999202 [2,0,0,0,0,0|1,0,0]=3 1961 B7R0.3 CCSCC(C)C=O Amb27592961 [2,0,0,0,0,0|1,0,0]=3 1962 B7R0.3 CCSCC(C)CBr Amb26852087 [2,0,0,0,0,0|2,0,0]=4 1963 B7R0.3 CCSCC(C)CC Amb27395876 [2,0,0,0,0,0|1,0,1]=4 1964 B7R0.3 CCSCC(C)CCl Amb27469104 [2,0,0,0,0,0|2,0,0]=4 1965 B7R0.3 CCSCC(C)CN Amb9391465 [2,0,0,0,0,0|2,0,0]=4 1966 B7R0.3 CCSCC(C)NC Amb19149257 [2,0,0,0,0,0|2,0,0]=4 1967 B7R0.3 CCSCC(N)CO Amb18643038 [2,0,0,0,0,0|2,0,0]=4 1968 B7R0.3 CCSCC(O)CC Amb27827536 [2,0,0,0,0,0|1,0,1]=4 1969 B7R0.3 CCSCC(O)CO Amb4019001 [2,0,0,0,0,0|1,0,1]=4 1970 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [2,0,0,0,0,0|2,0,0]=4 1971 B7R0.3 CCSC[C@H](N)CO Amb26564857 [2,0,0,0,0,0|2,0,0]=4 1972 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [2,0,0,0,0,0|1,0,1]=4 1973 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [2,0,0,0,0,0|1,0,1]=4 1974 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [2,0,0,0,0,0|1,0,1]=4 1975 B7R0.3 CC[C@H](C)CCCO Amb22226203 [2,0,0,0,0,0|1,0,1]=4 1976 B7R0.3 CC\C=C\C(C)C=O Amb33474380 [2,0,0,0,0,0|0,0,2]=4 1977 B7R0.3 CC\C=C\[C@@H](C)CO Amb28366044 [2,0,0,0,0,0|0,0,2]=4 1978 B7R0.3 CN(C=O)CCCCl Amb24589375 [2,0,0,0,0,0|2,0,0]=4 1979 B7R0.3 CN(C=O)CCCO Amb17593211 [2,0,0,0,0,0|2,0,0]=4 1980 B7R0.3 CNC(C)CCCO Amb17569902 [2,0,0,0,0,0|2,0,0]=4 1981 B7R0.3 CNC(C)CCOC Amb17569918 [2,0,0,0,0,0|2,0,0]=4 1982 B7R0.3 CNC(C)CCSC Amb19515468 [2,0,0,0,0,0|2,0,0]=4 1983 B7R0.3 CNCCC(C)CN Amb17334066 [2,0,0,0,0,0|2,0,0]=4 1984 B7R0.3 CNCCC(C)CO Amb17569900 [2,0,0,0,0,0|1,0,0]=3 1985 B7R0.3 CNCCC(C)OC Amb17569916 [2,0,0,0,0,0|2,0,0]=4 1986 B7R0.3 COC(C)CCCBr Amb27198618 [2,0,0,0,0,0|2,0,0]=4 1987 B7R0.3 COC(C)CCCCl Amb28397922 [2,0,0,0,0,0|2,0,0]=4 1988 B7R0.3 COC(C)CCCN Amb17569913 [2,0,0,0,0,0|2,0,0]=4 1989 B7R0.3 COCCC(C)C=O Amb26896518 [2,0,0,0,0,0|1,0,0]=3 1990 B7R0.3 COCCC(C)CBr Amb27210700 [2,0,0,0,0,0|2,0,0]=4 1991 B7R0.3 COCCC(C)CCl Amb26887699 [2,0,0,0,0,0|2,0,0]=4 1992 B7R0.3 COCCC(C)CN Amb17569915 [2,0,0,0,0,0|2,0,0]=4 1993 B7R0.3 COCCC(C)SC Amb27838053 [2,0,0,0,0,0|2,0,0]=4 1994 B7R0.3 COCCC(N)C=O Amb28397866 [2,0,0,0,0,0|2,0,0]=4 1995 B7R0.3 COCCC(N)CO Amb32952892 [2,0,0,0,0,0|2,0,0]=4 1996 B7R0.3 COCCC(N)CO Amb33532817 [2,0,0,0,0,0|2,0,0]=4 1997 B7R0.3 COCCC(O)CO Amb28128880 [2,0,0,0,0,0|1,0,1]=4 1998 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [2,0,0,0,0,0|1,0,0]=3 1999 B7R0.3 COCC[C@@H](N)CO Amb33377807 [2,0,0,0,0,0|2,0,0]=4 2000 B7R0.3 COCC[C@H](N)CO Amb25937729 [2,0,0,0,0,0|2,0,0]=4 2001 B7R0.3 COCO[C@@H](C)C=O Amb28422010 [2,0,0,0,0,0|2,0,0]=4 2002 B7R0.3 COCO[C@@H](C)CO Amb22169783 [2,0,0,0,0,0|2,0,0]=4 2003 B7R0.3 COCO[C@H](C)CO Amb8386157 [2,0,0,0,0,0|2,0,0]=4 2004 B7R0.3 COCSC(C)CO Amb28284985 [2,0,0,0,0,0|2,0,0]=4 2005 B7R0.3 CSCCC(C)C=O Amb26624792 [2,0,0,0,0,0|1,0,0]=3 2006 B7R0.3 CSCCC(C)CBr Amb26508349 [2,0,0,0,0,0|2,0,0]=4 2007 B7R0.3 CSCCC(C)CCl Amb27870601 [2,0,0,0,0,0|2,0,0]=4 2008 B7R0.3 CSCCC(C)CN Amb28291178 [2,0,0,0,0,0|2,0,0]=4 2009 B7R0.3 CSCCC(N)CO Amb4036829 [2,0,0,0,0,0|2,0,0]=4 2010 B7R0.3 CSCCC(O)CO Amb26019209 [2,0,0,0,0,0|1,0,1]=4 2011 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [2,0,0,0,0,0|2,0,0]=4 2012 B7R0.3 CSCC[C@H](N)CO Amb2720562 [2,0,0,0,0,0|2,0,0]=4 2013 B7R0.3 CSSCC(C)CO Amb27166642 [2,0,0,0,0,0|2,0,0]=4 2014 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [2,0,0,0,0,0|2,0,0]=4 2015 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [2,0,0,0,0,0|1,0,0]=3 2016 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [2,0,0,0,0,0|1,0,0]=3 2017 B7R0.3 C[C@@H](CO)NCCO Amb27881216 [2,0,0,0,0,0|2,0,0]=4 2018 B7R0.3 C[C@@H](CO)OCCO Amb28461084 [2,0,0,0,0,0|2,0,0]=4 2019 B7R0.3 C[C@H](CO)NCCO Amb27173258 [2,0,0,0,0,0|2,0,0]=4 2020 B7R0.3 C\C=C(/C)CCCC Amb22229367 [2,0,0,0,0,0|0,0,1]=3 2021 B7R0.3 C\C=C(/C)NCCC Amb27881221 [2,0,0,0,0,0|1,0,1]=4 2022 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [2,0,0,0,0,0|1,0,1]=4 2023 B7R0.3 C\C=C(\C)CCCN Amb27412873 [2,0,0,0,0,0|1,0,1]=4 2024 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [2,0,0,0,0,0|0,0,2]=4 2025 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [2,0,0,0,0,0|0,0,2]=4 2026 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [2,0,0,0,0,0|0,0,2]=4 2027 B7R0.3 NC(CO)CCCF Amb28069002 [2,0,0,0,0,0|2,0,0]=4 2028 B7R0.3 NC(CO)CCCO Amb18641979 [2,0,0,0,0,0|2,0,0]=4 2029 B7R0.3 NCCCC(N)CO Amb27665423 [2,0,0,0,0,0|2,0,0]=4 2030 B7R0.3 NCCCC(O)CO Amb27759884 [2,0,0,0,0,0|1,0,1]=4 2031 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [2,0,0,0,0,0|2,0,0]=4 2032 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [2,0,0,0,0,0|2,0,0]=4 2033 B7R0.3 N[C@H](CO)CCCO Amb24117047 [2,0,0,0,0,0|2,0,0]=4 2034 B7R0.3 O=C(CO)CCCO Amb27227084 [2,0,0,0,0,0|1,0,1]=4 2035 B7R0.3 O=CC(Cl)CCCO Amb27831369 [2,0,0,0,0,0|2,0,0]=4 2036 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [2,0,0,0,0,0|1,0,0]=3 2037 B7R0.3 OCC(O)CCCCl Amb17593523 [2,0,0,0,0,0|1,0,1]=4 2038 B7R0.3 OCCCC(O)CO Amb17593225 [2,0,0,0,0,0|1,0,1]=4 2039 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [2,0,0,0,0,0|1,0,1]=4 2040 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [2,0,0,0,0,0|2,0,0]=4 2041 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [2,0,0,0,0,0|1,0,1]=4 2042 B7R0.3 [C-]#[N+]C(C)CCCC Amb3973080 [2,0,0,0,0,0|1,0,1]=4 2043 B7R0.4 C#CCCCC(C)=O Amb18115312 [2,0,0,0,0,0|0,0,2]=4 2044 B7R0.4 C=C(C)CCCCC Amb6298938 [2,0,0,0,0,0|1,0,0]=3 2045 B7R0.4 C=C(C)CCCCO Amb26872404 [2,0,0,0,0,0|2,0,0]=4 2046 B7R0.4 C=C(C)CNCCC Amb17308631 [2,0,0,0,0,0|2,0,0]=4 2047 B7R0.4 C=C(C)CSCCC Amb27449649 [2,0,0,0,0,0|2,0,0]=4 2048 B7R0.4 C=CCCCC(C)=O Amb17593171 [2,0,0,0,0,0|0,0,2]=4 2049 B7R0.4 CC(=O)CCCC#N Amb17106756 [2,0,0,0,0,0|1,0,1]=4 2050 B7R0.4 CC(=O)CCCCBr Amb16234126 [2,0,0,0,0,0|1,0,0]=3 2051 B7R0.4 CC(=O)CCCCCl Amb3941549 [2,0,0,0,0,0|1,0,0]=3 2052 B7R0.4 CC(=O)CCCCF Amb27490855 [2,0,0,0,0,0|1,0,0]=3 2053 B7R0.4 CC(=O)CCCCN Amb27401218 [2,0,0,0,0,0|1,0,0]=3 2054 B7R0.4 CC(=O)CCCCO Amb10603864 [2,0,0,0,0,0|1,0,0]=3 2055 B7R0.4 CC(=O)COCCCl Amb25346574 [2,0,0,0,0,0|2,0,0]=4 2056 B7R0.4 CC(=O)COCCF Amb27463527 [2,0,0,0,0,0|2,0,0]=4 2057 B7R0.4 CC(=O)COCCO Amb28122841 [2,0,0,0,0,0|2,0,0]=4 2058 B7R0.4 CC(=O)CSCCF Amb24621173 [2,0,0,0,0,0|2,0,0]=4 2059 B7R0.4 CC(=O)CSCCN Amb17500454 [2,0,0,0,0,0|2,0,0]=4 2060 B7R0.4 CC(=O)CSCCO Amb4165952 [2,0,0,0,0,0|2,0,0]=4 2061 B7R0.4 CC(=O)NCCCBr Amb8826231 [2,0,0,0,0,0|2,0,0]=4 2062 B7R0.4 CC(=O)NCCCCl Amb3886559 [2,0,0,0,0,0|2,0,0]=4 2063 B7R0.4 CC(=O)NCCCN Amb10610286 [2,0,0,0,0,0|2,0,0]=4 2064 B7R0.4 CC(=O)NCCCN Amb6664982 [2,0,0,0,0,0|2,0,0]=4 2065 B7R0.4 CC(=O)NCCCO Amb3429354 [2,0,0,0,0,0|2,0,0]=4 2066 B7R0.4 CC(=O)OCCCBr Amb26515737 [2,0,0,0,0,0|2,0,0]=4 2067 B7R0.4 CC(=O)OCCCCl Amb3940269 [2,0,0,0,0,0|2,0,0]=4 2068 B7R0.4 CC(=O)OCCCO Amb25854267 [2,0,0,0,0,0|2,0,0]=4 2069 B7R0.4 CC(=O)OCCCS Amb4018773 [2,0,0,0,0,0|2,0,0]=4 2070 B7R0.4 CC(=O)SCCCBr Amb17610077 [2,0,0,0,0,0|2,0,0]=4 2071 B7R0.4 CC(=O)SCCCCl Amb3940270 [2,0,0,0,0,0|2,0,0]=4 2072 B7R0.4 CCC#CCC(C)=O Amb28040888 [2,0,0,0,0,0|0,0,2]=4 2073 B7R0.4 CCCC#CC(C)=O Amb26844271 [2,0,0,0,0,0|0,0,2]=4 2074 B7R0.4 CCCCC=C(C)C Amb22228888 [2,0,0,0,0,0|1,0,1]=4 2075 B7R0.4 CCCCCC(=N)N Amb19890171 [2,0,0,0,0,0|2,0,0]=4 2076 B7R0.4 CCCCCC(=N)N Amb2696574 [2,0,0,0,0,0|2,0,0]=4 2077 B7R0.4 CCCCCC(=N)N Amb35747068 [2,0,0,0,0,0|2,0,0]=4 2078 B7R0.4 CCCCCC(=O)F Amb26061517 [2,0,0,0,0,0|1,0,0]=3 2079 B7R0.4 CCCCCC(=O)O Amb3939846 [2,0,0,0,0,0|1,0,0]=3 2080 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [2,0,0,0,0,0|1,0,0]=3 2081 B7R0.4 CCCCCC(C)=O Amb6608885 [2,0,0,0,0,0|0,0,0]=2 2082 B7R0.4 CCCCCC(C)Br Amb3940202 [2,0,0,0,0,0|1,0,1]=4 2083 B7R0.4 CCCCCC(C)C Amb8513253 [2,0,0,0,0,0|1,0,1]=4 2084 B7R0.4 CCCCCC(C)Cl Amb22228752 [2,0,0,0,0,0|1,0,1]=4 2085 B7R0.4 CCCCCC(C)N Amb21962698 [2,0,0,0,0,0|1,0,1]=4 2086 B7R0.4 CCCCCC(C)N Amb3939364 [2,0,0,0,0,0|1,0,1]=4 2087 B7R0.4 CCCCCC(C)O Amb8383668 [2,0,0,0,0,0|0,0,2]=4 2088 B7R0.4 CCCCCC(C)S Amb17939452 [2,0,0,0,0,0|0,1,1]=4 2089 B7R0.4 CCCCCC(N)=S Amb6246072 [2,0,0,0,0,0|1,1,0]=4 2090 B7R0.4 CCCCCN(C)O Amb33428427 [2,0,0,0,0,0|1,0,1]=4 2091 B7R0.4 CCCCCS(=O)Cl Amb32720370 [2,0,0,0,0,0|2,0,0]=4 2092 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [2,0,0,0,0,0|2,0,0]=4 2093 B7R0.4 CCCCCS(C)=O Amb27457494 [2,0,0,0,0,0|1,0,0]=3 2094 B7R0.4 CCCCCS(N)=O Amb32720371 [2,0,0,0,0,0|2,0,0]=4 2095 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [2,0,0,0,0,0|1,0,1]=4 2096 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [2,0,0,0,0,0|0,0,2]=4 2097 B7R0.4 CCCCC[C@H](C)N Amb8516349 [2,0,0,0,0,0|1,0,1]=4 2098 B7R0.4 CCCCC[C@H](C)O Amb8395591 [2,0,0,0,0,0|0,0,2]=4 2099 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [2,0,0,0,0,0|2,0,0]=4 2100 B7R0.4 CCCCNC(=O)Cl Amb24574309 [2,0,0,0,0,0|2,0,0]=4 2101 B7R0.4 CCCCNC(C)=N Amb27663050 [2,0,0,0,0,0|2,0,0]=4 2102 B7R0.4 CCCCNC(C)=O Amb5835711 [2,0,0,0,0,0|1,0,0]=3 2103 B7R0.4 CCCCNC(N)=O Amb6663202 [2,0,0,0,0,0|2,0,0]=4 2104 B7R0.4 CCCCOC(=O)Cl Amb6608833 [2,0,0,0,0,0|2,0,0]=4 2105 B7R0.4 CCCCOC(C)=O Amb6608782 [2,0,0,0,0,0|1,0,0]=3 2106 B7R0.4 CCCCOC(N)=O Amb4136361 [2,0,0,0,0,0|2,0,0]=4 2107 B7R0.4 CCCCSC(=O)Cl Amb22352826 [2,0,0,0,0,0|2,0,0]=4 2108 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|2,0,0]=4 2109 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|2,0,0]=4 2110 B7R0.4 CCCNCC(C)=O Amb26954588 [2,0,0,0,0,0|1,0,0]=3 2111 B7R0.4 CCCNCC(N)=O Amb1124632 [2,0,0,0,0,0|2,0,0]=4 2112 B7R0.4 CCCNCC(N)=O Amb28934788 [2,0,0,0,0,0|2,0,0]=4 2113 B7R0.4 CCCOCC(=O)Cl Amb27260778 [2,0,0,0,0,0|2,0,0]=4 2114 B7R0.4 CCCOCC(=O)O Amb8874504 [2,0,0,0,0,0|2,0,0]=4 2115 B7R0.4 CCCOCC(N)=O Amb27844884 [2,0,0,0,0,0|2,0,0]=4 2116 B7R0.4 CCCONC(C)=O Amb27764366 [2,0,0,0,0,0|2,0,0]=4 2117 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|2,0,0]=4 2118 B7R0.4 CCCSCC(C)=O Amb9668676 [2,0,0,0,0,0|1,0,0]=3 2119 B7R0.4 CCCSCC(N)=O Amb27424658 [2,0,0,0,0,0|2,0,0]=4 2120 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [2,0,0,0,0,0|0,0,2]=4 2121 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [2,0,0,0,0,0|0,0,2]=4 2122 B7R0.4 CCNCCC(=O)O Amb28934794 [2,0,0,0,0,0|2,0,0]=4 2123 B7R0.4 CCNCCC(=O)O Amb7766402 [2,0,0,0,0,0|2,0,0]=4 2124 B7R0.4 CCNCCC(C)=O Amb18641851 [2,0,0,0,0,0|1,0,0]=3 2125 B7R0.4 CCNCCC(N)=O Amb33533384 [2,0,0,0,0,0|2,0,0]=4 2126 B7R0.4 CCNCCC(N)=O Amb35749820 [2,0,0,0,0,0|2,0,0]=4 2127 B7R0.4 CCOCCC(=O)Cl Amb20672027 [2,0,0,0,0,0|2,0,0]=4 2128 B7R0.4 CCOCCC(=O)O Amb3939859 [2,0,0,0,0,0|2,0,0]=4 2129 B7R0.4 CCOCCC(C)=O Amb7764636 [2,0,0,0,0,0|1,0,0]=3 2130 B7R0.4 CCSCCC(=O)O Amb6273140 [2,0,0,0,0,0|2,0,0]=4 2131 B7R0.4 CCSCCC(C)=O Amb9655821 [2,0,0,0,0,0|1,0,0]=3 2132 B7R0.4 CCSCCC(N)=O Amb27258252 [2,0,0,0,0,0|2,0,0]=4 2133 B7R0.4 CCSSCC(C)=O Amb28316151 [2,0,0,0,0,0|2,0,0]=4 2134 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [2,0,0,0,0,0|0,0,2]=4 2135 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [2,0,0,0,0,0|0,0,2]=4 2136 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|2,0,0]=4 2137 B7R0.4 CNCCCC(=O)O Amb4521435 [2,0,0,0,0,0|2,0,0]=4 2138 B7R0.4 CNCCCC(C)=O Amb27838406 [2,0,0,0,0,0|1,0,0]=3 2139 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 2140 B7R0.4 CNCCCC(N)=O Amb31307731 [2,0,0,0,0,0|2,0,0]=4 2141 B7R0.4 CNCCCS(C)=O Amb27827686 [2,0,0,0,0,0|2,0,0]=4 2142 B7R0.4 CNCCNC(C)=O Amb28934797 [2,0,0,0,0,0|2,0,0]=4 2143 B7R0.4 CNCCNC(C)=O Amb9256137 [2,0,0,0,0,0|2,0,0]=4 2144 B7R0.4 CNCCOC(C)=O Amb18124262 [2,0,0,0,0,0|2,0,0]=4 2145 B7R0.4 CNCCOC(C)=O Amb33621071 [2,0,0,0,0,0|2,0,0]=4 2146 B7R0.4 COCCCC(=O)O Amb6275629 [2,0,0,0,0,0|2,0,0]=4 2147 B7R0.4 COCCCC(C)=O Amb9031556 [2,0,0,0,0,0|1,0,0]=3 2148 B7R0.4 COCCNC(C)=O Amb3358082 [2,0,0,0,0,0|2,0,0]=4 2149 B7R0.4 COCCOC(C)=O Amb4037074 [2,0,0,0,0,0|2,0,0]=4 2150 B7R0.4 CS(=O)CCCCBr Amb27874454 [2,0,0,0,0,0|2,0,0]=4 2151 B7R0.4 CS(=O)CCCCCl Amb27253421 [2,0,0,0,0,0|2,0,0]=4 2152 B7R0.4 CS(=O)CCCCN Amb17617794 [2,0,0,0,0,0|2,0,0]=4 2153 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|2,0,0]=4 2154 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|1,0,0]=3 2155 B7R0.4 CSCCNC(C)=O Amb8504699 [2,0,0,0,0,0|2,0,0]=4 2156 B7R0.4 CSCCSC(C)=O Amb27635033 [2,0,0,0,0,0|2,0,0]=4 2157 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [2,0,0,0,0,0|0,0,2]=4 2158 B7R0.4 NC(=O)CCCCBr Amb27875083 [2,0,0,0,0,0|2,0,0]=4 2159 B7R0.4 NC(=O)CCCCCl Amb7782532 [2,0,0,0,0,0|2,0,0]=4 2160 B7R0.4 NC(=O)CCCCO Amb3939470 [2,0,0,0,0,0|2,0,0]=4 2161 B7R0.4 NC(=O)CCCCS Amb27839239 [2,0,0,0,0,0|2,0,0]=4 2162 B7R0.4 NCCCCC(=O)Cl Amb26599615 [2,0,0,0,0,0|2,0,0]=4 2163 B7R0.4 NCCCCC(=O)O Amb2780021 [2,0,0,0,0,0|2,0,0]=4 2164 B7R0.4 NCCCCC(=O)O Amb3941646 [2,0,0,0,0,0|2,0,0]=4 2165 B7R0.4 NCCCCC(=O)O Amb9825855 [2,0,0,0,0,0|2,0,0]=4 2166 B7R0.4 NCCCCC(N)=O Amb18641897 [2,0,0,0,0,0|2,0,0]=4 2167 B7R0.4 NCCCCC(N)=O Amb33552086 [2,0,0,0,0,0|2,0,0]=4 2168 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [2,0,0,0,0,0|2,0,0]=4 2169 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [2,0,0,0,0,0|2,0,0]=4 2170 B7R0.4 O=C(O)CCCCBr Amb6608763 [2,0,0,0,0,0|2,0,0]=4 2171 B7R0.4 O=C(O)CCCCCl Amb3940369 [2,0,0,0,0,0|2,0,0]=4 2172 B7R0.4 O=C(O)CCCCF Amb26639920 [2,0,0,0,0,0|2,0,0]=4 2173 B7R0.4 O=C(O)CCCCO Amb9214971 [2,0,0,0,0,0|2,0,0]=4 2174 B7R0.4 O=C(O)CCCCS Amb17503767 [2,0,0,0,0,0|2,0,0]=4 2175 B7R0.4 O=C([O-])CCCCF Amb33527827 [2,0,0,0,0,0|2,0,0]=4 2176 B7R0.4 O=C([O-])CCCCO Amb13952763 [2,0,0,0,0,0|2,0,0]=4 2177 B7R0.4 O=C([O-])CCCCO Amb22749314 [2,0,0,0,0,0|2,0,0]=4 2178 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [2,0,0,0,0,0|0,0,2]=4 2179 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [2,0,0,0,0,0|0,0,2]=4 2180 B7R0.5 C=C(C)C(C)CCN Amb33199933 [2,0,0,0,0,0|2,0,0]=4 2181 B7R0.5 C=C(C)C(C)CCO Amb27766618 [2,0,0,0,0,0|2,0,0]=4 2182 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [2,0,0,0,0,0|2,0,0]=4 2183 B7R0.5 C=C(C)C(O)CCN Amb25929797 [2,0,0,0,0,0|2,0,0]=4 2184 B7R0.5 C=C(C)C(O)CNC Amb24716760 [2,0,0,0,0,0|2,0,0]=4 2185 B7R0.5 C=C(C)C(O)COC Amb27662970 [2,0,0,0,0,0|2,0,0]=4 2186 B7R0.5 C=C(C)C(O)CSC Amb27795952 [2,0,0,0,0,0|2,0,0]=4 2187 B7R0.5 C=C(C)[C@@H](O)CCN Amb33199602 [2,0,0,0,0,0|2,0,0]=4 2188 B7R0.5 C=C(C)[C@H](O)CCN Amb33199603 [2,0,0,0,0,0|2,0,0]=4 2189 B7R0.5 C=C(F)C(O)CCC Amb27833609 [2,0,0,0,0,0|1,0,1]=4 2190 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [2,0,0,0,0,0|0,0,2]=4 2191 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [2,0,0,0,0,0|0,0,2]=4 2192 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [2,0,0,0,0,0|0,0,2]=4 2193 B7R0.5 CC#CC(O)C(C)=O Amb25950589 [2,0,0,0,0,0|0,0,2]=4 2194 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [2,0,0,0,0,0|2,0,0]=4 2195 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [2,0,0,0,0,0|2,0,0]=4 2196 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [2,0,0,0,0,0|1,0,1]=4 2197 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [2,0,0,0,0,0|1,0,0]=3 2198 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [2,0,0,0,0,0|1,0,0]=3 2199 B7R0.5 CC(=O)C(C)CCO Amb13881368 [2,0,0,0,0,0|1,0,0]=3 2200 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [2,0,0,0,0,0|2,0,0]=4 2201 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [2,0,0,0,0,0|2,0,0]=4 2202 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [2,0,0,0,0,0|2,0,0]=4 2203 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [2,0,0,0,0,0|2,0,0]=4 2204 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [2,0,0,0,0,0|2,0,0]=4 2205 B7R0.5 CC(=O)C(N)CCO Amb25087112 [2,0,0,0,0,0|2,0,0]=4 2206 B7R0.5 CC(=O)C(S)CCO Amb25831127 [2,0,0,0,0,0|1,1,0]=4 2207 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [2,0,0,0,0,0|2,0,0]=4 2208 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [2,0,0,0,0,0|2,0,0]=4 2209 B7R0.5 CC(=O)N(C)CCN Amb17046786 [2,0,0,0,0,0|2,0,0]=4 2210 B7R0.5 CC(=O)N(C)CCN Amb34137491 [2,0,0,0,0,0|2,0,0]=4 2211 B7R0.5 CC(=O)N(C)CCO Amb5797447 [2,0,0,0,0,0|2,0,0]=4 2212 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [2,0,0,0,0,0|1,0,1]=4 2213 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [2,0,0,0,0,0|2,0,0]=4 2214 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [2,0,0,0,0,0|1,0,1]=4 2215 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [2,0,0,0,0,0|2,0,0]=4 2216 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [2,0,0,0,0,0|2,0,0]=4 2217 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [2,0,0,0,0,0|2,0,0]=4 2218 B7R0.5 CC(CCF)C(=O)O Amb24678386 [2,0,0,0,0,0|2,0,0]=4 2219 B7R0.5 CC(CCN)C(=O)O Amb20667970 [2,0,0,0,0,0|2,0,0]=4 2220 B7R0.5 CC(CCN)C(=O)O Amb538221 [2,0,0,0,0,0|2,0,0]=4 2221 B7R0.5 CC(CCN)S(C)=O Amb20668090 [2,0,0,0,0,0|2,0,0]=4 2222 B7R0.5 CC(CCO)C(=O)O Amb18641949 [2,0,0,0,0,0|2,0,0]=4 2223 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [2,0,0,0,0,0|2,0,0]=4 2224 B7R0.5 CC(CCO)C(N)=O Amb28280962 [2,0,0,0,0,0|2,0,0]=4 2225 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [2,0,0,0,0,0|0,0,2]=4 2226 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [2,0,0,0,0,0|2,0,0]=4 2227 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [2,0,0,0,0,0|2,0,0]=4 2228 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [2,0,0,0,0,0|1,0,0]=3 2229 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [2,0,0,0,0,0|2,0,0]=4 2230 B7R0.5 CCCC(C)=C(C)C Amb4019545 [2,0,0,0,0,0|1,0,1]=4 2231 B7R0.5 CCCC(C)C(=N)N Amb27810844 [2,0,0,0,0,0|2,0,0]=4 2232 B7R0.5 CCCC(C)C(=N)N Amb33212650 [2,0,0,0,0,0|2,0,0]=4 2233 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [2,0,0,0,0,0|1,0,0]=3 2234 B7R0.5 CCCC(C)C(=O)O Amb3938958 [2,0,0,0,0,0|1,0,0]=3 2235 B7R0.5 CCCC(C)C(C)=O Amb4034597 [2,0,0,0,0,0|0,0,0]=2 2236 B7R0.5 CCCC(C)C(C)C Amb4019539 [2,0,0,0,0,0|1,0,1]=4 2237 B7R0.5 CCCC(C)C(C)N Amb18289572 [2,0,0,0,0,0|1,0,1]=4 2238 B7R0.5 CCCC(C)C(C)N Amb29083224 [2,0,0,0,0,0|1,0,1]=4 2239 B7R0.5 CCCC(C)C(C)O Amb4036337 [2,0,0,0,0,0|0,0,2]=4 2240 B7R0.5 CCCC(C)C(N)=O Amb3886535 [2,0,0,0,0,0|1,0,0]=3 2241 B7R0.5 CCCC(C)C(N)=S Amb25138492 [2,0,0,0,0,0|1,1,0]=4 2242 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [2,0,0,0,0,0|2,0,0]=4 2243 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [2,0,0,0,0,0|2,0,0]=4 2244 B7R0.5 CCCC(C)S(N)=O Amb32720511 [2,0,0,0,0,0|2,0,0]=4 2245 B7R0.5 CCCC(C)[C@@H](C)N Amb33322349 [2,0,0,0,0,0|1,0,1]=4 2246 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [2,0,0,0,0,0|0,0,2]=4 2247 B7R0.5 CCCC(C)[C@H](C)N Amb33322348 [2,0,0,0,0,0|1,0,1]=4 2248 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [2,0,0,0,0,0|0,0,2]=4 2249 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [2,0,0,0,0,0|2,0,0]=4 2250 B7R0.5 CCCC(F)C(=O)O Amb25842008 [2,0,0,0,0,0|2,0,0]=4 2251 B7R0.5 CCCC(F)C(C)=O Amb28316211 [2,0,0,0,0,0|1,0,0]=3 2252 B7R0.5 CCCC(F)C(N)=O Amb28127390 [2,0,0,0,0,0|2,0,0]=4 2253 B7R0.5 CCCC(N)C(=O)O Amb6262055 [2,0,0,0,0,0|2,0,0]=4 2254 B7R0.5 CCCC(N)C(C)=O Amb27838289 [2,0,0,0,0,0|1,0,0]=3 2255 B7R0.5 CCCC(N)C(N)=O Amb22284825 [2,0,0,0,0,0|2,0,0]=4 2256 B7R0.5 CCCC(N)C(N)=O Amb9514970 [2,0,0,0,0,0|2,0,0]=4 2257 B7R0.5 CCCC(O)C(=N)N Amb27881736 [2,0,0,0,0,0|2,0,0]=4 2258 B7R0.5 CCCC(O)C(=O)O Amb2818222 [2,0,0,0,0,0|1,0,0]=3 2259 B7R0.5 CCCC(O)C(C)=O Amb22495823 [2,0,0,0,0,0|0,0,0]=2 2260 B7R0.5 CCCC(O)C(C)Br Amb27781536 [2,0,0,0,0,0|1,0,1]=4 2261 B7R0.5 CCCC(O)C(C)C Amb8513256 [2,0,0,0,0,0|1,0,1]=4 2262 B7R0.5 CCCC(O)C(N)=O Amb24116553 [2,0,0,0,0,0|1,0,0]=3 2263 B7R0.5 CCCC(O)N(C)C Amb28400462 [2,0,0,0,0,0|2,0,0]=4 2264 B7R0.5 CCCC(O)[C@@H](C)N Amb35618098 [2,0,0,0,0,0|1,0,1]=4 2265 B7R0.5 CCCC(O)[C@H](C)N Amb35737168 [2,0,0,0,0,0|1,0,1]=4 2266 B7R0.5 CCCC(S)C(=O)O Amb18124440 [2,0,0,0,0,0|1,1,0]=4 2267 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [2,0,0,0,0,0|2,0,0]=4 2268 B7R0.5 CCCN(C)C(N)=O Amb8898960 [2,0,0,0,0,0|2,0,0]=4 2269 B7R0.5 CCCN(N)C(C)=O Amb18641903 [2,0,0,0,0,0|2,0,0]=4 2270 B7R0.5 CCCN(O)C(N)=O Amb28347092 [2,0,0,0,0,0|2,0,0]=4 2271 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [2,0,0,0,0,0|1,0,0]=3 2272 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [2,0,0,0,0,0|0,0,2]=4 2273 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [2,0,0,0,0,0|0,0,2]=4 2274 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [2,0,0,0,0,0|2,0,0]=4 2275 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [2,0,0,0,0,0|2,0,0]=4 2276 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [2,0,0,0,0,0|1,0,0]=3 2277 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [2,0,0,0,0,0|2,0,0]=4 2278 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [2,0,0,0,0,0|2,0,0]=4 2279 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [2,0,0,0,0,0|1,0,0]=3 2280 B7R0.5 CCC[C@@H](O)[C@@H](C)N Amb28198280 [2,0,0,0,0,0|1,0,1]=4 2281 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [2,0,0,0,0,0|0,0,2]=4 2282 B7R0.5 CCC[C@@H](O)[C@H](C)N Amb27392138 [2,0,0,0,0,0|1,0,1]=4 2283 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [2,0,0,0,0,0|2,0,0]=4 2284 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [2,0,0,0,0,0|1,0,0]=3 2285 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [2,0,0,0,0,0|0,0,0]=2 2286 B7R0.5 CCC[C@H](C)[C@@H](C)N Amb27839498 [2,0,0,0,0,0|1,0,1]=4 2287 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [2,0,0,0,0,0|0,0,2]=4 2288 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [2,0,0,0,0,0|2,0,0]=4 2289 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [2,0,0,0,0,0|2,0,0]=4 2290 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [2,0,0,0,0,0|2,0,0]=4 2291 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [2,0,0,0,0,0|1,0,0]=3 2292 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [2,0,0,0,0,0|2,0,0]=4 2293 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [2,0,0,0,0,0|2,0,0]=4 2294 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [2,0,0,0,0,0|1,0,0]=3 2295 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [2,0,0,0,0,0|0,0,0]=2 2296 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [2,0,0,0,0,0|1,1,0]=4 2297 B7R0.5 CCNC(C)C(=O)O Amb33527634 [2,0,0,0,0,0|2,0,0]=4 2298 B7R0.5 CCNC(C)C(=O)O Amb9326962 [2,0,0,0,0,0|2,0,0]=4 2299 B7R0.5 CCNC(C)C(N)=O Amb21959648 [2,0,0,0,0,0|2,0,0]=4 2300 B7R0.5 CCNC(C)C(N)=O Amb7758139 [2,0,0,0,0,0|2,0,0]=4 2301 B7R0.5 CCNC(O)C(=O)O Amb27259098 [2,0,0,0,0,0|2,0,0]=4 2302 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [2,0,0,0,0,0|2,0,0]=4 2303 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [2,0,0,0,0,0|2,0,0]=4 2304 B7R0.5 CCOC(C)C(=O)O Amb9725271 [2,0,0,0,0,0|2,0,0]=4 2305 B7R0.5 CCOC(C)C(C)=O Amb9666103 [2,0,0,0,0,0|1,0,0]=3 2306 B7R0.5 CCOC(C)C(N)=O Amb19960053 [2,0,0,0,0,0|2,0,0]=4 2307 B7R0.5 CCSC(C)C(=O)O Amb9721554 [2,0,0,0,0,0|2,0,0]=4 2308 B7R0.5 CCSC(C)C(N)=O Amb27830179 [2,0,0,0,0,0|2,0,0]=4 2309 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [2,0,0,0,0,0|2,0,0]=4 2310 B7R0.5 CNCC(C)C(=O)O Amb13952364 [2,0,0,0,0,0|2,0,0]=4 2311 B7R0.5 CNCC(C)C(=O)O Amb9400281 [2,0,0,0,0,0|2,0,0]=4 2312 B7R0.5 CNCC(C)C(N)=O Amb8943991 [2,0,0,0,0,0|2,0,0]=4 2313 B7R0.5 CNCC(O)C(=O)O Amb26894610 [2,0,0,0,0,0|2,0,0]=4 2314 B7R0.5 COCC(C)C(=O)O Amb33545090 [2,0,0,0,0,0|2,0,0]=4 2315 B7R0.5 COCC(C)C(C)=O Amb24683449 [2,0,0,0,0,0|1,0,0]=3 2316 B7R0.5 COCC(C)C(N)=O Amb27401584 [2,0,0,0,0,0|2,0,0]=4 2317 B7R0.5 COCC(N)C(C)=O Amb27468401 [2,0,0,0,0,0|2,0,0]=4 2318 B7R0.5 COCC(O)C(=O)O Amb18124273 [2,0,0,0,0,0|2,0,0]=4 2319 B7R0.5 COCC(O)C(N)=O Amb28069186 [2,0,0,0,0,0|2,0,0]=4 2320 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [2,0,0,0,0,0|2,0,0]=4 2321 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [2,0,0,0,0,0|2,0,0]=4 2322 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [2,0,0,0,0,0|2,0,0]=4 2323 B7R0.5 CSCC(C)C(=O)O Amb18967825 [2,0,0,0,0,0|2,0,0]=4 2324 B7R0.5 CSCC(O)C(=O)O Amb25131873 [2,0,0,0,0,0|2,0,0]=4 2325 B7R0.5 CSCC(O)C(C)=O Amb25983211 [2,0,0,0,0,0|1,0,0]=3 2326 B7R0.5 CSCC(O)C(N)=O Amb27168145 [2,0,0,0,0,0|2,0,0]=4 2327 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [2,0,0,0,0,0|2,0,0]=4 2328 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [2,0,0,0,0,0|2,0,0]=4 2329 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [2,0,0,0,0,0|2,0,0]=4 2330 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [2,0,0,0,0,0|2,0,0]=4 2331 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [2,0,0,0,0,0|0,0,2]=4 2332 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [2,0,0,0,0,0|0,0,2]=4 2333 B7R0.5 NCCC(O)C(=O)O Amb16232090 [2,0,0,0,0,0|2,0,0]=4 2334 B7R0.5 NCCC(O)C(N)=O Amb28121985 [2,0,0,0,0,0|2,0,0]=4 2335 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [2,0,0,0,0,0|2,0,0]=4 2336 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [2,0,0,0,0,0|2,0,0]=4 2337 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [2,0,0,0,0,0|2,0,0]=4 2338 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [2,0,0,0,0,0|2,0,0]=4 2339 B7R0.5 O=C(O)C(O)CCF Amb28071189 [2,0,0,0,0,0|2,0,0]=4 2340 B7R0.5 O=C(O)C(O)CCO Amb24689942 [2,0,0,0,0,0|2,0,0]=4 2341 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [2,0,0,0,0,0|2,0,0]=4 2342 B7R0.12 C#CC(CO)CCC Amb27472343 [2,0,0,0,0,0|0,0,2]=4 2343 B7R0.12 C=CC(CC)CCC Amb26515787 [2,0,0,0,0,0|1,0,1]=4 2344 B7R0.12 C=CC(CO)CCC Amb27857843 [2,0,0,0,0,0|0,0,1]=3 2345 B7R0.12 CCC(CO)CCN Amb27838851 [2,0,0,0,0,0|1,0,1]=4 2346 B7R0.12 CCC(CO)COC Amb27474297 [2,0,0,0,0,0|1,0,1]=4 2347 B7R0.12 CCCC(C#N)C=O Amb27408303 [2,0,0,0,0,0|1,0,1]=4 2348 B7R0.12 CCCC(C#N)CO Amb28041229 [2,0,0,0,0,0|1,0,1]=4 2349 B7R0.12 CCCC(C=O)C=O Amb26644051 [2,0,0,0,0,0|0,0,2]=4 2350 B7R0.12 CCCC(C=O)OC Amb25290248 [2,0,0,0,0,0|2,0,0]=4 2351 B7R0.12 CCCC(CBr)OC Amb27477979 [2,0,0,0,0,0|2,0,0]=4 2352 B7R0.12 CCCC(CC)CBr Amb24710188 [2,0,0,0,0,0|1,0,1]=4 2353 B7R0.12 CCCC(CC)CC Amb4019540 [2,0,0,0,0,0|1,0,1]=4 2354 B7R0.12 CCCC(CC)CCl Amb27256711 [2,0,0,0,0,0|1,0,1]=4 2355 B7R0.12 CCCC(CC)CO Amb26486953 [2,0,0,0,0,0|0,0,1]=3 2356 B7R0.12 CCCC(CC)NO Amb27776666 [2,0,0,0,0,0|1,0,1]=4 2357 B7R0.12 CCCC(CC)SC Amb27457518 [2,0,0,0,0,0|2,0,0]=4 2358 B7R0.12 CCCC(CN)CO Amb26907962 [2,0,0,0,0,0|1,0,1]=4 2359 B7R0.12 CCCC(CN)OC Amb24693574 [2,0,0,0,0,0|2,0,0]=4 2360 B7R0.12 CCCC(CO)CF Amb28052943 [2,0,0,0,0,0|1,0,1]=4 2361 B7R0.12 CCCC(CO)CO Amb6298036 [2,0,0,0,0,0|0,0,2]=4 2362 B7R0.12 CCCC(CO)OC Amb27207376 [2,0,0,0,0,0|1,0,0]=3 2363 B7R0.12 CCCC(CS)OC Amb27192029 [2,0,0,0,0,0|1,1,0]=4 2364 B7R0.12 CCCN(CO)N=O Amb27252079 [2,0,0,0,0,0|2,0,0]=4 2365 B7R0.12 CCC[C@@H](CC)CO Amb27405222 [2,0,0,0,0,0|0,0,1]=3 2366 B7R0.12 CCC[C@@H](CN)CO Amb27949320 [2,0,0,0,0,0|1,0,1]=4 2367 B7R0.12 CCC[C@H](C=O)SC Amb28287171 [2,0,0,0,0,0|2,0,0]=4 2368 B7R0.12 CCC[C@H](CC)CBr Amb27595055 [2,0,0,0,0,0|1,0,1]=4 2369 B7R0.12 CCC[C@H](CN)CO Amb28316219 [2,0,0,0,0,0|1,0,1]=4 2370 B7R0.12 CCC\C(C=O)=C\O Amb27268562 [2,0,0,0,0,0|0,0,2]=4 2371 B7R0.12 CCNC(CC)CO Amb6735191 [2,0,0,0,0,0|1,0,1]=4 2372 B7R0.12 CCN[C@@H](CC)CO Amb22745950 [2,0,0,0,0,0|1,0,1]=4 2373 B7R0.12 CCN[C@H](CC)CO Amb24624036 [2,0,0,0,0,0|1,0,1]=4 2374 B7R0.12 CCOC(C=O)CO Amb27164613 [2,0,0,0,0,0|1,0,0]=3 2375 B7R0.12 CCOC(CC)CO Amb27755431 [2,0,0,0,0,0|1,0,1]=4 2376 B7R0.12 CNC(CO)COC Amb27172954 [2,0,0,0,0,0|2,0,0]=4 2377 B7R0.12 CNC(CO)CSC Amb27830294 [2,0,0,0,0,0|2,0,0]=4 2378 B7R0.12 COC(CO)CCO Amb28066154 [2,0,0,0,0,0|2,0,0]=4 2379 B7R0.12 COCC(CO)OC Amb24288652 [2,0,0,0,0,0|2,0,0]=4 2380 B7R0.12 COC[C@@H](CO)OC Amb33457614 [2,0,0,0,0,0|2,0,0]=4 2381 B7R0.12 COC[C@H](CO)OC Amb25332375 [2,0,0,0,0,0|2,0,0]=4 2382 B7R0.12 CO[C@@H](CO)CCO Amb27764792 [2,0,0,0,0,0|2,0,0]=4 2383 B7R0.12 C\C=C(\CO)CCBr Amb24519452 [2,0,0,0,0,0|1,0,1]=4 2384 B7R0.12 C\C=C(\CO)CSC Amb24740110 [2,0,0,0,0,0|1,0,1]=4 2385 B7R0.15 C=C(C)C(CC)CC Amb4019532 [2,0,0,0,0,0|2,0,0]=4 2386 B7R0.15 C=C(C)C(CC)CO Amb28453435 [2,0,0,0,0,0|1,0,0]=3 2387 B7R0.15 C=C(C)C(CN)CO Amb33199604 [2,0,0,0,0,0|2,0,0]=4 2388 B7R0.15 C=CC(CC)C(C)=O Amb28315864 [2,0,0,0,0,0|1,0,1]=4 2389 B7R0.15 CC(=O)C(CN)CN Amb28206451 [2,0,0,0,0,0|2,0,0]=4 2390 B7R0.15 CC(=O)C(CO)CO Amb22904340 [2,0,0,0,0,0|1,0,0]=3 2391 B7R0.15 CC(=O)N(CO)CO Amb28381633 [2,0,0,0,0,0|2,0,0]=4 2392 B7R0.15 CCC(C#N)C(C)=O Amb9535904 [2,0,0,0,0,0|1,0,1]=4 2393 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [2,0,0,0,0,0|2,0,0]=4 2394 B7R0.15 CCC(CC)C(=O)O Amb4605826 [2,0,0,0,0,0|2,0,0]=4 2395 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [2,0,0,0,0,0|2,0,0]=4 2396 B7R0.15 CCC(CC)C(C)=O Amb33536259 [2,0,0,0,0,0|1,0,0]=3 2397 B7R0.15 CCC(CC)C(N)=O Amb33550498 [2,0,0,0,0,0|2,0,0]=4 2398 B7R0.15 CCC(CCl)C(=O)Cl Amb28421936 [2,0,0,0,0,0|2,0,0]=4 2399 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [2,0,0,0,0,0|2,0,0]=4 2400 B7R0.15 CCC(CF)C(=O)O Amb27625346 [2,0,0,0,0,0|2,0,0]=4 2401 B7R0.15 CCC(CN)C(=O)O Amb18987934 [2,0,0,0,0,0|2,0,0]=4 2402 B7R0.15 CCC(CN)C(=O)O Amb19514932 [2,0,0,0,0,0|2,0,0]=4 2403 B7R0.15 CCC(CN)C(N)=O Amb18294192 [2,0,0,0,0,0|2,0,0]=4 2404 B7R0.15 CCC(CO)C(=O)O Amb18641947 [2,0,0,0,0,0|1,0,0]=3 2405 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [2,0,0,0,0,0|1,0,0]=3 2406 B7R0.15 CCC(CO)C(C)C Amb3939511 [2,0,0,0,0,0|1,0,1]=4 2407 B7R0.15 CCC(CO)C(C)O Amb28048986 [2,0,0,0,0,0|0,0,2]=4 2408 B7R0.15 CCC(CO)C(N)=O Amb28314312 [2,0,0,0,0,0|1,0,0]=3 2409 B7R0.15 CCC(CO)N(C)C Amb9173458 [2,0,0,0,0,0|2,0,0]=4 2410 B7R0.15 CCC(CO)[N+](=O)[O-] Amb4035129 [2,0,0,0,0,0|2,0,0]=4 2411 B7R0.15 CCC(NC)C(C)=O Amb28049011 [2,0,0,0,0,0|2,0,0]=4 2412 B7R0.15 CCC(NO)C(=O)O Amb4019788 [2,0,0,0,0,0|2,0,0]=4 2413 B7R0.15 CCC(OC)C(C)=O Amb26004835 [2,0,0,0,0,0|2,0,0]=4 2414 B7R0.15 CCC(SC)C(C)=O Amb28460748 [2,0,0,0,0,0|2,0,0]=4 2415 B7R0.15 CCN(CC)C(C)=O Amb3358092 [2,0,0,0,0,0|2,0,0]=4 2416 B7R0.15 CCN(CCl)C(C)=O Amb27253146 [2,0,0,0,0,0|2,0,0]=4 2417 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [2,0,0,0,0,0|2,0,0]=4 2418 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [2,0,0,0,0,0|1,0,0]=3 2419 B7R0.15 CC[C@@H](CO)C(C)C Amb27255223 [2,0,0,0,0,0|1,0,1]=4 2420 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [2,0,0,0,0,0|2,0,0]=4 2421 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [2,0,0,0,0,0|1,0,0]=3 2422 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [2,0,0,0,0,0|2,0,0]=4 2423 B7R0.15 CC\C(=N\O)C(C)=O Amb28198610 [2,0,0,0,0,0|1,0,1]=4 2424 B7R0.15 CNC(CO)C(=O)O Amb26068513 [2,0,0,0,0,0|2,0,0]=4 2425 B7R0.15 CNC(CO)C(N)=O Amb18641957 [2,0,0,0,0,0|2,0,0]=4 2426 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [2,0,0,0,0,0|2,0,0]=4 2427 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [2,0,0,0,0,0|1,0,0]=3 2428 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [2,0,0,0,0,0|2,0,0]=4 2429 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [2,0,0,0,0,0|2,0,0]=4 2430 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [2,0,0,0,0,0|2,0,0]=4 2431 B9R0.3 CCCCC(C)C(C)(C)O Amb28204142 [1,1,0,0,0,0|0,0,2]=4 2432 B9R0.3 CCCCC(C)S(=O)(=O)Cl Amb18324731 [1,1,0,0,0,0|2,0,0]=4 2433 B9R0.3 CCCCC(C)S(=O)(=O)F Amb32717744 [1,1,0,0,0,0|2,0,0]=4 2434 B9R0.3 CCCCC(C)S(N)(=O)=O Amb18183522 [1,1,0,0,0,0|2,0,0]=4 2435 B9R0.3 CCCCC(N)P(C)(=O)O Amb27863006 [1,1,0,0,0,0|2,0,0]=4 2436 B9R0.3 CCCCC(O)C(C)(C)C Amb4020070 [1,1,0,0,0,0|1,0,1]=4 2437 B9R0.3 CCCCC(O)C(C)(C)O Amb27839540 [1,1,0,0,0,0|0,0,2]=4 2438 B9R0.3 CCCCC(O)P(=O)(O)O Amb25356317 [1,1,0,0,0,0|2,0,0]=4 2439 B9R0.3 CCCC[C@H](O)C(C)(C)O Amb27427097 [1,1,0,0,0,0|0,0,2]=4 2440 B9R0.3 CCNCC(C)S(C)(=O)=O Amb27968614 [1,1,0,0,0,0|2,0,0]=4 2441 B9R0.6 C=C(C(C)=O)[C@@H](O)CCC Amb28141638 [1,1,0,0,0,0|0,0,2]=4 2442 B9R0.6 C=C(C)C(O)C(C)COC Amb27770498 [1,1,0,0,0,0|2,0,0]=4 2443 B9R0.6 C=C(C)C(O)C(O)CCC Amb27858600 [1,1,0,0,0,0|1,0,0]=3 2444 B9R0.6 C=C(C)[C@@H](O)[C@H](C)CCC Amb27833712 [1,1,0,0,0,0|1,0,0]=3 2445 B9R0.6 CC(=O)C(C)C(C)CC=O Amb27827459 [1,1,0,0,0,0|1,0,1]=4 2446 B9R0.6 CC(=O)C(O)C(O)CC=O Amb28050017 [1,1,0,0,0,0|1,0,1]=4 2447 B9R0.6 CCCC(=O)C(C)C(C)=O Amb17593599 [1,1,0,0,0,0|0,0,1]=3 2448 B9R0.6 CCCC(C)C(=O)C(C)=O Amb28144170 [1,1,0,0,0,0|0,0,2]=4 2449 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [1,1,0,0,0,0|1,0,0]=3 2450 B9R0.6 CCCC(C)C(C)C(C)O Amb28126833 [1,1,0,0,0,0|0,0,2]=4 2451 B9R0.6 CCCC(C)C(Cl)C(N)=O Amb18800738 [1,1,0,0,0,0|2,0,0]=4 2452 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [1,1,0,0,0,0|2,0,0]=4 2453 B9R0.6 CCCC(C)C(N)C(N)=O Amb27809015 [1,1,0,0,0,0|2,0,0]=4 2454 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [1,1,0,0,0,0|1,0,0]=3 2455 B9R0.6 CCCC(C)C(O)C(C)=O Amb27645205 [1,1,0,0,0,0|0,0,0]=2 2456 B9R0.6 CCCC(C)C(O)C(C)C Amb4035864 [1,1,0,0,0,0|1,0,1]=4 2457 B9R0.6 CCCC(C)C(O)C(C)O Amb28126834 [1,1,0,0,0,0|0,0,2]=4 2458 B9R0.6 CCCC(C)C(O)C(N)=O Amb27407802 [1,1,0,0,0,0|1,0,0]=3 2459 B9R0.6 CCCC(C)N(C)C(=O)Cl Amb27837818 [1,1,0,0,0,0|2,0,0]=4 2460 B9R0.6 CCCC(C)N(C)C(C)=O Amb27839148 [1,1,0,0,0,0|1,0,0]=3 2461 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [1,1,0,0,0,0|1,0,0]=3 2462 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [1,1,0,0,0,0|2,0,0]=4 2463 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [1,1,0,0,0,0|1,0,0]=3 2464 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [1,1,0,0,0,0|2,0,0]=4 2465 B9R0.6 CCCC(Cl)C(O)C(C)=O Amb25943692 [1,1,0,0,0,0|0,0,0]=2 2466 B9R0.6 CCCC(F)C(Br)C(=O)O Amb27623862 [1,1,0,0,0,0|2,0,0]=4 2467 B9R0.6 CCCC(F)C(N)C(=O)O Amb10839857 [1,1,0,0,0,0|2,0,0]=4 2468 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [1,1,0,0,0,0|1,0,0]=3 2469 B9R0.6 CCCC(N)C(F)C(=O)O Amb33036385 [1,1,0,0,0,0|2,0,0]=4 2470 B9R0.6 CCCC(N)C(O)C(N)=O Amb8391315 [1,1,0,0,0,0|1,0,0]=3 2471 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [1,1,0,0,0,0|1,0,0]=3 2472 B9R0.6 CCCC(O)C(C)C(C)O Amb17779410 [1,1,0,0,0,0|0,0,2]=4 2473 B9R0.6 CCCC(O)C(C)C(N)=O Amb27816041 [1,1,0,0,0,0|1,0,0]=3 2474 B9R0.6 CCCC(O)C(Cl)C(=O)O Amb28120934 [1,1,0,0,0,0|2,0,0]=4 2475 B9R0.6 CCCC(O)C(Cl)C(C)=O Amb26066170 [1,1,0,0,0,0|1,0,0]=3 2476 B9R0.6 CCCC(O)C(F)C(=O)O Amb33036248 [1,1,0,0,0,0|2,0,0]=4 2477 B9R0.6 CCCC(O)C(N)C(=O)O Amb18124815 [1,1,0,0,0,0|2,0,0]=4 2478 B9R0.6 CCCC(O)C(O)C(=O)O Amb27772742 [1,1,0,0,0,0|1,0,0]=3 2479 B9R0.6 CCCC(O)C(O)C(C)=O Amb28122464 [1,1,0,0,0,0|0,0,0]=2 2480 B9R0.6 CCCC(O)C(O)C(C)Cl Amb27591040 [1,1,0,0,0,0|1,0,1]=4 2481 B9R0.6 CCCC(O)C(O)C(C)O Amb27207836 [1,1,0,0,0,0|0,0,2]=4 2482 B9R0.6 CCCC(O)[C@@H](O)C(=O)O Amb27256644 [1,1,0,0,0,0|1,0,0]=3 2483 B9R0.6 CCCC(O)[C@H](N)C(=O)O Amb26635079 [1,1,0,0,0,0|2,0,0]=4 2484 B9R0.6 CCCC(S)C(N)C(=O)O Amb27860699 [1,1,0,0,0,0|2,0,0]=4 2485 B9R0.6 CCCC(S)[C@@H](N)C(=O)O Amb27759942 [1,1,0,0,0,0|2,0,0]=4 2486 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [1,1,0,0,0,0|1,0,0]=3 2487 B9R0.6 CCC[C@@H](N)C(O)C(N)=O Amb33716855 [1,1,0,0,0,0|1,0,0]=3 2488 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [1,1,0,0,0,0|1,0,0]=3 2489 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O Amb22747816 [1,1,0,0,0,0|1,0,0]=3 2490 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O Amb22747809 [1,1,0,0,0,0|1,0,0]=3 2491 B9R0.6 CCC[C@@H](O)[C@@H](N)C(=O)O Amb25367288 [1,1,0,0,0,0|2,0,0]=4 2492 B9R0.6 CCC[C@@H](O)[C@H](N)C(=O)O Amb24715802 [1,1,0,0,0,0|2,0,0]=4 2493 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [1,1,0,0,0,0|2,0,0]=4 2494 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [1,1,0,0,0,0|1,0,0]=3 2495 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [1,1,0,0,0,0|2,0,0]=4 2496 B9R0.6 CCC[C@H](N)C(O)C(=O)O Amb27229636 [1,1,0,0,0,0|1,0,0]=3 2497 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [1,1,0,0,0,0|1,0,0]=3 2498 B9R0.6 CCC[C@H](N)[C@@H](O)C(=O)O Amb26344900 [1,1,0,0,0,0|1,0,0]=3 2499 B9R0.6 CCC[C@H](N)[C@H](O)C(=O)O Amb25084552 [1,1,0,0,0,0|1,0,0]=3 2500 B9R0.6 CCC[C@H](O)[C@@H](N)C(=O)O Amb26415873 [1,1,0,0,0,0|2,0,0]=4 2501 B9R0.6 CCC[C@H](O)[C@H](N)C(=O)O Amb25113866 [1,1,0,0,0,0|2,0,0]=4 2502 B9R0.6 CCNC(C)C(C)S(C)=O Amb27191826 [1,1,0,0,0,0|2,0,0]=4 2503 B9R0.6 CCOC(=N)C(C)C(C)=O Amb28189941 [1,1,0,0,0,0|1,0,1]=4 2504 B9R0.6 CCOC(=O)C(C)C(C)=O Amb3941651 [1,1,0,0,0,0|1,0,1]=4 2505 B9R0.6 CCOC(=O)C(O)C(C)=O Amb17593653 [1,1,0,0,0,0|1,0,1]=4 2506 B9R0.6 CCOC(=S)C(C)C(C)=O Amb27945529 [1,1,0,0,0,0|1,0,1]=4 2507 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [1,1,0,0,0,0|2,0,0]=4 2508 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [1,1,0,0,0,0|2,0,0]=4 2509 B9R0.6 CCOC(C)C(O)C(C)=O Amb27226954 [1,1,0,0,0,0|1,0,0]=3 2510 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [1,1,0,0,0,0|2,0,0]=4 2511 B9R0.6 CC\C=C(/C)C(O)C(C)=O Amb28202152 [1,1,0,0,0,0|0,0,2]=4 2512 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [1,1,0,0,0,0|2,0,0]=4 2513 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [1,1,0,0,0,0|2,0,0]=4 2514 B9R0.6 COCC(C)N(C)C(C)=O Amb28203512 [1,1,0,0,0,0|2,0,0]=4 2515 B9R0.6 C\C=C\C(C)C(C)C(C)=O Amb24570391 [1,1,0,0,0,0|0,0,2]=4 2516 B9R0.7 C=C(C)C(Cl)CCC(C)C Amb27402118 [1,1,0,0,0,0|2,0,0]=4 2517 B9R0.7 C=C(C)C(O)CCN(C)C Amb27613278 [1,1,0,0,0,0|2,0,0]=4 2518 B9R0.7 C=C(C)C(O)COC(C)C Amb28126844 [1,1,0,0,0,0|2,0,0]=4 2519 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [1,1,0,0,0,0|1,0,1]=4 2520 B9R0.7 C=C(C)CCC(C)C(C)=O Amb27753284 [1,1,0,0,0,0|0,0,1]=3 2521 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [1,1,0,0,0,0|1,0,1]=4 2522 B9R0.7 C=C(C)COC(C)C(C)=O Amb27476278 [1,1,0,0,0,0|1,0,1]=4 2523 B9R0.7 C=C(C)CSC(C)C(C)=O Amb28381627 [1,1,0,0,0,0|1,0,1]=4 2524 B9R0.7 C=C(C)[C@@H](C)CCC(C)=O Amb24583145 [1,1,0,0,0,0|1,0,1]=4 2525 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [1,1,0,0,0,0|1,0,1]=4 2526 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [1,1,0,0,0,0|0,0,0]=2 2527 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [1,1,0,0,0,0|1,0,1]=4 2528 B9R0.7 CC(=O)C(C)CCN(C)C Amb27470904 [1,1,0,0,0,0|1,0,0]=3 2529 B9R0.7 CC(=O)C(C)CCS(C)=O Amb27783563 [1,1,0,0,0,0|1,0,0]=3 2530 B9R0.7 CC(=O)C(C)CNN(C)C Amb28049906 [1,1,0,0,0,0|2,0,0]=4 2531 B9R0.7 CC(=O)C(C)NCC(C)C Amb24480697 [1,1,0,0,0,0|1,0,0]=3 2532 B9R0.7 CC(=O)C(C)OCC(C)C Amb9665195 [1,1,0,0,0,0|1,0,0]=3 2533 B9R0.7 CC(=O)C(C)SCC(C)O Amb27651284 [1,1,0,0,0,0|1,0,0]=3 2534 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [1,1,0,0,0,0|1,0,1]=4 2535 B9R0.7 CC(=O)C(O)COC(C)C Amb28201134 [1,1,0,0,0,0|1,0,0]=3 2536 B9R0.7 CC(=O)CCC(Cl)C(C)=O Amb27444965 [1,1,0,0,0,0|1,0,1]=4 2537 B9R0.7 CC(=O)N(C)CCC(C)Br Amb27393471 [1,1,0,0,0,0|1,0,0]=3 2538 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [1,1,0,0,0,0|1,0,1]=4 2539 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [1,1,0,0,0,0|1,0,1]=4 2540 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [1,1,0,0,0,0|1,0,1]=4 2541 B9R0.7 CC(=O)\C(C)=N\CC(C)O Amb27434278 [1,1,0,0,0,0|1,0,1]=4 2542 B9R0.7 CC(C)C(O)CC[C@@H](C)O Amb27213851 [1,1,0,0,0,0|1,0,1]=4 2543 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [1,1,0,0,0,0|2,0,0]=4 2544 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [1,1,0,0,0,0|1,0,0]=3 2545 B9R0.7 CC(C)CCC(C)C(C)Cl Amb18183502 [1,1,0,0,0,0|1,0,1]=4 2546 B9R0.7 CC(C)CCC(C)C(C)O Amb25262988 [1,1,0,0,0,0|0,0,2]=4 2547 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [1,1,0,0,0,0|2,0,0]=4 2548 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [1,1,0,0,0,0|2,0,0]=4 2549 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [1,1,0,0,0,0|2,0,0]=4 2550 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [1,1,0,0,0,0|2,0,0]=4 2551 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [1,1,0,0,0,0|2,0,0]=4 2552 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [1,1,0,0,0,0|1,0,0]=3 2553 B9R0.7 CC(C)CCC(O)C(C)C Amb22228388 [1,1,0,0,0,0|1,0,1]=4 2554 B9R0.7 CC(C)CCC(O)C(C)N Amb27444287 [1,1,0,0,0,0|1,0,1]=4 2555 B9R0.7 CC(C)CCN(C)C(=O)Cl Amb27617143 [1,1,0,0,0,0|2,0,0]=4 2556 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [1,1,0,0,0,0|1,0,0]=3 2557 B9R0.7 CC(C)CC[C@@H](Cl)C(=O)Cl Amb27164122 [1,1,0,0,0,0|2,0,0]=4 2558 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [1,1,0,0,0,0|2,0,0]=4 2559 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [1,1,0,0,0,0|2,0,0]=4 2560 B9R0.7 CC(C)CC[C@@H](O)C(=O)[O-] Amb27218868 [1,1,0,0,0,0|1,0,0]=3 2561 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [1,1,0,0,0,0|1,0,0]=3 2562 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [1,1,0,0,0,0|2,0,0]=4 2563 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [1,1,0,0,0,0|2,0,0]=4 2564 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [1,1,0,0,0,0|2,0,0]=4 2565 B9R0.7 CC(C)CNC(C)C(N)=O Amb9203289 [1,1,0,0,0,0|2,0,0]=4 2566 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [1,1,0,0,0,0|2,0,0]=4 2567 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [1,1,0,0,0,0|2,0,0]=4 2568 B9R0.7 CC(C)COC(C)C(N)=O Amb19960054 [1,1,0,0,0,0|2,0,0]=4 2569 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [1,1,0,0,0,0|2,0,0]=4 2570 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [1,1,0,0,0,0|2,0,0]=4 2571 B9R0.7 CC(C)NCC(C)C(N)=O Amb8944544 [1,1,0,0,0,0|2,0,0]=4 2572 B9R0.7 CC(C)NCC(C)S(C)=O Amb27474158 [1,1,0,0,0,0|2,0,0]=4 2573 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [1,1,0,0,0,0|2,0,0]=4 2574 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [1,1,0,0,0,0|2,0,0]=4 2575 B9R0.7 CC(C)[C@@H](O)CC[C@@H](C)O Amb28455603 [1,1,0,0,0,0|1,0,1]=4 2576 B9R0.7 CC(C)[C@H](O)CC[C@@H](C)O Amb28079178 [1,1,0,0,0,0|1,0,1]=4 2577 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [1,1,0,0,0,0|2,0,0]=4 2578 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [1,1,0,0,0,0|2,0,0]=4 2579 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [1,1,0,0,0,0|2,0,0]=4 2580 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [1,1,0,0,0,0|2,0,0]=4 2581 B9R0.7 CC(Cl)CCC(C)N(C)C Amb27201320 [1,1,0,0,0,0|2,0,0]=4 2582 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [1,1,0,0,0,0|1,0,0]=3 2583 B9R0.7 CC(N)CCN(C)C(N)=O Amb27643169 [1,1,0,0,0,0|2,0,0]=4 2584 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [1,1,0,0,0,0|2,0,0]=4 2585 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [1,1,0,0,0,0|2,0,0]=4 2586 B9R0.7 CC(NC[C@H](C)O)C(N)=O Amb27596825 [1,1,0,0,0,0|2,0,0]=4 2587 B9R0.7 CC(O)CCC(C)C(C)O Amb28044350 [1,1,0,0,0,0|0,0,2]=4 2588 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [1,1,0,0,0,0|2,0,0]=4 2589 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [1,1,0,0,0,0|2,0,0]=4 2590 B9R0.7 CC(O)CC[C@@H](C)[C@H](C)O Amb27213872 [1,1,0,0,0,0|0,0,2]=4 2591 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [1,1,0,0,0,0|2,0,0]=4 2592 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [1,1,0,0,0,0|2,0,0]=4 2593 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [1,1,0,0,0,0|2,0,0]=4 2594 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [1,1,0,0,0,0|2,0,0]=4 2595 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [1,1,0,0,0,0|2,0,0]=4 2596 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [1,1,0,0,0,0|2,0,0]=4 2597 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [1,1,0,0,0,0|2,0,0]=4 2598 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [1,1,0,0,0,0|1,0,0]=3 2599 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [1,1,0,0,0,0|2,0,0]=4 2600 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [1,1,0,0,0,0|2,0,0]=4 2601 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [1,1,0,0,0,0|2,0,0]=4 2602 B9R0.7 C[S+](C)CCC(O)C(=O)[O-] Amb28069582 [1,1,0,0,0,0|2,0,0]=4 2603 B9R0.8 C#CC(=O)N(C)CCCC Amb27970751 [1,1,0,0,0,0|1,0,1]=4 2604 B9R0.8 C=C(C#N)C(O)CCCC Amb18643442 [1,1,0,0,0,0|1,0,1]=4 2605 B9R0.8 C=C(CO)C(O)CCCC Amb27839533 [1,1,0,0,0,0|1,0,0]=3 2606 B9R0.8 C=CC(=O)C(N)CCCC Amb28050432 [1,1,0,0,0,0|1,0,1]=4 2607 B9R0.8 C=CC(C)C(C)CCCC Amb27493593 [1,1,0,0,0,0|1,0,1]=4 2608 B9R0.8 C=CC(C)C(O)CCCC Amb17593607 [1,1,0,0,0,0|1,0,1]=4 2609 B9R0.8 C=CCCC(O)C(=O)OC Amb27669786 [1,1,0,0,0,0|0,0,2]=4 2610 B9R0.8 C=C[C@@H](C)[C@H](O)CCCC Amb27857168 [1,1,0,0,0,0|1,0,1]=4 2611 B9R0.8 C=C[C@H](C)[C@H](O)CCCC Amb27198444 [1,1,0,0,0,0|1,0,1]=4 2612 B9R0.8 CC#CCC(C)C(=O)CC Amb27859606 [1,1,0,0,0,0|0,0,2]=4 2613 B9R0.8 CC#CCC(C)C(=O)CCl Amb27422908 [1,1,0,0,0,0|0,0,2]=4 2614 B9R0.8 CC(CCCN)C(=O)NN Amb27593191 [1,1,0,0,0,0|2,0,0]=4 2615 B9R0.8 CCC(=O)C(C)CCCO Amb28314429 [1,1,0,0,0,0|1,0,0]=3 2616 B9R0.8 CCC(=O)C(C)CCOC Amb28254753 [1,1,0,0,0,0|1,0,0]=3 2617 B9R0.8 CCC(=O)C(C)SCCCl Amb27955804 [1,1,0,0,0,0|2,0,0]=4 2618 B9R0.8 CCC(=O)C(N)CCOC Amb28423088 [1,1,0,0,0,0|2,0,0]=4 2619 B9R0.8 CCC(=O)N(C)CCNC Amb27984418 [1,1,0,0,0,0|2,0,0]=4 2620 B9R0.8 CCC(=O)N(C)CCOC Amb25291328 [1,1,0,0,0,0|2,0,0]=4 2621 B9R0.8 CCCCC(=O)C(=O)OC Amb22755702 [1,1,0,0,0,0|0,0,2]=4 2622 B9R0.8 CCCCC(Br)C(=O)CBr Amb26444150 [1,1,0,0,0,0|1,0,0]=3 2623 B9R0.8 CCCCC(Br)C(=O)OC Amb19514695 [1,1,0,0,0,0|1,0,0]=3 2624 B9R0.8 CCCCC(C)C(=N)NO Amb28388768 [1,1,0,0,0,0|1,0,1]=4 2625 B9R0.8 CCCCC(C)C(=O)CC Amb25359211 [1,1,0,0,0,0|0,0,0]=2 2626 B9R0.8 CCCCC(C)C(=O)NC Amb27627834 [1,1,0,0,0,0|0,0,0]=2 2627 B9R0.8 CCCCC(C)C(C)NC Amb27605555 [1,1,0,0,0,0|1,0,1]=4 2628 B9R0.8 CCCCC(C)C(F)CO Amb27261654 [1,1,0,0,0,0|1,0,1]=4 2629 B9R0.8 CCCCC(C)N(C)C=O Amb28325442 [1,1,0,0,0,0|1,0,0]=3 2630 B9R0.8 CCCCC(C)\C(C)=N\O Amb26370042 [1,1,0,0,0,0|0,0,1]=3 2631 B9R0.8 CCCCC(Cl)C(=O)CC Amb28322143 [1,1,0,0,0,0|1,0,0]=3 2632 B9R0.8 CCCCC(F)C(=O)CC Amb27212037 [1,1,0,0,0,0|1,0,0]=3 2633 B9R0.8 CCCCC(N)C(=O)NN Amb27654302 [1,1,0,0,0,0|2,0,0]=4 2634 B9R0.8 CCCCC(N)C(=O)NO Amb22059372 [1,1,0,0,0,0|2,0,0]=4 2635 B9R0.8 CCCCC(N)C(=O)OC Amb9330294 [1,1,0,0,0,0|1,0,0]=3 2636 B9R0.8 CCCCC(N)C(=O)OC Amb9825492 [1,1,0,0,0,0|1,0,0]=3 2637 B9R0.8 CCCCC(O)C(=O)CO Amb27434084 [1,1,0,0,0,0|0,0,0]=2 2638 B9R0.8 CCCCC(O)C(C)CC Amb4020074 [1,1,0,0,0,0|1,0,1]=4 2639 B9R0.8 CCCCC(O)C(C)CN Amb26392245 [1,1,0,0,0,0|1,0,1]=4 2640 B9R0.8 CCCCC(O)C(C)NC Amb27252118 [1,1,0,0,0,0|1,0,1]=4 2641 B9R0.8 CCCCC(O)C(C)OC Amb28049582 [1,1,0,0,0,0|0,0,2]=4 2642 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [1,1,0,0,0,0|1,0,1]=4 2643 B9R0.8 CCCCC(O)C(O)CO Amb8514775 [1,1,0,0,0,0|0,0,2]=4 2644 B9R0.8 CCCCC(O)\C(F)=C\F Amb28050743 [1,1,0,0,0,0|1,0,1]=4 2645 B9R0.8 CCCCC(S)C(=O)OC Amb24745120 [1,1,0,0,0,0|0,1,0]=3 2646 B9R0.8 CCCCN(C)C(=N)NC Amb27222838 [1,1,0,0,0,0|2,0,0]=4 2647 B9R0.8 CCCCN(C)C(=O)CCl Amb6272027 [1,1,0,0,0,0|1,0,0]=3 2648 B9R0.8 CCCCN(C)C(=O)CN Amb5783143 [1,1,0,0,0,0|1,0,0]=3 2649 B9R0.8 CCCCN(C)C(=O)CO Amb17334237 [1,1,0,0,0,0|1,0,0]=3 2650 B9R0.8 CCCCN(C)C(=O)CS Amb33548706 [1,1,0,0,0,0|1,0,0]=3 2651 B9R0.8 CCCCN(N)C(=O)CC Amb33191485 [1,1,0,0,0,0|2,0,0]=4 2652 B9R0.8 CCCCN(N)C(=O)OC Amb33191487 [1,1,0,0,0,0|2,0,0]=4 2653 B9R0.8 CCCC[C@@H](C)C(=O)OC Amb27172534 [1,1,0,0,0,0|0,0,0]=2 2654 B9R0.8 CCCC[C@@H](C)[C@@H](O)CC Amb27981905 [1,1,0,0,0,0|0,0,2]=4 2655 B9R0.8 CCCC[C@@H](C)[C@H](O)CC Amb27980692 [1,1,0,0,0,0|0,0,2]=4 2656 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb16183949 [1,1,0,0,0,0|1,0,0]=3 2657 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb22745342 [1,1,0,0,0,0|1,0,0]=3 2658 B9R0.8 CCCC[C@@H](O)[C@@H](C)CC Amb27839219 [1,1,0,0,0,0|1,0,1]=4 2659 B9R0.8 CCCC[C@@H](O)[C@@H](C)CO Amb28125795 [1,1,0,0,0,0|0,0,2]=4 2660 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [1,1,0,0,0,0|1,0,1]=4 2661 B9R0.8 CCCC[C@@H](O)[C@H](C)CO Amb27756413 [1,1,0,0,0,0|0,0,2]=4 2662 B9R0.8 CCCC[C@H](Cl)C(=O)OC Amb27823590 [1,1,0,0,0,0|1,0,0]=3 2663 B9R0.8 CCCC[C@H](N)C(=O)OC Amb22169631 [1,1,0,0,0,0|1,0,0]=3 2664 B9R0.8 CCCC[C@H](N)C(=O)OC Amb26391986 [1,1,0,0,0,0|1,0,0]=3 2665 B9R0.8 CCCC[C@H](O)C(=O)OC Amb27589932 [1,1,0,0,0,0|0,0,0]=2 2666 B9R0.8 CCCC[C@H](O)[C@@H](C)C=O Amb27770429 [1,1,0,0,0,0|0,0,1]=3 2667 B9R0.8 CCCC[C@H](O)[C@@H](C)CO Amb27775544 [1,1,0,0,0,0|0,0,2]=4 2668 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [1,1,0,0,0,0|1,0,0]=3 2669 B9R0.8 CCCNC(C)C(=O)OC Amb32751764 [1,1,0,0,0,0|1,0,0]=3 2670 B9R0.8 CCCN[C@H](C)C(=O)OC Amb27812247 [1,1,0,0,0,0|1,0,0]=3 2671 B9R0.8 CCCO[C@@H](C)C(=O)CC Amb27433171 [1,1,0,0,0,0|1,0,0]=3 2672 B9R0.8 CCCO[C@H](C)C(=O)OC Amb28145144 [1,1,0,0,0,0|1,0,0]=3 2673 B9R0.8 CCCSC(C)C(=O)NC Amb24420363 [1,1,0,0,0,0|1,0,0]=3 2674 B9R0.8 CCC\C=C(\C)C(=O)CC Amb27854893 [1,1,0,0,0,0|0,0,2]=4 2675 B9R0.8 CCC\C=C(\C)C(=O)CO Amb27844148 [1,1,0,0,0,0|0,0,2]=4 2676 B9R0.8 CCNCC(C)C(=O)NN Amb27864683 [1,1,0,0,0,0|2,0,0]=4 2677 B9R0.8 CCNCC(C)C(=O)OC Amb9400286 [1,1,0,0,0,0|1,0,0]=3 2678 B9R0.8 CCNCC(I)C(=O)OC Amb27839610 [1,1,0,0,0,0|2,0,0]=4 2679 B9R0.8 CCOCC(Br)C(=O)OC Amb27443366 [1,1,0,0,0,0|2,0,0]=4 2680 B9R0.8 CCOCC(Cl)C(=O)CCl Amb27657708 [1,1,0,0,0,0|2,0,0]=4 2681 B9R0.8 CCOCC(N)C(=O)OC Amb26578258 [1,1,0,0,0,0|2,0,0]=4 2682 B9R0.8 CCOC[C@@H](N)C(=O)OC Amb24478281 [1,1,0,0,0,0|2,0,0]=4 2683 B9R0.8 CCOC[C@H](N)C(=O)OC Amb26047386 [1,1,0,0,0,0|2,0,0]=4 2684 B9R0.8 CCONC(C)C(=O)NC Amb27483948 [1,1,0,0,0,0|2,0,0]=4 2685 B9R0.8 CCSCC(Br)C(=O)OC Amb28424307 [1,1,0,0,0,0|2,0,0]=4 2686 B9R0.8 CCSCC(C)C(=O)NN Amb27815660 [1,1,0,0,0,0|2,0,0]=4 2687 B9R0.8 CCSCC(Cl)C(=O)OC Amb27454062 [1,1,0,0,0,0|2,0,0]=4 2688 B9R0.8 CCSCC(N)C(=O)NC Amb27199796 [1,1,0,0,0,0|2,0,0]=4 2689 B9R0.8 CCSCC(N)C(=O)OC Amb18788226 [1,1,0,0,0,0|2,0,0]=4 2690 B9R0.8 CCSCC(O)C(=O)OC Amb27881455 [1,1,0,0,0,0|1,0,0]=3 2691 B9R0.8 CC\C=C\C(O)C(=O)OC Amb32663237 [1,1,0,0,0,0|0,0,2]=4 2692 B9R0.8 CN(CCCO)C(=O)CS Amb27982262 [1,1,0,0,0,0|2,0,0]=4 2693 B9R0.8 CNC(=O)C(Br)CCCBr Amb27632799 [1,1,0,0,0,0|2,0,0]=4 2694 B9R0.8 CNC(=O)C(C)CCCN Amb27167461 [1,1,0,0,0,0|1,0,0]=3 2695 B9R0.8 CNC(=O)C(C)NCCF Amb27239508 [1,1,0,0,0,0|2,0,0]=4 2696 B9R0.8 CNC(=O)C(N)CCOC Amb18311406 [1,1,0,0,0,0|2,0,0]=4 2697 B9R0.8 CNC(=O)C(N)CCSC Amb23443538 [1,1,0,0,0,0|2,0,0]=4 2698 B9R0.8 CNC(=O)C(N)CCSC Amb32666291 [1,1,0,0,0,0|2,0,0]=4 2699 B9R0.8 CNC(=O)N(C)CCCBr Amb27971575 [1,1,0,0,0,0|2,0,0]=4 2700 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb17232422 [1,1,0,0,0,0|2,0,0]=4 2701 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb32653153 [1,1,0,0,0,0|2,0,0]=4 2702 B9R0.8 CNC(=O)[C@H](N)CCSC Amb27600839 [1,1,0,0,0,0|2,0,0]=4 2703 B9R0.8 CNCCC(N)C(=O)OC Amb32993440 [1,1,0,0,0,0|2,0,0]=4 2704 B9R0.8 CNCCN(C)C(=O)OC Amb25853559 [1,1,0,0,0,0|2,0,0]=4 2705 B9R0.8 COC(=O)C(Br)CCCBr Amb10071878 [1,1,0,0,0,0|2,0,0]=4 2706 B9R0.8 COC(=O)C(C)CCCCl Amb27626035 [1,1,0,0,0,0|1,0,0]=3 2707 B9R0.8 COC(=O)C(C)CCCN Amb25904967 [1,1,0,0,0,0|1,0,0]=3 2708 B9R0.8 COC(=O)C(C)CSSC Amb27969893 [1,1,0,0,0,0|2,0,0]=4 2709 B9R0.8 COC(=O)C(C)NCCF Amb25032140 [1,1,0,0,0,0|2,0,0]=4 2710 B9R0.8 COC(=O)C(C)NCCN Amb27426861 [1,1,0,0,0,0|2,0,0]=4 2711 B9R0.8 COC(=O)C(C)NCCO Amb28137392 [1,1,0,0,0,0|2,0,0]=4 2712 B9R0.8 COC(=O)C(Cl)CCSC Amb18327893 [1,1,0,0,0,0|2,0,0]=4 2713 B9R0.8 COC(=O)C(N)CCCF Amb26857313 [1,1,0,0,0,0|2,0,0]=4 2714 B9R0.8 COC(=O)C(N)CCCN Amb9871379 [1,1,0,0,0,0|2,0,0]=4 2715 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [1,1,0,0,0,0|2,0,0]=4 2716 B9R0.8 COC(=O)C(N)CCCS Amb27974600 [1,1,0,0,0,0|2,0,0]=4 2717 B9R0.8 COC(=O)C(N)CCSC Amb1152979 [1,1,0,0,0,0|2,0,0]=4 2718 B9R0.8 COC(=O)C(N)CCSC Amb2720119 [1,1,0,0,0,0|2,0,0]=4 2719 B9R0.8 COC(=O)C(O)CCCBr Amb24759864 [1,1,0,0,0,0|1,0,0]=3 2720 B9R0.8 COC(=O)C(O)CCCCl Amb24480606 [1,1,0,0,0,0|1,0,0]=3 2721 B9R0.8 COC(=O)C(O)CCCF Amb33196109 [1,1,0,0,0,0|1,0,0]=3 2722 B9R0.8 COC(=O)C(O)CCSC Amb18800831 [1,1,0,0,0,0|1,0,0]=3 2723 B9R0.8 COC(=O)C(S)CCCCl Amb27984780 [1,1,0,0,0,0|1,1,0]=4 2724 B9R0.8 COC(=O)N(C)CCCCl Amb27494070 [1,1,0,0,0,0|2,0,0]=4 2725 B9R0.8 COC(=O)N(C)CCCN Amb6670337 [1,1,0,0,0,0|2,0,0]=4 2726 B9R0.8 COC(=O)[C@@H](N)CCCN Amb16236222 [1,1,0,0,0,0|2,0,0]=4 2727 B9R0.8 COC(=O)[C@@H](N)CCCO Amb27260220 [1,1,0,0,0,0|2,0,0]=4 2728 B9R0.8 COC(=O)[C@@H](N)CCSC Amb533934 [1,1,0,0,0,0|2,0,0]=4 2729 B9R0.8 COC(=O)[C@@H](N)CCSC Amb8390413 [1,1,0,0,0,0|2,0,0]=4 2730 B9R0.8 COC(=O)[C@@H](O)CCSC Amb28066926 [1,1,0,0,0,0|1,0,0]=3 2731 B9R0.8 COC(=O)[C@H](N)CCSC Amb3939028 [1,1,0,0,0,0|2,0,0]=4 2732 B9R0.8 COC(=O)[C@H](N)CCSC Amb9826085 [1,1,0,0,0,0|2,0,0]=4 2733 B9R0.8 COC(=O)[C@H](O)CCCO Amb27766582 [1,1,0,0,0,0|1,0,0]=3 2734 B9R0.8 COC(=O)[C@H](O)CCSC Amb28207376 [1,1,0,0,0,0|1,0,0]=3 2735 B9R0.8 COCCC(N)C(=O)OC Amb24053179 [1,1,0,0,0,0|2,0,0]=4 2736 B9R0.8 COCCC(N)C(=O)OC Amb28555457 [1,1,0,0,0,0|2,0,0]=4 2737 B9R0.8 COCCC(O)C(=O)OC Amb26933750 [1,1,0,0,0,0|1,0,0]=3 2738 B9R0.8 COCCN(C)C(=O)CBr Amb27971849 [1,1,0,0,0,0|2,0,0]=4 2739 B9R0.8 COCCN(C)C(=O)CCl Amb17232571 [1,1,0,0,0,0|2,0,0]=4 2740 B9R0.8 COCCN(C)C(=O)CN Amb17232010 [1,1,0,0,0,0|2,0,0]=4 2741 B9R0.8 COCC[C@H](N)C(=O)OC Amb27880632 [1,1,0,0,0,0|2,0,0]=4 2742 B9R0.8 COCNC(C)C(=O)OC Amb27838101 [1,1,0,0,0,0|2,0,0]=4 2743 B9R0.8 COCSC(C)C(=O)OC Amb27204212 [1,1,0,0,0,0|2,0,0]=4 2744 B9R0.8 CONC[C@@H](O)C(=O)OC Amb28078805 [1,1,0,0,0,0|2,0,0]=4 2745 B9R0.8 CSCCC(O)C(=O)NO Amb28188916 [1,1,0,0,0,0|2,0,0]=4 2746 B9R0.8 C\C=C(/C)C(O)CCCC Amb27946271 [1,1,0,0,0,0|1,0,0]=3 2747 B9R0.8 C\C=C(/Cl)C(O)CCCC Amb27455885 [1,1,0,0,0,0|1,0,0]=3 2748 B9R0.8 C\C=C(/Cl)C(O)COCC Amb27220167 [1,1,0,0,0,0|2,0,0]=4 2749 B9R0.8 C\C=C\CC(O)C(=O)OC Amb27588872 [1,1,0,0,0,0|0,0,2]=4 2750 B9R0.8 O=C(CO)[C@H](O)CCCO Amb27427126 [1,1,0,0,0,0|1,0,0]=3 2751 B9R0.42 C=C(C)C(N)CC(C)CC Amb28064517 [1,1,0,0,0,0|2,0,0]=4 2752 B9R0.42 C=C(C)[C@@H](O)CC(=O)CC Amb28126621 [1,1,0,0,0,0|1,0,1]=4 2753 B9R0.42 C=C(C)[C@H](O)CC(=O)CC Amb27760878 [1,1,0,0,0,0|1,0,1]=4 2754 B9R0.42 C=C(C[C@@H](C)CC)C(C)=O Amb26853718 [1,1,0,0,0,0|0,0,2]=4 2755 B9R0.42 C=C[C@H](C)C[C@@H](C)C(C)=O Amb27787532 [1,1,0,0,0,0|0,0,2]=4 2756 B9R0.42 CC(=O)C(C)CC(C)C#N Amb18643436 [1,1,0,0,0,0|1,0,1]=4 2757 B9R0.42 CC(=O)C(C)CC(O)CO Amb27616537 [1,1,0,0,0,0|1,0,0]=3 2758 B9R0.42 CC(=O)C(C)OC(C)CN Amb18110684 [1,1,0,0,0,0|2,0,0]=4 2759 B9R0.42 CC(=O)C(O)CC(O)CO Amb28049878 [1,1,0,0,0,0|1,0,0]=3 2760 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [1,1,0,0,0,0|2,0,0]=4 2761 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [1,1,0,0,0,0|2,0,0]=4 2762 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [1,1,0,0,0,0|1,0,1]=4 2763 B9R0.42 CCC(=O)OC(C)C(C)=O Amb26063123 [1,1,0,0,0,0|1,0,1]=4 2764 B9R0.42 CCC(C)CC(Br)C(C)=O Amb27224857 [1,1,0,0,0,0|1,0,0]=3 2765 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [1,1,0,0,0,0|1,0,0]=3 2766 B9R0.42 CCC(C)CC(C)C(C)C Amb27455148 [1,1,0,0,0,0|1,0,1]=4 2767 B9R0.42 CCC(C)CC(C)C(C)N Amb27953251 [1,1,0,0,0,0|1,0,1]=4 2768 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [1,1,0,0,0,0|0,0,2]=4 2769 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [1,1,0,0,0,0|2,0,0]=4 2770 B9R0.42 CCC(C)CC(Cl)C(N)=O Amb27669368 [1,1,0,0,0,0|2,0,0]=4 2771 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [1,1,0,0,0,0|2,0,0]=4 2772 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [1,1,0,0,0,0|2,0,0]=4 2773 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [1,1,0,0,0,0|2,0,0]=4 2774 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [1,1,0,0,0,0|1,0,0]=3 2775 B9R0.42 CCC(C)CC(O)C(C)C Amb27396277 [1,1,0,0,0,0|1,0,1]=4 2776 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [1,1,0,0,0,0|1,1,0]=4 2777 B9R0.42 CCC(C)CN(C)C(=O)Cl Amb27837817 [1,1,0,0,0,0|2,0,0]=4 2778 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [1,1,0,0,0,0|1,0,0]=3 2779 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [1,1,0,0,0,0|2,0,0]=4 2780 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [1,1,0,0,0,0|1,0,0]=3 2781 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [1,1,0,0,0,0|2,0,0]=4 2782 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [1,1,0,0,0,0|2,0,0]=4 2783 B9R0.42 CCC(C)NC(C)C(N)=O Amb9203258 [1,1,0,0,0,0|2,0,0]=4 2784 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [1,1,0,0,0,0|2,0,0]=4 2785 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [1,1,0,0,0,0|2,0,0]=4 2786 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [1,1,0,0,0,0|2,0,0]=4 2787 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [1,1,0,0,0,0|2,0,0]=4 2788 B9R0.42 CCC(N)CC(C)C(C)C Amb27255759 [1,1,0,0,0,0|1,0,1]=4 2789 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [1,1,0,0,0,0|2,0,0]=4 2790 B9R0.42 CCC(N)C[C@H](O)[C@H](C)O Amb27473755 [1,1,0,0,0,0|0,0,2]=4 2791 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [1,1,0,0,0,0|1,0,0]=3 2792 B9R0.42 CCC(O)CC(C)C(C)O Amb28126010 [1,1,0,0,0,0|0,0,2]=4 2793 B9R0.42 CCC(O)CC(C)N(C)C Amb27969032 [1,1,0,0,0,0|2,0,0]=4 2794 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [1,1,0,0,0,0|2,0,0]=4 2795 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [1,1,0,0,0,0|2,0,0]=4 2796 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [1,1,0,0,0,0|2,0,0]=4 2797 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [1,1,0,0,0,0|1,0,0]=3 2798 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [1,1,0,0,0,0|2,0,0]=4 2799 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [1,1,0,0,0,0|2,0,0]=4 2800 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [1,1,0,0,0,0|2,0,0]=4 2801 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [1,1,0,0,0,0|2,0,0]=4 2802 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [1,1,0,0,0,0|2,0,0]=4 2803 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [1,1,0,0,0,0|2,0,0]=4 2804 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [1,1,0,0,0,0|1,0,0]=3 2805 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [1,1,0,0,0,0|1,0,0]=3 2806 B9R0.42 CC[C@@H](N)C[C@H](O)C(C)C Amb19929611 [1,1,0,0,0,0|1,0,1]=4 2807 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [1,1,0,0,0,0|1,0,0]=3 2808 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [1,1,0,0,0,0|2,0,0]=4 2809 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [1,1,0,0,0,0|1,0,0]=3 2810 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [1,1,0,0,0,0|2,0,0]=4 2811 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [1,1,0,0,0,0|2,0,0]=4 2812 B9R0.42 CC[C@H](C)\C=C(/C)C(C)=O Amb24586848 [1,1,0,0,0,0|0,0,2]=4 2813 B9R0.42 CC[C@H](N)C[C@H](O)C(C)C Amb19929612 [1,1,0,0,0,0|1,0,1]=4 2814 B9R0.42 CNC(C)CC(C)S(C)=O Amb27437059 [1,1,0,0,0,0|2,0,0]=4 2815 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [1,1,0,0,0,0|1,0,1]=4 2816 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [1,1,0,0,0,0|1,0,1]=4 2817 B9R0.42 COC(C)CC(C)C(C)=O Amb27841945 [1,1,0,0,0,0|1,0,0]=3 2818 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [1,1,0,0,0,0|2,0,0]=4 2819 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [1,1,0,0,0,0|2,0,0]=4 2820 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [1,1,0,0,0,0|2,0,0]=4 2821 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [1,1,0,0,0,0|2,0,0]=4 2822 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [1,1,0,0,0,0|2,0,0]=4 2823 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [1,1,0,0,0,0|2,0,0]=4 2824 B9R0.47 C#CCCCC(C)C(C)=O Amb25965398 [1,1,0,0,0,0|0,0,1]=3 2825 B9R0.47 C=C(C)C(C)OCCCC Amb27595789 [1,1,0,0,0,0|1,0,0]=3 2826 B9R0.47 C=C(C)C(N)CCCOC Amb28455830 [1,1,0,0,0,0|2,0,0]=4 2827 B9R0.47 C=C(C)C(O)CC#CCC Amb27839251 [1,1,0,0,0,0|1,0,1]=4 2828 B9R0.47 C=C(C)C(O)CCCCO Amb27765710 [1,1,0,0,0,0|1,0,0]=3 2829 B9R0.47 C=C(C)C(O)CCCSC Amb27978956 [1,1,0,0,0,0|1,0,0]=3 2830 B9R0.47 C=C(C)C(O)CC\C=C\C Amb27839343 [1,1,0,0,0,0|1,0,1]=4 2831 B9R0.47 C=C(C)[C@@H](O)CCCCC Amb28065257 [1,1,0,0,0,0|1,0,0]=3 2832 B9R0.47 C=C(Cl)C(C)CCCCO Amb27260219 [1,1,0,0,0,0|1,0,1]=4 2833 B9R0.47 C=CCCCC(C)C(C)=O Amb27839019 [1,1,0,0,0,0|0,0,1]=3 2834 B9R0.47 C=CCCCN(C)C(C)=O Amb24627578 [1,1,0,0,0,0|1,0,1]=4 2835 B9R0.47 C=CCCC[C@@H](O)C(C)=O Amb27453672 [1,1,0,0,0,0|0,0,1]=3 2836 B9R0.47 C=CCCOC(C)C(C)=O Amb27979070 [1,1,0,0,0,0|0,0,2]=4 2837 B9R0.47 CC#CCCC(C)C(=O)O Amb27412753 [1,1,0,0,0,0|1,0,1]=4 2838 B9R0.47 CC#CCCC(O)C(=O)O Amb27615159 [1,1,0,0,0,0|1,0,1]=4 2839 B9R0.47 CC#CCOC(C)C(C)=O Amb27437779 [1,1,0,0,0,0|0,0,2]=4 2840 B9R0.47 CC#CCSC(C)C(C)=O Amb28348863 [1,1,0,0,0,0|0,0,2]=4 2841 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [1,1,0,0,0,0|0,0,0]=2 2842 B9R0.47 CC(=O)C(C)OCCCN Amb18111504 [1,1,0,0,0,0|1,0,0]=3 2843 B9R0.47 CC(=O)C(C)SCCC#N Amb18927758 [1,1,0,0,0,0|1,0,1]=4 2844 B9R0.47 CC(=O)C(C)SCCCF Amb27424937 [1,1,0,0,0,0|1,0,0]=3 2845 B9R0.47 CC(=O)C(C)SCCCS Amb28200050 [1,1,0,0,0,0|1,0,0]=3 2846 B9R0.47 CC(=O)N(C)CCCCBr Amb27860570 [1,1,0,0,0,0|1,0,0]=3 2847 B9R0.47 CC(C)=C(C)CCCCBr Amb32690232 [1,1,0,0,0,0|1,0,1]=4 2848 B9R0.47 CC(C)=C(C)CCCCCl Amb32690231 [1,1,0,0,0,0|1,0,1]=4 2849 B9R0.47 CC(C)=C(C)CCCCO Amb26895794 [1,1,0,0,0,0|1,0,1]=4 2850 B9R0.47 CC(C)C(O)CCCCF Amb27425079 [1,1,0,0,0,0|1,0,1]=4 2851 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [1,1,0,0,0,0|1,0,0]=3 2852 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [1,1,0,0,0,0|1,0,0]=3 2853 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [1,1,0,0,0,0|1,0,0]=3 2854 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [1,1,0,0,0,0|1,0,0]=3 2855 B9R0.47 CC(CCCCO)N(C)C Amb27959595 [1,1,0,0,0,0|2,0,0]=4 2856 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [1,1,0,0,0,0|2,0,0]=4 2857 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [1,1,0,0,0,0|2,0,0]=4 2858 B9R0.47 CC(CNCCN)S(C)=O Amb27458530 [1,1,0,0,0,0|2,0,0]=4 2859 B9R0.47 CC(CNCCO)C(N)=O Amb9358396 [1,1,0,0,0,0|2,0,0]=4 2860 B9R0.47 CC(CNCCO)S(C)=O Amb27245628 [1,1,0,0,0,0|2,0,0]=4 2861 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [1,1,0,0,0,0|2,0,0]=4 2862 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [1,1,0,0,0,0|2,0,0]=4 2863 B9R0.47 CC(NCCCF)C(N)=O Amb28136243 [1,1,0,0,0,0|2,0,0]=4 2864 B9R0.47 CC(NCCCO)C(N)=O Amb9246629 [1,1,0,0,0,0|2,0,0]=4 2865 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [1,1,0,0,0,0|2,0,0]=4 2866 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [1,1,0,0,0,0|2,0,0]=4 2867 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [1,1,0,0,0,0|2,0,0]=4 2868 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [1,1,0,0,0,0|2,0,0]=4 2869 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [1,1,0,0,0,0|2,0,0]=4 2870 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [1,1,0,0,0,0|1,0,0]=3 2871 B9R0.47 CCCCCC(C)=C(C)C Amb22228299 [1,1,0,0,0,0|1,0,1]=4 2872 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [1,1,0,0,0,0|1,0,0]=3 2873 B9R0.47 CCCCCC(C)C(C)C Amb10069375 [1,1,0,0,0,0|1,0,1]=4 2874 B9R0.47 CCCCCC(C)C(C)N Amb27155602 [1,1,0,0,0,0|1,0,1]=4 2875 B9R0.47 CCCCCC(C)[C@@H](C)N Amb33738432 [1,1,0,0,0,0|1,0,1]=4 2876 B9R0.47 CCCCCC(C)[C@H](C)N Amb33745259 [1,1,0,0,0,0|1,0,1]=4 2877 B9R0.47 CCCCCC(C)[N+](=O)[O-] Amb25059956 [1,1,0,0,0,0|2,0,0]=4 2878 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [1,1,0,0,0,0|2,0,0]=4 2879 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [1,1,0,0,0,0|2,0,0]=4 2880 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [1,1,0,0,0,0|2,0,0]=4 2881 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [1,1,0,0,0,0|2,0,0]=4 2882 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [1,1,0,0,0,0|1,0,0]=3 2883 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [1,1,0,0,0,0|0,0,0]=2 2884 B9R0.47 CCCCCC(O)C(C)C Amb4036433 [1,1,0,0,0,0|1,0,1]=4 2885 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [1,1,0,0,0,0|0,0,2]=4 2886 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [1,1,0,0,0,0|1,1,0]=4 2887 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [1,1,0,0,0,0|2,0,0]=4 2888 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [1,1,0,0,0,0|0,0,0]=2 2889 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [1,1,0,0,0,0|2,0,0]=4 2890 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [1,1,0,0,0,0|1,0,0]=3 2891 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [1,1,0,0,0,0|0,0,0]=2 2892 B9R0.47 CCCCC[C@@H](O)[C@H](C)Br Amb28049949 [1,1,0,0,0,0|1,0,1]=4 2893 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [1,1,0,0,0,0|2,0,0]=4 2894 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [1,1,0,0,0,0|1,0,0]=3 2895 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [1,1,0,0,0,0|2,0,0]=4 2896 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [1,1,0,0,0,0|2,0,0]=4 2897 B9R0.47 CCCCC[C@H](O)C(C)C Amb28064175 [1,1,0,0,0,0|1,0,1]=4 2898 B9R0.47 CCCCC[C@H](O)[C@@H](C)N Amb27488726 [1,1,0,0,0,0|1,0,1]=4 2899 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [1,1,0,0,0,0|0,0,2]=4 2900 B9R0.47 CCCCNC(=O)C(C)=O Amb17399878 [1,1,0,0,0,0|0,0,2]=4 2901 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [1,1,0,0,0,0|1,0,0]=3 2902 B9R0.47 CCCCNC(C)C(C)Cl Amb27424247 [1,1,0,0,0,0|1,0,1]=4 2903 B9R0.47 CCCCNC(C)C(C)O Amb27874111 [1,1,0,0,0,0|0,0,2]=4 2904 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [1,1,0,0,0,0|1,0,0]=3 2905 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [1,1,0,0,0,0|1,0,0]=3 2906 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [1,1,0,0,0,0|1,0,0]=3 2907 B9R0.47 CCCCOC(C)C(=N)N Amb27393859 [1,1,0,0,0,0|2,0,0]=4 2908 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [1,1,0,0,0,0|1,0,0]=3 2909 B9R0.47 CCCCOC(C)C(C)Cl Amb28383768 [1,1,0,0,0,0|1,0,1]=4 2910 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [1,1,0,0,0,0|1,0,0]=3 2911 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [1,1,0,0,0,0|1,1,0]=4 2912 B9R0.47 CCCCOC(C)[C@@H](C)N Amb27201179 [1,1,0,0,0,0|1,0,1]=4 2913 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [1,1,0,0,0,0|2,0,0]=4 2914 B9R0.47 CCCCOC(O)C(C)C Amb27764938 [1,1,0,0,0,0|1,0,1]=4 2915 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [1,1,0,0,0,0|1,0,0]=3 2916 B9R0.47 CCCCO[C@@H](C)[C@@H](C)O Amb28050639 [1,1,0,0,0,0|0,0,2]=4 2917 B9R0.47 CCCCO[C@@H](C)[C@H](C)O Amb27790251 [1,1,0,0,0,0|0,0,2]=4 2918 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [1,1,0,0,0,0|1,0,0]=3 2919 B9R0.47 CCCCSC(C)C(C)Cl Amb27424775 [1,1,0,0,0,0|1,0,1]=4 2920 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [1,1,0,0,0,0|2,0,0]=4 2921 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [1,1,0,0,0,0|2,0,0]=4 2922 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [1,1,0,0,0,0|1,0,0]=3 2923 B9R0.47 CCCCS[C@H](C)[C@@H](C)O Amb27835113 [1,1,0,0,0,0|0,0,2]=4 2924 B9R0.47 CCCC\C=C(/Cl)C(C)=O Amb27822638 [1,1,0,0,0,0|1,0,1]=4 2925 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [1,1,0,0,0,0|1,0,1]=4 2926 B9R0.47 CCCC\N=C(/Cl)C(C)=O Amb27861098 [1,1,0,0,0,0|1,0,1]=4 2927 B9R0.47 CCCNCC(C)N(C)C Amb28204516 [1,1,0,0,0,0|2,0,0]=4 2928 B9R0.47 CCCNCC(N)C(N)=O Amb27952357 [1,1,0,0,0,0|2,0,0]=4 2929 B9R0.47 CCCNCC(O)C(C)C Amb27427929 [1,1,0,0,0,0|1,0,1]=4 2930 B9R0.47 CCCNCC(O)C(N)=O Amb27875874 [1,1,0,0,0,0|1,0,0]=3 2931 B9R0.47 CCCN\C=C(/O)C(C)=O Amb27259606 [1,1,0,0,0,0|0,0,2]=4 2932 B9R0.47 CCCN\C=C(\C)C(C)=O Amb25244710 [1,1,0,0,0,0|0,0,2]=4 2933 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [1,1,0,0,0,0|2,0,0]=4 2934 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [1,1,0,0,0,0|2,0,0]=4 2935 B9R0.47 CCCOCC(N)C(N)=O Amb27155900 [1,1,0,0,0,0|2,0,0]=4 2936 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [1,1,0,0,0,0|2,0,0]=4 2937 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [1,1,0,0,0,0|2,0,0]=4 2938 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [1,1,0,0,0,0|0,0,0]=2 2939 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [1,1,0,0,0,0|2,0,0]=4 2940 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [1,1,0,0,0,0|2,0,0]=4 2941 B9R0.47 CCCSC[C@H](C)N(C)C Amb28349583 [1,1,0,0,0,0|2,0,0]=4 2942 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [1,1,0,0,0,0|2,0,0]=4 2943 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [1,1,0,0,0,0|1,0,1]=4 2944 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [1,1,0,0,0,0|1,0,1]=4 2945 B9R0.47 CCC\C=C\[C@H](O)C(C)=O Amb28139306 [1,1,0,0,0,0|0,0,1]=3 2946 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [1,1,0,0,0,0|1,0,0]=3 2947 B9R0.47 CCNCCC(C)C(C)C Amb27801731 [1,1,0,0,0,0|1,0,1]=4 2948 B9R0.47 CCNCCC(C)S(C)=O Amb27408727 [1,1,0,0,0,0|1,0,0]=3 2949 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [1,1,0,0,0,0|2,0,0]=4 2950 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [1,1,0,0,0,0|2,0,0]=4 2951 B9R0.47 CCOCCC(C)C(C)=O Amb27837597 [1,1,0,0,0,0|0,0,0]=2 2952 B9R0.47 CCOCCC(C)C(C)N Amb27837598 [1,1,0,0,0,0|1,0,1]=4 2953 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [1,1,0,0,0,0|2,0,0]=4 2954 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [1,1,0,0,0,0|2,0,0]=4 2955 B9R0.47 CCOCCC(N)C(C)=O Amb28055992 [1,1,0,0,0,0|1,0,0]=3 2956 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [1,1,0,0,0,0|2,0,0]=4 2957 B9R0.47 CCOCCN(C)C(=O)Cl Amb27228674 [1,1,0,0,0,0|2,0,0]=4 2958 B9R0.47 CCOCCN(C)C(N)=O Amb28137478 [1,1,0,0,0,0|2,0,0]=4 2959 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [1,1,0,0,0,0|2,0,0]=4 2960 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [1,1,0,0,0,0|2,0,0]=4 2961 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [1,1,0,0,0,0|2,0,0]=4 2962 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [1,1,0,0,0,0|2,0,0]=4 2963 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [1,1,0,0,0,0|2,0,0]=4 2964 B9R0.47 CCONCC(C)C(N)=O Amb28244659 [1,1,0,0,0,0|2,0,0]=4 2965 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [1,1,0,0,0,0|1,0,0]=3 2966 B9R0.47 CCSCCC(C)C(C)O Amb27762859 [1,1,0,0,0,0|0,0,2]=4 2967 B9R0.47 CCSCCC(Cl)C(N)=O Amb27614970 [1,1,0,0,0,0|2,0,0]=4 2968 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [1,1,0,0,0,0|2,0,0]=4 2969 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [1,1,0,0,0,0|2,0,0]=4 2970 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [1,1,0,0,0,0|1,0,0]=3 2971 B9R0.47 CCSCCC(O)C(N)=O Amb26926790 [1,1,0,0,0,0|1,0,0]=3 2972 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [1,1,0,0,0,0|2,0,0]=4 2973 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [1,1,0,0,0,0|2,0,0]=4 2974 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [1,1,0,0,0,0|1,0,1]=4 2975 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [1,1,0,0,0,0|2,0,0]=4 2976 B9R0.47 CN(CCCCO)C(N)=O Amb27452604 [1,1,0,0,0,0|2,0,0]=4 2977 B9R0.47 CN(CCCCO)S(C)=O Amb28192000 [1,1,0,0,0,0|2,0,0]=4 2978 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [1,1,0,0,0,0|2,0,0]=4 2979 B9R0.47 CNCCCN(C)C(N)=O Amb27446493 [1,1,0,0,0,0|2,0,0]=4 2980 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [1,1,0,0,0,0|2,0,0]=4 2981 B9R0.47 CNCCOC(C)C(C)=O Amb18111841 [1,1,0,0,0,0|1,0,0]=3 2982 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [1,1,0,0,0,0|1,0,0]=3 2983 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [1,1,0,0,0,0|0,0,0]=2 2984 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [1,1,0,0,0,0|1,0,0]=3 2985 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [1,1,0,0,0,0|2,0,0]=4 2986 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [1,1,0,0,0,0|2,0,0]=4 2987 B9R0.47 COCCCC(N)C(N)=O Amb26331697 [1,1,0,0,0,0|2,0,0]=4 2988 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [1,1,0,0,0,0|1,0,0]=3 2989 B9R0.47 COCCCN(C)C(=O)Cl Amb27837819 [1,1,0,0,0,0|2,0,0]=4 2990 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [1,1,0,0,0,0|2,0,0]=4 2991 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [1,1,0,0,0,0|2,0,0]=4 2992 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [1,1,0,0,0,0|2,0,0]=4 2993 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [1,1,0,0,0,0|2,0,0]=4 2994 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [1,1,0,0,0,0|2,0,0]=4 2995 B9R0.47 COCCNC(C)C(N)=O Amb9203267 [1,1,0,0,0,0|2,0,0]=4 2996 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [1,1,0,0,0,0|2,0,0]=4 2997 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [1,1,0,0,0,0|2,0,0]=4 2998 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [1,1,0,0,0,0|2,0,0]=4 2999 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [1,1,0,0,0,0|2,0,0]=4 3000 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [1,1,0,0,0,0|2,0,0]=4 3001 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [1,1,0,0,0,0|2,0,0]=4 3002 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [1,1,0,0,0,0|1,0,0]=3 3003 B9R0.47 CSCCCC(C)C(C)=O Amb27841950 [1,1,0,0,0,0|0,0,0]=2 3004 B9R0.47 CSCCCC(Cl)C(N)=O Amb27588927 [1,1,0,0,0,0|2,0,0]=4 3005 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [1,1,0,0,0,0|2,0,0]=4 3006 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [1,1,0,0,0,0|2,0,0]=4 3007 B9R0.47 CSCCCC(N)C(N)=O Amb27770389 [1,1,0,0,0,0|2,0,0]=4 3008 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [1,1,0,0,0,0|1,0,0]=3 3009 B9R0.47 CSCCCC(O)C(N)=O Amb27197765 [1,1,0,0,0,0|1,0,0]=3 3010 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [1,1,0,0,0,0|2,0,0]=4 3011 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [1,1,0,0,0,0|2,0,0]=4 3012 B9R0.47 CSCCNC(C)C(N)=O Amb27400757 [1,1,0,0,0,0|2,0,0]=4 3013 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [1,1,0,0,0,0|2,0,0]=4 3014 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [1,1,0,0,0,0|2,0,0]=4 3015 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [1,1,0,0,0,0|2,0,0]=4 3016 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [1,1,0,0,0,0|1,0,0]=3 3017 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [1,1,0,0,0,0|2,0,0]=4 3018 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [1,1,0,0,0,0|2,0,0]=4 3019 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [1,1,0,0,0,0|2,0,0]=4 3020 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [1,1,0,0,0,0|1,0,1]=4 3021 B9R0.47 NC(=O)C(N)CCCCBr Amb28313246 [1,1,0,0,0,0|2,0,0]=4 3022 B9R0.47 NC(=O)C(N)CCCCF Amb27977425 [1,1,0,0,0,0|2,0,0]=4 3023 B9R0.47 NC(=O)C(N)CCCCO Amb33065912 [1,1,0,0,0,0|2,0,0]=4 3024 B9R0.47 NC(=O)C(O)CNCCF Amb28320057 [1,1,0,0,0,0|2,0,0]=4 3025 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [1,1,0,0,0,0|2,0,0]=4 3026 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [1,1,0,0,0,0|2,0,0]=4 3027 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [1,1,0,0,0,0|2,0,0]=4 3028 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [1,1,0,0,0,0|2,0,0]=4 3029 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [1,1,0,0,0,0|2,0,0]=4 3030 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [1,1,0,0,0,0|2,0,0]=4 3031 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [1,1,0,0,0,0|2,0,0]=4 3032 B9R0.47 NCCCCC(N)C(N)=O Amb17593646 [1,1,0,0,0,0|2,0,0]=4 3033 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [1,1,0,0,0,0|2,0,0]=4 3034 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [1,1,0,0,0,0|2,0,0]=4 3035 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [1,1,0,0,0,0|2,0,0]=4 3036 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [1,1,0,0,0,0|2,0,0]=4 3037 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb27404620 [1,1,0,0,0,0|2,0,0]=4 3038 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [1,1,0,0,0,0|2,0,0]=4 3039 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [1,1,0,0,0,0|2,0,0]=4 3040 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [1,1,0,0,0,0|2,0,0]=4 3041 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [1,1,0,0,0,0|2,0,0]=4 3042 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [1,1,0,0,0,0|2,0,0]=4 3043 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [1,1,0,0,0,0|2,0,0]=4 3044 B9R0.47 NCCCC[C@H](N)C(N)=O Amb33757921 [1,1,0,0,0,0|2,0,0]=4 3045 B9R0.47 NCCSCC(O)C(=O)O Amb27789579 [1,1,0,0,0,0|2,0,0]=4 3046 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [1,1,0,0,0,0|2,0,0]=4 3047 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [1,1,0,0,0,0|2,0,0]=4 3048 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [1,1,0,0,0,0|2,0,0]=4 3049 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [1,1,0,0,0,0|2,0,0]=4 3050 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [1,1,0,0,0,0|2,0,0]=4 3051 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [1,1,0,0,0,0|2,0,0]=4 3052 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [1,1,0,0,0,0|2,0,0]=4 3053 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [1,1,0,0,0,0|1,0,0]=3 3054 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [1,1,0,0,0,0|2,0,0]=4 3055 B9R0.47 [C-]#[N+]CCCN(C)C(C)=O Amb27625151 [1,1,0,0,0,0|1,0,1]=4 3056 B9R0.51 C=C(C)C(C)(C)CCCBr Amb28422286 [1,1,0,0,0,0|2,0,0]=4 3057 B9R0.51 C=C(C)C(C)(O)CCCC Amb27191545 [1,1,0,0,0,0|1,0,0]=3 3058 B9R0.51 C=C(C)C(C)(O)CCCN Amb27759192 [1,1,0,0,0,0|2,0,0]=4 3059 B9R0.51 C=C(C)C(C)(O)CCNC Amb27950404 [1,1,0,0,0,0|2,0,0]=4 3060 B9R0.51 C=C(C)C(C)(O)CCOC Amb28124211 [1,1,0,0,0,0|2,0,0]=4 3061 B9R0.51 CC(=O)C(C)(C)CCC#N Amb18643431 [1,1,0,0,0,0|1,0,1]=4 3062 B9R0.51 CC(=O)C(C)(Cl)CCCCl Amb28244745 [1,1,0,0,0,0|1,0,0]=3 3063 B9R0.51 CC(=O)C(F)(F)CCCO Amb27838959 [1,1,0,0,0,0|2,0,0]=4 3064 B9R0.51 CC(C)(CCCCl)C(=O)O Amb27601953 [1,1,0,0,0,0|2,0,0]=4 3065 B9R0.51 CC(C)(CCCF)C(=O)O Amb28049560 [1,1,0,0,0,0|2,0,0]=4 3066 B9R0.51 CC(C)(CCCN)C(=O)O Amb26855022 [1,1,0,0,0,0|2,0,0]=4 3067 B9R0.51 CC(C)(CCCN)C(=O)O Amb27601033 [1,1,0,0,0,0|2,0,0]=4 3068 B9R0.51 CC(C)(CCCO)C(=O)O Amb28410873 [1,1,0,0,0,0|2,0,0]=4 3069 B9R0.51 CC(C)(CCCO)C(=O)[O-] Amb32674658 [1,1,0,0,0,0|2,0,0]=4 3070 B9R0.51 CC(N)(CCCF)C(=O)O Amb32670154 [1,1,0,0,0,0|2,0,0]=4 3071 B9R0.51 CC(N)(CCCN)C(=O)O Amb18644277 [1,1,0,0,0,0|2,0,0]=4 3072 B9R0.51 CC(N)(CCCN)C(=O)O Amb2697838 [1,1,0,0,0,0|2,0,0]=4 3073 B9R0.51 CC(O)(CCCF)C(=O)O Amb33196095 [1,1,0,0,0,0|2,0,0]=4 3074 B9R0.51 CCCCC(C)(Br)C(=O)O Amb28198025 [1,1,0,0,0,0|1,0,0]=3 3075 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [1,1,0,0,0,0|1,0,0]=3 3076 B9R0.51 CCCCC(C)(C)C(=O)O Amb2687527 [1,1,0,0,0,0|1,0,0]=3 3077 B9R0.51 CCCCC(C)(F)C(=O)O Amb24444856 [1,1,0,0,0,0|1,0,0]=3 3078 B9R0.51 CCCCC(C)(F)C(C)N Amb27617733 [1,1,0,0,0,0|1,0,1]=4 3079 B9R0.51 CCCCC(C)(N)C(=O)O Amb33743440 [1,1,0,0,0,0|1,0,0]=3 3080 B9R0.51 CCCCC(C)(N)C(=O)O Amb4134834 [1,1,0,0,0,0|1,0,0]=3 3081 B9R0.51 CCCCC(C)(N)C(C)C Amb18312893 [1,1,0,0,0,0|1,0,1]=4 3082 B9R0.51 CCCCC(C)(O)C(=O)O Amb17593657 [1,1,0,0,0,0|1,0,0]=3 3083 B9R0.51 CCCCC(C)(O)C(C)=O Amb27621354 [1,1,0,0,0,0|0,0,0]=2 3084 B9R0.51 CCCCC(C)(O)C(C)C Amb10807398 [1,1,0,0,0,0|1,0,1]=4 3085 B9R0.51 CCCCC(Cl)(Cl)C(=O)O Amb2720177 [1,1,0,0,0,0|2,0,0]=4 3086 B9R0.51 CCCCC(F)(F)C(=O)O Amb19929267 [1,1,0,0,0,0|2,0,0]=4 3087 B9R0.51 CCCCC(O)(O)C(=O)O Amb28059576 [1,1,0,0,0,0|1,0,0]=3 3088 B9R0.51 CCCC[C@@](C)(N)C(=O)O Amb26346904 [1,1,0,0,0,0|1,0,0]=3 3089 B9R0.51 CCCC[C@@](C)(O)C(=O)O Amb27221053 [1,1,0,0,0,0|1,0,0]=3 3090 B9R0.51 CCCC[C@@](C)(O)[C@H](C)Cl Amb27232769 [1,1,0,0,0,0|1,0,1]=4 3091 B9R0.51 CCCC[C@](C)(N)C(=O)O Amb25961122 [1,1,0,0,0,0|1,0,0]=3 3092 B9R0.51 CCCC[C@](C)(O)C(=O)O Amb27615053 [1,1,0,0,0,0|1,0,0]=3 3093 B9R0.51 CCCNC(C)(C)C(=O)O Amb9620095 [1,1,0,0,0,0|2,0,0]=4 3094 B9R0.51 CCCSC(C)(C)C(=O)O Amb17501481 [1,1,0,0,0,0|2,0,0]=4 3095 B9R0.51 CCNCC(C)(C)C(N)=O Amb27248039 [1,1,0,0,0,0|2,0,0]=4 3096 B9R0.51 CCOCC(C)(C)C(=O)O Amb27810825 [1,1,0,0,0,0|2,0,0]=4 3097 B9R0.51 CCOCC(C)(N)C(=O)O Amb27404396 [1,1,0,0,0,0|2,0,0]=4 3098 B9R0.51 CCOCC(C)(N)C(N)=O Amb27253744 [1,1,0,0,0,0|2,0,0]=4 3099 B9R0.51 CCOCC(C)(O)C(=O)O Amb27949919 [1,1,0,0,0,0|2,0,0]=4 3100 B9R0.51 CCOCC(C)(O)C(N)=O Amb28350523 [1,1,0,0,0,0|2,0,0]=4 3101 B9R0.51 CCSCC(C)(C)C(=O)O Amb26439975 [1,1,0,0,0,0|2,0,0]=4 3102 B9R0.51 CCSCC(C)(N)C(=O)O Amb18788224 [1,1,0,0,0,0|2,0,0]=4 3103 B9R0.51 COCCC(C)(C)C(=O)O Amb19029437 [1,1,0,0,0,0|2,0,0]=4 3104 B9R0.51 COCCC(C)(Cl)C(=O)O Amb27878699 [1,1,0,0,0,0|2,0,0]=4 3105 B9R0.51 COCCC(C)(O)C(=O)O Amb23454643 [1,1,0,0,0,0|2,0,0]=4 3106 B9R0.51 COCC[C@](C)(N)C(=O)O Amb27425033 [1,1,0,0,0,0|2,0,0]=4 3107 B9R0.51 CSCCC(C)(C)C(=O)O Amb10844081 [1,1,0,0,0,0|2,0,0]=4 3108 B9R0.51 CSCCC(C)(O)C(=O)O Amb33271718 [1,1,0,0,0,0|2,0,0]=4 3109 B9R0.51 CSCC[C@@](C)(N)C(=O)O Amb24482190 [1,1,0,0,0,0|2,0,0]=4 3110 B9R0.51 C[C@@](N)(CCCN)C(=O)O Amb27468967 [1,1,0,0,0,0|2,0,0]=4 3111 B9R0.51 C[C@](O)(CCCO)C(=O)O Amb27252130 [1,1,0,0,0,0|2,0,0]=4 3112 B9R0.51 C\C=C\C[C@@](C)(O)C(C)=O Amb26946376 [1,1,0,0,0,0|0,0,2]=4 3113 B9R0.26 CCC(C)CC(C#N)CO Amb27485258 [1,1,0,0,0,0|1,0,1]=4 3114 B9R0.26 CCC(C)CC(C=O)OC Amb28313381 [1,1,0,0,0,0|2,0,0]=4 3115 B9R0.26 CCC(C)CC(CC)CBr Amb24703678 [1,1,0,0,0,0|1,0,1]=4 3116 B9R0.26 CCC(C)CC(CC)CCl Amb28322618 [1,1,0,0,0,0|1,0,1]=4 3117 B9R0.26 CCC(C)CC(CC)CO Amb27227430 [1,1,0,0,0,0|0,0,1]=3 3118 B9R0.26 CCC(C)CC(CC)NO Amb28282079 [1,1,0,0,0,0|1,0,1]=4 3119 B9R0.26 CCC(C)CC(CN)NC Amb27212083 [1,1,0,0,0,0|2,0,0]=4 3120 B9R0.26 CCC(C)CC(CN)OC Amb27484072 [1,1,0,0,0,0|2,0,0]=4 3121 B9R0.26 CCC(C)N[C@@H](CC)CO Amb28319469 [1,1,0,0,0,0|1,0,1]=4 3122 B9R0.26 CCN(C)CC(CO)NC Amb27967910 [1,1,0,0,0,0|2,0,0]=4 3123 B9R0.37 C=CC(CO)C(=O)CCC Amb28200047 [1,1,0,0,0,0|0,0,2]=4 3124 B9R0.37 CCCC(=O)C(CC)CO Amb17593634 [1,1,0,0,0,0|0,0,2]=4 3125 B9R0.37 CCCC(C)C(CC)CBr Amb24653182 [1,1,0,0,0,0|1,0,1]=4 3126 B9R0.37 CCCC(C)C(CC)CCl Amb24739181 [1,1,0,0,0,0|1,0,1]=4 3127 B9R0.37 CCCC(C)C(CC)NC Amb27212601 [1,1,0,0,0,0|2,0,0]=4 3128 B9R0.37 CCCC(C)C(CN)CO Amb24481096 [1,1,0,0,0,0|1,0,1]=4 3129 B9R0.37 CCCC(C)C(CN)OC Amb26889112 [1,1,0,0,0,0|2,0,0]=4 3130 B9R0.37 CCCC(C)C(CN)SC Amb27258908 [1,1,0,0,0,0|2,0,0]=4 3131 B9R0.37 CCCC(Cl)C(CC)CO Amb28385538 [1,1,0,0,0,0|0,0,1]=3 3132 B9R0.37 CCCC(N)C(CC)CCl Amb27777323 [1,1,0,0,0,0|1,0,1]=4 3133 B9R0.37 CCCC(N)C(CC)CN Amb18124708 [1,1,0,0,0,0|1,0,1]=4 3134 B9R0.37 CCCC(N)C(CO)OC Amb27486726 [1,1,0,0,0,0|1,0,0]=3 3135 B9R0.37 CCCC(O)C(C=O)CC Amb17593630 [1,1,0,0,0,0|1,0,0]=3 3136 B9R0.37 CCCC(O)C(CC)CN Amb24501748 [1,1,0,0,0,0|1,0,1]=4 3137 B9R0.37 CCCC(O)C(CC)CO Amb2818284 [1,1,0,0,0,0|0,0,1]=3 3138 B9R0.37 CCCC(O)C(CC)CS Amb27762712 [1,1,0,0,0,0|0,1,1]=4 3139 B9R0.37 CCC[C@@H](N)[C@H](CC)CO Amb27814796 [1,1,0,0,0,0|0,0,1]=3 3140 B9R0.37 CCC[C@@H](O)C(CC)CC Amb27618515 [1,1,0,0,0,0|1,0,1]=4 3141 B9R0.37 CCC[C@@H](O)[C@@H](C=O)CC Amb27768596 [1,1,0,0,0,0|1,0,0]=3 3142 B9R0.37 CCC[C@H](N)C(CC)CC Amb27984076 [1,1,0,0,0,0|1,0,1]=4 3143 B9R0.37 CCC[C@H](O)C(CC)CC Amb27192098 [1,1,0,0,0,0|1,0,1]=4 3144 B9R0.37 CCC[C@H](O)[C@@H](C=O)CC Amb27615124 [1,1,0,0,0,0|1,0,0]=3 3145 B9R0.37 CCOC(C)C(C=O)CC Amb18124685 [1,1,0,0,0,0|2,0,0]=4 3146 B9R0.37 CCOC(C)C(CC)CO Amb28453472 [1,1,0,0,0,0|1,0,1]=4 3147 B9R0.37 CNC(CO)C(C)COC Amb27655271 [1,1,0,0,0,0|2,0,0]=4 3148 B9R0.37 CN[C@H](CO)[C@H](O)CSC Amb27985847 [1,1,0,0,0,0|2,0,0]=4 3149 B9R0.37 COCC(N)C(CO)OC Amb28457012 [1,1,0,0,0,0|2,0,0]=4 3150 B9R0.37 COCC(N)C(CO)SC Amb28381699 [1,1,0,0,0,0|2,0,0]=4 3151 B9R0.37 COC[C@H](O)[C@H](CO)OC Amb28399642 [1,1,0,0,0,0|2,0,0]=4 3152 B9R0.40 C#CCC(CO)CCCC Amb27617209 [1,1,0,0,0,0|0,0,2]=4 3153 B9R0.40 C=CC(CCCC)CNC Amb27770600 [1,1,0,0,0,0|1,0,1]=4 3154 B9R0.40 C=CC(CCCO)COC Amb27424919 [1,1,0,0,0,0|1,0,1]=4 3155 B9R0.40 C=CCC(C=O)CCCCl Amb27592487 [1,1,0,0,0,0|2,0,0]=4 3156 B9R0.40 C=CCC(C=O)CCOC Amb27851965 [1,1,0,0,0,0|2,0,0]=4 3157 B9R0.40 C=CCC(CBr)CCCC Amb27267257 [1,1,0,0,0,0|1,0,1]=4 3158 B9R0.40 C=CCC(CCl)CCCC Amb27249760 [1,1,0,0,0,0|1,0,1]=4 3159 B9R0.40 C=CCC(CO)CCCO Amb27765655 [1,1,0,0,0,0|1,0,1]=4 3160 B9R0.40 C=CCC(CO)COCC Amb27267347 [1,1,0,0,0,0|1,0,1]=4 3161 B9R0.40 C=CC[C@H](C=O)CCCC Amb27401115 [1,1,0,0,0,0|1,0,0]=3 3162 B9R0.40 CCCC(CO)CCCO Amb27424905 [1,1,0,0,0,0|1,0,1]=4 3163 B9R0.40 CCCCC(C#N)NC=O Amb27259085 [1,1,0,0,0,0|1,0,1]=4 3164 B9R0.40 CCCCC(C=O)CCC Amb27237029 [1,1,0,0,0,0|1,0,0]=3 3165 B9R0.40 CCCCC(C=O)OCC Amb27261094 [1,1,0,0,0,0|1,0,0]=3 3166 B9R0.40 CCCCC(CBr)CCC Amb26369676 [1,1,0,0,0,0|1,0,1]=4 3167 B9R0.40 CCCCC(CBr)OCC Amb27655012 [1,1,0,0,0,0|1,0,1]=4 3168 B9R0.40 CCCCC(CC)CC#N Amb4017615 [1,1,0,0,0,0|1,0,1]=4 3169 B9R0.40 CCCCC(CC)CC=O Amb22059367 [1,1,0,0,0,0|1,0,0]=3 3170 B9R0.40 CCCCC(CC)CCC Amb25335776 [1,1,0,0,0,0|1,0,1]=4 3171 B9R0.40 CCCCC(CC)CCN Amb28430735 [1,1,0,0,0,0|1,0,1]=4 3172 B9R0.40 CCCCC(CC)CCO Amb28293407 [1,1,0,0,0,0|0,0,1]=3 3173 B9R0.40 CCCCC(CC)CNC Amb9204013 [1,1,0,0,0,0|1,0,1]=4 3174 B9R0.40 CCCCC(CC)CON Amb27476658 [1,1,0,0,0,0|0,0,1]=3 3175 B9R0.40 CCCCC(CC)C[Mg]Br Amb22000562 [1,1,0,0,0,0|1,0,1]=4 3176 B9R0.40 CCCCC(CC)C[Zn]Br Amb22000364 [1,1,0,0,0,0|1,0,1]=4 3177 B9R0.40 CCCCC(CC)N=C=O Amb7786902 [1,1,0,0,0,0|1,0,1]=4 3178 B9R0.40 CCCCC(CC)NCC Amb28133928 [1,1,0,0,0,0|1,0,1]=4 3179 B9R0.40 CCCCC(CCCl)OC Amb28364152 [1,1,0,0,0,0|2,0,0]=4 3180 B9R0.40 CCCCC(CCl)CCC Amb25206828 [1,1,0,0,0,0|1,0,1]=4 3181 B9R0.40 CCCCC(CCl)OCC Amb28134086 [1,1,0,0,0,0|1,0,1]=4 3182 B9R0.40 CCCCC(CN)CCC Amb20632050 [1,1,0,0,0,0|1,0,1]=4 3183 B9R0.40 CCCCC(CN)OCC Amb27596490 [1,1,0,0,0,0|1,0,1]=4 3184 B9R0.40 CCCCC(CNC)OC Amb28386262 [1,1,0,0,0,0|2,0,0]=4 3185 B9R0.40 CCCCC(CO)CCC Amb26011965 [1,1,0,0,0,0|0,0,1]=3 3186 B9R0.40 CCCCC(CO)CCO Amb27810571 [1,1,0,0,0,0|0,0,1]=3 3187 B9R0.40 CCCCC(CO)N=[N+]=[N-] Amb24477259 [1,1,0,0,0,0|2,0,0]=4 3188 B9R0.40 CCCCC(CO)OCC Amb27216686 [1,1,0,0,0,0|0,0,1]=3 3189 B9R0.40 CCCCC(COC)NN Amb28050347 [1,1,0,0,0,0|2,0,0]=4 3190 B9R0.40 CCCCN(C=O)CCO Amb26609531 [1,1,0,0,0,0|1,0,0]=3 3191 B9R0.40 CCCCN(CO)CCO Amb27829883 [1,1,0,0,0,0|1,0,1]=4 3192 B9R0.40 CCCCN(COC)N=O Amb27881682 [1,1,0,0,0,0|2,0,0]=4 3193 B9R0.40 CCCC[C@@H](CC)CCO Amb27829957 [1,1,0,0,0,0|0,0,1]=3 3194 B9R0.40 CCCC[C@@H](CO)CCO Amb27665485 [1,1,0,0,0,0|0,0,1]=3 3195 B9R0.40 CCCC\C(=C\C=O)CC Amb27467797 [1,1,0,0,0,0|1,0,1]=4 3196 B9R0.40 CCCC\C(=C\CO)CO Amb27761569 [1,1,0,0,0,0|0,0,1]=3 3197 B9R0.40 CCCC\C(C=O)=C\OC Amb27841072 [1,1,0,0,0,0|0,0,2]=4 3198 B9R0.40 CCCNC(CC)COC Amb27622068 [1,1,0,0,0,0|1,0,1]=4 3199 B9R0.40 CCCN[C@H](CC)COC Amb27259719 [1,1,0,0,0,0|1,0,1]=4 3200 B9R0.40 CCCN[C@H](CO)CCC Amb27195642 [1,1,0,0,0,0|1,0,1]=4 3201 B9R0.40 CCCOC(C=O)CC=O Amb27268515 [1,1,0,0,0,0|1,0,1]=4 3202 B9R0.40 CCNC(CO)CCCO Amb27838837 [1,1,0,0,0,0|1,0,1]=4 3203 B9R0.40 CCNC(CO)CCOC Amb27839139 [1,1,0,0,0,0|1,0,1]=4 3204 B9R0.40 CCNC(CO)CSCC Amb27770375 [1,1,0,0,0,0|1,0,1]=4 3205 B9R0.40 CCNCC(CC)CCO Amb27837793 [1,1,0,0,0,0|1,0,1]=4 3206 B9R0.40 CCOC(C=O)CCCO Amb28050007 [1,1,0,0,0,0|2,0,0]=4 3207 B9R0.40 CCOC(C=O)CCSC Amb27955424 [1,1,0,0,0,0|2,0,0]=4 3208 B9R0.40 CCSCC(CCO)NC Amb28141426 [1,1,0,0,0,0|2,0,0]=4 3209 B9R0.40 CCSCC(CO)SCC Amb17594636 [1,1,0,0,0,0|1,0,1]=4 3210 B9R0.40 CC\C=C(/C=O)CCCC Amb27966532 [1,1,0,0,0,0|1,0,1]=4 3211 B9R0.40 COCC(C=O)OCCO Amb27760652 [1,1,0,0,0,0|2,0,0]=4 3212 B9R0.40 COCC(CCCBr)OC Amb32689778 [1,1,0,0,0,0|2,0,0]=4 3213 B9R0.40 COCC(CCCCl)OC Amb32690557 [1,1,0,0,0,0|2,0,0]=4 3214 B9R0.40 COCCC(CO)NC=O Amb27433889 [1,1,0,0,0,0|1,0,0]=3 3215 B9R0.40 COCCN(C=O)CCO Amb27607421 [1,1,0,0,0,0|2,0,0]=4 3216 B9R0.40 C\C=C(/CCO)CCCC Amb27839280 [1,1,0,0,0,0|0,0,1]=3 3217 B9R0.40 C\C=C\C(CO)CCCC Amb28050569 [1,1,0,0,0,0|0,0,0]=2 3218 B9R0.40 C\C=C\C(CO)CCCO Amb28344982 [1,1,0,0,0,0|1,0,0]=3 3219 B9R0.40 OCCC[C@@H](CO)CCO Amb28460677 [1,1,0,0,0,0|1,0,1]=4 3220 B9R0.40 [C-]#[N+]CC(CC)CCCC Amb33730142 [1,1,0,0,0,0|1,0,1]=4 3221 B9R0.43 CC(O)CC\C(=C\Cl)CO Amb27974248 [1,1,0,0,0,0|1,0,1]=4 3222 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [1,1,0,0,0,0|1,0,1]=4 3223 B9R0.43 CCC(C=O)CCC(C)C Amb27876026 [1,1,0,0,0,0|1,0,0]=3 3224 B9R0.43 CCC(CBr)CCC(C)C Amb25334410 [1,1,0,0,0,0|1,0,1]=4 3225 B9R0.43 CCC(CC)CCC(C)Br Amb27605501 [1,1,0,0,0,0|1,0,1]=4 3226 B9R0.43 CCC(CC)CCC(C)N Amb25147370 [1,1,0,0,0,0|1,0,1]=4 3227 B9R0.43 CCC(CC)CCC(C)O Amb4017702 [1,1,0,0,0,0|1,0,1]=4 3228 B9R0.43 CCC(CC)CC[C@@H](C)N Amb33313778 [1,1,0,0,0,0|1,0,1]=4 3229 B9R0.43 CCC(CC)CC[C@@H](C)O Amb28350101 [1,1,0,0,0,0|1,0,1]=4 3230 B9R0.43 CCC(CC)CC[C@H](C)N Amb33313777 [1,1,0,0,0,0|1,0,1]=4 3231 B9R0.43 CCC(CC)CC[C@H](C)O Amb33313780 [1,1,0,0,0,0|1,0,1]=4 3232 B9R0.43 CCC(CCC(C)Cl)OC Amb27617114 [1,1,0,0,0,0|2,0,0]=4 3233 B9R0.43 CCC(CCC(C)N)OC Amb26580036 [1,1,0,0,0,0|2,0,0]=4 3234 B9R0.43 CCC(CCC(C)O)OC Amb28050767 [1,1,0,0,0,0|2,0,0]=4 3235 B9R0.43 CCC(CC[C@@H](C)N)OC Amb33325782 [1,1,0,0,0,0|2,0,0]=4 3236 B9R0.43 CCC(CC[C@@H](C)O)OC Amb33325784 [1,1,0,0,0,0|2,0,0]=4 3237 B9R0.43 CCC(CC[C@H](C)N)OC Amb33224358 [1,1,0,0,0,0|2,0,0]=4 3238 B9R0.43 CCC(CC[C@H](C)O)OC Amb33325785 [1,1,0,0,0,0|2,0,0]=4 3239 B9R0.43 CCC(CCl)CCC(C)C Amb25726963 [1,1,0,0,0,0|1,0,1]=4 3240 B9R0.43 CCC(CO)CCC(C)=O Amb8395984 [1,1,0,0,0,0|0,0,2]=4 3241 B9R0.43 CCC(CO)CCC(C)C Amb28126755 [1,1,0,0,0,0|0,0,1]=3 3242 B9R0.43 CCC(CO)CCC(C)O Amb8395987 [1,1,0,0,0,0|0,0,1]=3 3243 B9R0.43 CCC(CO)CCS(C)=O Amb27874513 [1,1,0,0,0,0|1,0,1]=4 3244 B9R0.43 CCC(CO)NCC(C)C Amb4304060 [1,1,0,0,0,0|1,0,1]=4 3245 B9R0.43 CCC(CO)NCC(C)O Amb27399907 [1,1,0,0,0,0|1,0,1]=4 3246 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [1,1,0,0,0,0|1,0,1]=4 3247 B9R0.43 CNC(CN)CCC(C)C Amb28436977 [1,1,0,0,0,0|2,0,0]=4 3248 B9R0.43 CNC(CO)CCN(C)C Amb25299372 [1,1,0,0,0,0|2,0,0]=4 3249 B9R0.43 CNC(CO)COC(C)C Amb27236680 [1,1,0,0,0,0|2,0,0]=4 3250 B9R0.43 CNC(CO)COC(C)C Amb33526859 [1,1,0,0,0,0|2,0,0]=4 3251 B9R0.43 CNC(CO)CSC(C)C Amb27796847 [1,1,0,0,0,0|2,0,0]=4 3252 B9R0.43 COC(CN)CCC(C)C Amb25975513 [1,1,0,0,0,0|2,0,0]=4 3253 B9R0.43 COC(CO)CCC(C)C Amb27770508 [1,1,0,0,0,0|1,0,0]=3 3254 B9R0.50 C=CC(CBr)CCOCC Amb27440911 [1,1,0,0,0,0|1,0,1]=4 3255 B9R0.50 C=CC(CO)CCCCC Amb27977343 [1,1,0,0,0,0|0,0,1]=3 3256 B9R0.50 C=CC(CO)CCCCO Amb27664638 [1,1,0,0,0,0|0,0,1]=3 3257 B9R0.50 C=CC(CO)CC\C=C\C Amb27615147 [1,1,0,0,0,0|0,0,2]=4 3258 B9R0.50 C=CCCCC(C=C)CO Amb27615184 [1,1,0,0,0,0|0,0,2]=4 3259 B9R0.50 C=CCCC[C@@H](CO)OC Amb27448855 [1,1,0,0,0,0|1,0,1]=4 3260 B9R0.50 CC#CCC[C@H](C=O)CC Amb27619210 [1,1,0,0,0,0|1,0,1]=4 3261 B9R0.50 CCC(C=O)CCCC=O Amb27262880 [1,1,0,0,0,0|1,0,1]=4 3262 B9R0.50 CCC(CBr)CCCOC Amb27424787 [1,1,0,0,0,0|1,0,1]=4 3263 B9R0.50 CCC(CBr)CCCSC Amb24373300 [1,1,0,0,0,0|1,0,1]=4 3264 B9R0.50 CCC(CC)CCCCBr Amb27460595 [1,1,0,0,0,0|1,0,1]=4 3265 B9R0.50 CCC(CC)CCCCCl Amb27823192 [1,1,0,0,0,0|1,0,1]=4 3266 B9R0.50 CCC(CC)CCCCN Amb24373288 [1,1,0,0,0,0|1,0,1]=4 3267 B9R0.50 CCC(CC)CCCCO Amb26581149 [1,1,0,0,0,0|1,0,1]=4 3268 B9R0.50 CCC(CC)CCCNC Amb26964323 [1,1,0,0,0,0|1,0,1]=4 3269 B9R0.50 CCC(CC)CCCNC Amb28555603 [1,1,0,0,0,0|1,0,1]=4 3270 B9R0.50 CCC(CCCCN)OC Amb25959007 [1,1,0,0,0,0|2,0,0]=4 3271 B9R0.50 CCC(CCCCO)OC Amb27617717 [1,1,0,0,0,0|2,0,0]=4 3272 B9R0.50 CCC(CCl)CCCOC Amb24509529 [1,1,0,0,0,0|1,0,1]=4 3273 B9R0.50 CCC(CCl)CCCSC Amb26363204 [1,1,0,0,0,0|1,0,1]=4 3274 B9R0.50 CCC(CO)CCCCO Amb27770514 [1,1,0,0,0,0|0,0,1]=3 3275 B9R0.50 CCC(CO)NCCCN Amb27770580 [1,1,0,0,0,0|1,0,1]=4 3276 B9R0.50 CCC(CO)NCCSC Amb28188146 [1,1,0,0,0,0|1,0,1]=4 3277 B9R0.50 CCCCCC(C=O)CC Amb25883306 [1,1,0,0,0,0|1,0,0]=3 3278 B9R0.50 CCCCCC(C=O)SC Amb27841692 [1,1,0,0,0,0|2,0,0]=4 3279 B9R0.50 CCCCCC(CC)CBr Amb26369673 [1,1,0,0,0,0|1,0,1]=4 3280 B9R0.50 CCCCCC(CC)CC Amb22229275 [1,1,0,0,0,0|1,0,1]=4 3281 B9R0.50 CCCCCC(CC)CCl Amb26369462 [1,1,0,0,0,0|1,0,1]=4 3282 B9R0.50 CCCCCC(CC)CO Amb27831173 [1,1,0,0,0,0|0,0,1]=3 3283 B9R0.50 CCCCCC(CC)OC Amb27425019 [1,1,0,0,0,0|2,0,0]=4 3284 B9R0.50 CCCCCC(CN)CO Amb27465223 [1,1,0,0,0,0|1,0,1]=4 3285 B9R0.50 CCCCCC(CN)OC Amb25989930 [1,1,0,0,0,0|2,0,0]=4 3286 B9R0.50 CCCCCC(CN)SC Amb27249496 [1,1,0,0,0,0|2,0,0]=4 3287 B9R0.50 CCCCCC(CO)CS Amb27839186 [1,1,0,0,0,0|0,1,1]=4 3288 B9R0.50 CCCCCC(CO)SC Amb27457183 [1,1,0,0,0,0|1,0,0]=3 3289 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [1,1,0,0,0,0|1,0,0]=3 3290 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [1,1,0,0,0,0|0,0,1]=3 3291 B9R0.50 CCCCNC(CC)CBr Amb28198883 [1,1,0,0,0,0|1,0,1]=4 3292 B9R0.50 CCCCNC(CC)CO Amb4304056 [1,1,0,0,0,0|0,0,1]=3 3293 B9R0.50 CCCCN[C@@H](CC)CO Amb28369528 [1,1,0,0,0,0|0,0,1]=3 3294 B9R0.50 CCCCOC(CC)CBr Amb5494000 [1,1,0,0,0,0|1,0,1]=4 3295 B9R0.50 CCCCOC(CC)CO Amb26324075 [1,1,0,0,0,0|0,0,1]=3 3296 B9R0.50 CCCCOC(CN)CO Amb32721464 [1,1,0,0,0,0|1,0,1]=4 3297 B9R0.50 CCCCOC(CO)CCl Amb28042708 [1,1,0,0,0,0|1,0,1]=4 3298 B9R0.50 CCCCOC(CO)CO Amb28050521 [1,1,0,0,0,0|0,0,2]=4 3299 B9R0.50 CCCCOC(CO)OC Amb27606709 [1,1,0,0,0,0|1,0,0]=3 3300 B9R0.50 CCCCSC(C=O)CC Amb27799813 [1,1,0,0,0,0|1,0,0]=3 3301 B9R0.50 CCCCSC(CC)CC Amb28349735 [1,1,0,0,0,0|1,0,1]=4 3302 B9R0.50 CCCC\C=C(/C=O)CCl Amb28319228 [1,1,0,0,0,0|1,0,1]=4 3303 B9R0.50 CCCNCC(CC)CC Amb6262228 [1,1,0,0,0,0|1,0,1]=4 3304 B9R0.50 CCCNCC(CC)OC Amb27229568 [1,1,0,0,0,0|2,0,0]=4 3305 B9R0.50 CCCOCC(CC)CBr Amb26554699 [1,1,0,0,0,0|1,0,1]=4 3306 B9R0.50 CCCOCC(CC)CCl Amb32689897 [1,1,0,0,0,0|1,0,1]=4 3307 B9R0.50 CCCOCC(CO)NC Amb27448150 [1,1,0,0,0,0|1,0,0]=3 3308 B9R0.50 CCCSCC(CO)NC Amb27839117 [1,1,0,0,0,0|1,0,0]=3 3309 B9R0.50 CCNCCN(C=O)CC Amb18124697 [1,1,0,0,0,0|2,0,0]=4 3310 B9R0.50 CCOCCC(CC)CBr Amb27443425 [1,1,0,0,0,0|1,0,1]=4 3311 B9R0.50 CCOCCC(CC)CCl Amb25292235 [1,1,0,0,0,0|1,0,1]=4 3312 B9R0.50 CCOCCC(CO)NC Amb27615062 [1,1,0,0,0,0|1,0,0]=3 3313 B9R0.50 CCOCCN(C=O)CC Amb28123303 [1,1,0,0,0,0|2,0,0]=4 3314 B9R0.50 CCSCCC(CC)CBr Amb24373774 [1,1,0,0,0,0|1,0,1]=4 3315 B9R0.50 CCSCCC(CC)CCl Amb26613421 [1,1,0,0,0,0|1,0,1]=4 3316 B9R0.50 CCSCCC(CN)NC Amb28207879 [1,1,0,0,0,0|2,0,0]=4 3317 B9R0.50 CCSCCC(CN)OC Amb27260637 [1,1,0,0,0,0|2,0,0]=4 3318 B9R0.50 CCSCCC(CO)NC Amb27839120 [1,1,0,0,0,0|1,0,0]=3 3319 B9R0.50 CC[C@H](CO)NCCOC Amb27437256 [1,1,0,0,0,0|1,0,1]=4 3320 B9R0.50 COC(CN)CCCSC Amb25769675 [1,1,0,0,0,0|2,0,0]=4 3321 B9R0.50 COCCCC(C#N)CO Amb27982323 [1,1,0,0,0,0|1,0,1]=4 3322 B9R0.50 COCCCC(CO)CO Amb27219939 [1,1,0,0,0,0|0,0,2]=4 3323 B9R0.50 COCCOC(CO)OC Amb28350083 [1,1,0,0,0,0|2,0,0]=4 3324 B9R0.50 CSCCCC(C#N)CO Amb28250573 [1,1,0,0,0,0|1,0,1]=4 3325 B9R0.50 CSCCCC(CN)CO Amb28136196 [1,1,0,0,0,0|1,0,1]=4 3326 B9R0.50 C\C=C\CCC(C=O)CO Amb24721770 [1,1,0,0,0,0|0,0,1]=3 3327 B9R0.67 C=CC(C)(CBr)CCCC Amb24692426 [1,1,0,0,0,0|1,0,1]=4 3328 B9R0.67 C=CC(C)(CCl)CCCC Amb25207483 [1,1,0,0,0,0|1,0,1]=4 3329 B9R0.67 C=CC(C)(CO)CCOC Amb27406994 [1,1,0,0,0,0|1,0,1]=4 3330 B9R0.67 C=CC(C)(CO)COCC Amb28184498 [1,1,0,0,0,0|1,0,1]=4 3331 B9R0.67 CCC(N)(CO)CCCF Amb32670174 [1,1,0,0,0,0|1,0,1]=4 3332 B9R0.67 CCCCC(C)(C#N)CO Amb27632871 [1,1,0,0,0,0|1,0,1]=4 3333 B9R0.67 CCCCC(C)(CC)CBr Amb26341117 [1,1,0,0,0,0|1,0,1]=4 3334 B9R0.67 CCCCC(C)(CC)CC Amb22229298 [1,1,0,0,0,0|1,0,1]=4 3335 B9R0.67 CCCCC(C)(CC)CCl Amb27215931 [1,1,0,0,0,0|1,0,1]=4 3336 B9R0.67 CCCCC(C)(CC)CN Amb27620592 [1,1,0,0,0,0|1,0,1]=4 3337 B9R0.67 CCCCC(C)(CC)CO Amb27768857 [1,1,0,0,0,0|0,0,1]=3 3338 B9R0.67 CCCCC(C)(CN)CO Amb28119476 [1,1,0,0,0,0|1,0,1]=4 3339 B9R0.67 CCCCC(C)(CN)OC Amb24682304 [1,1,0,0,0,0|2,0,0]=4 3340 B9R0.67 CCCCC(Cl)(C=O)CC Amb27854950 [1,1,0,0,0,0|1,0,0]=3 3341 B9R0.67 CCCCC(O)(CC)CC Amb4020057 [1,1,0,0,0,0|1,0,1]=4 3342 B9R0.67 CCCCC(O)(CC)CCl Amb28067715 [1,1,0,0,0,0|1,0,1]=4 3343 B9R0.67 CCCCC(O)(CC)CN Amb27668691 [1,1,0,0,0,0|1,0,1]=4 3344 B9R0.67 CCCSC(C)(CC)CO Amb28317994 [1,1,0,0,0,0|1,0,1]=4 3345 B9R0.67 CCOCC(C)(CC)CO Amb27245978 [1,1,0,0,0,0|1,0,1]=4 3346 B9R0.67 CCSCC(C)(CO)NC Amb28428518 [1,1,0,0,0,0|2,0,0]=4 3347 B9R0.67 CC[C@@](O)(CO)CCCO Amb27605418 [1,1,0,0,0,0|1,0,1]=4 3348 B9R0.67 CNC(C)(CO)CCSC Amb28043516 [1,1,0,0,0,0|2,0,0]=4 3349 B9R0.9 CP(C)(=O)C(CO)CCO Amb28065252 [1,1,0,0,0,0|2,0,0]=4 3350 B9R0.12 CCC(CCN)C(=O)OC Amb18831468 [1,1,0,0,0,0|2,0,0]=4 3351 B9R0.12 CCC(CCO)C(=O)OC Amb17593656 [1,1,0,0,0,0|2,0,0]=4 3352 B9R0.12 CCCC(C#N)C(=O)CC Amb27772534 [1,1,0,0,0,0|1,0,1]=4 3353 B9R0.12 CCCC(C#N)C(=O)NC Amb27393803 [1,1,0,0,0,0|1,0,1]=4 3354 B9R0.12 CCCC(CC)C(=O)OC Amb26855569 [1,1,0,0,0,0|1,0,0]=3 3355 B9R0.12 CCCC(CN)C(=O)NO Amb27185504 [1,1,0,0,0,0|2,0,0]=4 3356 B9R0.12 CCCC(CN)C(=O)OC Amb26516612 [1,1,0,0,0,0|1,0,0]=3 3357 B9R0.12 CCCC(NC)C(=O)OC Amb24116637 [1,1,0,0,0,0|2,0,0]=4 3358 B9R0.12 CCCC(NC)C(=O)OC Amb33735073 [1,1,0,0,0,0|2,0,0]=4 3359 B9R0.12 CCCN(CC)C(=O)CBr Amb28293236 [1,1,0,0,0,0|2,0,0]=4 3360 B9R0.12 CCCN(CC)C(=O)CC Amb27985699 [1,1,0,0,0,0|2,0,0]=4 3361 B9R0.12 CCCN(CC)C(=O)NC Amb27949128 [1,1,0,0,0,0|2,0,0]=4 3362 B9R0.12 CCCN(CCl)C(=O)SC Amb27444339 [1,1,0,0,0,0|2,0,0]=4 3363 B9R0.12 CCC[C@@H](CO)[C@H](N)CO Amb27883607 [1,1,0,0,0,0|1,0,1]=4 3364 B9R0.12 CCC[C@H](CN)C(=O)OC Amb27655535 [1,1,0,0,0,0|1,0,0]=3 3365 B9R0.12 CCC[C@H](NC)C(=O)OC Amb25980086 [1,1,0,0,0,0|2,0,0]=4 3366 B9R0.12 CCNC(CC)C(=O)OC Amb25324244 [1,1,0,0,0,0|2,0,0]=4 3367 B9R0.12 CCNC(CC)C(=O)OC Amb32753847 [1,1,0,0,0,0|2,0,0]=4 3368 B9R0.12 CCNC(CN)C(=O)OC Amb27830264 [1,1,0,0,0,0|2,0,0]=4 3369 B9R0.12 CCNC(CO)C(=O)OC Amb27407880 [1,1,0,0,0,0|1,0,0]=3 3370 B9R0.12 CCN[C@@H](CO)C(=O)OC Amb27468731 [1,1,0,0,0,0|1,0,0]=3 3371 B9R0.12 CCSC(CCl)C(=O)NC Amb27847751 [1,1,0,0,0,0|2,0,0]=4 3372 B9R0.12 CCSC(CCl)C(=O)OC Amb27407080 [1,1,0,0,0,0|2,0,0]=4 3373 B9R0.12 CNC(=O)C(CS)CCS Amb28364319 [1,1,0,0,0,0|1,1,0]=4 3374 B9R0.12 COC(=O)C(CN)CCF Amb33196108 [1,1,0,0,0,0|2,0,0]=4 3375 B9R0.12 COC(=O)C(CN)CSC Amb33271729 [1,1,0,0,0,0|2,0,0]=4 3376 B9R0.12 COC(=O)C(CO)CCF Amb27481856 [1,1,0,0,0,0|1,0,0]=3 3377 B9R0.12 COCC(CN)C(=O)OC Amb33428674 [1,1,0,0,0,0|2,0,0]=4 3378 B9R0.12 C\C=N\[C@@H](CO)C(=O)OC Amb27481118 [1,1,0,0,0,0|1,0,1]=4 3379 B9R0.12 [C-]#[N+]C(CCC)C(=O)OC Amb2688986 [1,1,0,0,0,0|2,0,0]=4 3380 B9R0.12 [C-]#[N+][C@@H](CCC)C(=O)OC Amb33747505 [1,1,0,0,0,0|2,0,0]=4 3381 B9R0.12 [C-]#[N+][C@H](CCC)C(=O)OC Amb33747252 [1,1,0,0,0,0|2,0,0]=4 3382 B9R0.15 C=CCC(CCC)C(=O)O Amb17619617 [1,1,0,0,0,0|2,0,0]=4 3383 B9R0.15 C=CCC(CCC)C(N)=O Amb28050033 [1,1,0,0,0,0|2,0,0]=4 3384 B9R0.15 C=CCC(OCC)C(C)=O Amb25088299 [1,1,0,0,0,0|2,0,0]=4 3385 B9R0.15 CC(=O)C(CCN)CCN Amb27591645 [1,1,0,0,0,0|2,0,0]=4 3386 B9R0.15 CC(=O)N(CCO)CCO Amb17232028 [1,1,0,0,0,0|2,0,0]=4 3387 B9R0.15 CCCC(CC=O)C(=O)O Amb27786319 [1,1,0,0,0,0|1,0,1]=4 3388 B9R0.15 CCCC(CCC)C(=O)Cl Amb3939568 [1,1,0,0,0,0|2,0,0]=4 3389 B9R0.15 CCCC(CCC)C(=O)I Amb27478658 [1,1,0,0,0,0|2,0,0]=4 3390 B9R0.15 CCCC(CCC)C(=O)O Amb3940097 [1,1,0,0,0,0|2,0,0]=4 3391 B9R0.15 CCCC(CCC)C(=O)[O-] Amb3499360 [1,1,0,0,0,0|2,0,0]=4 3392 B9R0.15 CCCC(CCC)C(C)=O Amb25146280 [1,1,0,0,0,0|1,0,0]=3 3393 B9R0.15 CCCC(CCC)C(N)=O Amb6336479 [1,1,0,0,0,0|2,0,0]=4 3394 B9R0.15 CCCC(CCCl)C(=O)O Amb27427463 [1,1,0,0,0,0|2,0,0]=4 3395 B9R0.15 CCCC(CCF)C(=O)O Amb27837855 [1,1,0,0,0,0|2,0,0]=4 3396 B9R0.15 CCCC(CCN)C(=O)O Amb33756786 [1,1,0,0,0,0|2,0,0]=4 3397 B9R0.15 CCCC(CCO)C(C)N Amb27794045 [1,1,0,0,0,0|1,0,1]=4 3398 B9R0.15 CCCC(NCC)C(=O)O Amb9496319 [1,1,0,0,0,0|2,0,0]=4 3399 B9R0.15 CCCC(OCC)C(=O)O Amb28050125 [1,1,0,0,0,0|2,0,0]=4 3400 B9R0.15 CCCC(OCC)C(C)=O Amb26475888 [1,1,0,0,0,0|1,0,0]=3 3401 B9R0.15 CCCC(SCC)C(=O)[O-] Amb2610616 [1,1,0,0,0,0|2,0,0]=4 3402 B9R0.15 CCCC(SCC)C(N)=O Amb27983703 [1,1,0,0,0,0|2,0,0]=4 3403 B9R0.15 CCCN(CCC)C(C)=O Amb2721240 [1,1,0,0,0,0|2,0,0]=4 3404 B9R0.15 CCCN(CCO)S(C)=O Amb27617568 [1,1,0,0,0,0|2,0,0]=4 3405 B9R0.15 CCC[C@@H](NCC)C(=O)O Amb33347491 [1,1,0,0,0,0|2,0,0]=4 3406 B9R0.15 CCC[C@H](NCC)C(=O)O Amb33347483 [1,1,0,0,0,0|2,0,0]=4 3407 B9R0.15 CCC\C(=N/OC)C(C)=O Amb28201036 [1,1,0,0,0,0|1,0,1]=4 3408 B9R0.15 CCN[C@H](COC)C(=O)O Amb33347499 [1,1,0,0,0,0|2,0,0]=4 3409 B9R0.15 CCOC(COC)C(=O)O Amb28348050 [1,1,0,0,0,0|2,0,0]=4 3410 B9R0.15 CCOC(OCC)C(C)=O Amb28050208 [1,1,0,0,0,0|2,0,0]=4 3411 B9R0.15 CC\C=C(/CCC)C(C)=O Amb27802632 [1,1,0,0,0,0|1,0,1]=4 3412 B9R0.15 CC\C=C(/CCO)C(C)=O Amb28145901 [1,1,0,0,0,0|0,0,2]=4 3413 B9R0.15 CSCC(NCO)C(=O)O Amb28137810 [1,1,0,0,0,0|2,0,0]=4 3414 B9R0.15 O=C(O)C(CCO)CCBr Amb24616904 [1,1,0,0,0,0|2,0,0]=4 3415 B9R0.29 CCC(=O)C(CC)C(C)=O Amb17593598 [1,1,0,0,0,0|1,0,1]=4 3416 B9R0.29 CCC(C(=O)O)[C@@H](C)CC Amb28050112 [1,1,0,0,0,0|2,0,0]=4 3417 B9R0.29 CCC(C)C(CC)C(C)=O Amb25775510 [1,1,0,0,0,0|1,0,0]=3 3418 B9R0.29 CCC(C)C(CC)C(N)=O Amb17621194 [1,1,0,0,0,0|2,0,0]=4 3419 B9R0.29 CCC(C)C(CN)C(=O)O Amb25978406 [1,1,0,0,0,0|2,0,0]=4 3420 B9R0.29 CCC(C)C(CN)C(N)=O Amb32418136 [1,1,0,0,0,0|2,0,0]=4 3421 B9R0.29 CCC(C)C(CO)N(C)C Amb24116652 [1,1,0,0,0,0|2,0,0]=4 3422 B9R0.29 CCC(C)\C(=N\O)C(C)=O Amb28052556 [1,1,0,0,0,0|1,0,1]=4 3423 B9R0.29 CCC(N)C(CC)C(=O)O Amb28041915 [1,1,0,0,0,0|2,0,0]=4 3424 B9R0.29 CCC(O)C(CC)C(=O)O Amb18310733 [1,1,0,0,0,0|2,0,0]=4 3425 B9R0.29 CC[C@H](C(=O)O)[C@H](N)CC Amb27461449 [1,1,0,0,0,0|2,0,0]=4 3426 B9R0.29 CC[C@H](C)[C@@H](CC)C(N)=O Amb26024210 [1,1,0,0,0,0|2,0,0]=4 3427 B9R0.29 CC[C@H](C)[C@H](CC)C(=O)O Amb28340911 [1,1,0,0,0,0|2,0,0]=4 3428 B9R0.33 CC(=O)C(CCF)C(C)C Amb27239507 [1,1,0,0,0,0|2,0,0]=4 3429 B9R0.33 CC(O)C(CCO)C(N)=O Amb27467700 [1,1,0,0,0,0|2,0,0]=4 3430 B9R0.33 CCCC(C(=O)O)C(=O)O Amb8384909 [1,1,0,0,0,0|1,0,1]=4 3431 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [1,1,0,0,0,0|2,0,0]=4 3432 B9R0.33 CCCC(C(=O)O)C(C)N Amb33036414 [1,1,0,0,0,0|2,0,0]=4 3433 B9R0.33 CCCC(C(=O)O)C(C)O Amb26422276 [1,1,0,0,0,0|1,0,0]=3 3434 B9R0.33 CCCC(C(=O)O)S(C)=O Amb27255158 [1,1,0,0,0,0|1,0,1]=4 3435 B9R0.33 CCCC(C(C)=O)C(N)=O Amb24744722 [1,1,0,0,0,0|0,0,2]=4 3436 B9R0.33 CCCC(C(C)=O)N(C)C Amb27823561 [1,1,0,0,0,0|2,0,0]=4 3437 B9R0.33 CCCC(C(C)C)C(C)O Amb27602892 [1,1,0,0,0,0|1,0,1]=4 3438 B9R0.33 CCCC(C(C)O)C(C)O Amb28139893 [1,1,0,0,0,0|0,0,2]=4 3439 B9R0.33 CCCC(C(C)O)N(C)C Amb27604520 [1,1,0,0,0,0|2,0,0]=4 3440 B9R0.33 CCCC(C(N)=O)C(C)C Amb27770607 [1,1,0,0,0,0|2,0,0]=4 3441 B9R0.33 CCCN(C(C)=O)C(C)C Amb27647782 [1,1,0,0,0,0|2,0,0]=4 3442 B9R0.33 CCC[C@H](C(=O)O)[C@H](C)O Amb27221692 [1,1,0,0,0,0|1,0,0]=3 3443 B9R0.33 CCC\C(C(C)=O)=C(\C)O Amb28324383 [1,1,0,0,0,0|0,0,2]=4 3444 B9R0.33 CCN[C@H](C(=O)O)C(C)O Amb27629796 [1,1,0,0,0,0|2,0,0]=4 3445 B9R0.39 C=C(C)CC(CC)C(C)=O Amb28060802 [1,1,0,0,0,0|1,0,1]=4 3446 B9R0.39 CC(=O)\C(=C/O)CC(C)C Amb27752064 [1,1,0,0,0,0|0,0,2]=4 3447 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [1,1,0,0,0,0|2,0,0]=4 3448 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [1,1,0,0,0,0|2,0,0]=4 3449 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [1,1,0,0,0,0|1,0,0]=3 3450 B9R0.39 CC(C)CC(CO)C(C)C Amb27442839 [1,1,0,0,0,0|1,0,1]=4 3451 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [1,1,0,0,0,0|2,0,0]=4 3452 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [1,1,0,0,0,0|2,0,0]=4 3453 B9R0.39 CC(C)C[C@@H](CO)N(C)C Amb27451615 [1,1,0,0,0,0|2,0,0]=4 3454 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [1,1,0,0,0,0|2,0,0]=4 3455 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [1,1,0,0,0,0|2,0,0]=4 3456 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [1,1,0,0,0,0|2,0,0]=4 3457 B9R0.39 CC(C)NC(CO)C(N)=O Amb27838044 [1,1,0,0,0,0|2,0,0]=4 3458 B9R0.39 CC(C)[C@H](CO)C[C@@H](C)O Amb28126537 [1,1,0,0,0,0|1,0,1]=4 3459 B9R0.39 CC(Cl)CC(CN)C(=O)O Amb28396430 [1,1,0,0,0,0|2,0,0]=4 3460 B9R0.39 CCC(CC(C)=O)C(C)=O Amb27403023 [1,1,0,0,0,0|1,0,1]=4 3461 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [1,1,0,0,0,0|2,0,0]=4 3462 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [1,1,0,0,0,0|2,0,0]=4 3463 B9R0.39 CCN(CC(C)C)C(C)=O Amb27458275 [1,1,0,0,0,0|2,0,0]=4 3464 B9R0.39 CCN(CC(C)O)C(C)=O Amb27219905 [1,1,0,0,0,0|2,0,0]=4 3465 B9R0.39 CCN(C[C@@H](C)O)C(C)=O Amb28063653 [1,1,0,0,0,0|2,0,0]=4 3466 B9R0.39 CCN(C[C@H](C)O)C(C)=O Amb28281456 [1,1,0,0,0,0|2,0,0]=4 3467 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [1,1,0,0,0,0|2,0,0]=4 3468 B9R0.74 C=C(C)C(F)(CN)CCC Amb27880853 [1,1,0,0,0,0|2,0,0]=4 3469 B9R0.74 C=CC(C)(CCC)C(C)=O Amb27243851 [1,1,0,0,0,0|1,0,1]=4 3470 B9R0.74 C=CCC(C)(CO)C(C)=O Amb27267151 [1,1,0,0,0,0|0,0,2]=4 3471 B9R0.74 CCC(N)(COC)C(C)=O Amb27636316 [1,1,0,0,0,0|2,0,0]=4 3472 B9R0.74 CCCC(Br)(CC)C(=O)O Amb27614914 [1,1,0,0,0,0|2,0,0]=4 3473 B9R0.74 CCCC(C)(C#N)C(C)=O Amb22755418 [1,1,0,0,0,0|1,0,1]=4 3474 B9R0.74 CCCC(C)(C=O)C(C)=O Amb27643639 [1,1,0,0,0,0|0,0,2]=4 3475 B9R0.74 CCCC(C)(CC)C(=O)O Amb18311361 [1,1,0,0,0,0|2,0,0]=4 3476 B9R0.74 CCCC(C)(CO)C(C)C Amb27166282 [1,1,0,0,0,0|1,0,1]=4 3477 B9R0.74 CCCC(C)(CO)N(C)C Amb24116807 [1,1,0,0,0,0|2,0,0]=4 3478 B9R0.74 CCCC(Cl)(CO)[N+](=O)[O-] Amb27162234 [1,1,0,0,0,0|2,0,0]=4 3479 B9R0.74 CCCC(N)(CO)C(=O)O Amb27668101 [1,1,0,0,0,0|1,0,0]=3 3480 B9R0.74 CCCC(O)(CC)C(N)=O Amb27473850 [1,1,0,0,0,0|2,0,0]=4 3481 B9R0.74 CCC[C@@](C)(CC)C(=O)O Amb28119970 [1,1,0,0,0,0|2,0,0]=4 3482 B9R0.74 CCC[C@@](N)(CN)C(=O)O Amb27253064 [1,1,0,0,0,0|2,0,0]=4 3483 B9R0.74 CCC[C@](C)(CC)C(=O)O Amb28398097 [1,1,0,0,0,0|2,0,0]=4 3484 B9R0.74 CCC[C@](O)(CC)C(=O)O Amb27977076 [1,1,0,0,0,0|2,0,0]=4 3485 B9R0.74 CCNC(C)(CO)C(=O)O Amb28067321 [1,1,0,0,0,0|2,0,0]=4 3486 B9R0.74 COCC(C)(CO)C(C)=O Amb28324422 [1,1,0,0,0,0|1,0,0]=3 3487 B9R0.74 COCC(O)(CO)C(=O)O Amb27465024 [1,1,0,0,0,0|2,0,0]=4 3488 B9R0.74 NC(CO)(CCF)C(=O)O Amb32670159 [1,1,0,0,0,0|2,0,0]=4 3489 B11R0.56 CCCC(C)C(CN)CC(=O)O Amb33324098 [0,1,0,0,0,1|2,0,0]=4 3490 B11R0.77 CCCC#CC(CC)NC(C)=O Amb28120028 [0,1,0,0,0,1|1,0,1]=4 3491 B11R0.143 CC(=O)OCC(CO)OC(C)=O Amb19960032 [0,1,0,0,0,1|1,0,1]=4 3492 B11R0.143 CC(=O)OCC(CO)OC(C)=O Amb33987901 [0,1,0,0,0,1|1,0,1]=4 3493 B11R0.160 CC(=O)NC(CCCF)C(=O)O Amb33308610 [0,1,0,0,0,1|1,0,1]=4 3494 B11R0.160 CC(=O)NC(CCCO)C(=O)O Amb33036789 [0,1,0,0,0,1|1,0,1]=4 3495 B11R0.160 CCCCC(CC(=O)O)C(=O)O Amb17933248 [0,1,0,0,0,1|1,0,1]=4 3496 B11R0.160 CCCCC(NC(C)=O)C(=O)O Amb2732387 [0,1,0,0,0,1|0,0,1]=3 3497 B11R0.160 CCCCC(NC(N)=O)C(=O)O Amb9329824 [0,1,0,0,0,1|1,0,1]=4 3498 B11R0.160 CCCC[C@H](NC(C)=O)C(=O)O Amb2732388 [0,1,0,0,0,1|0,0,1]=3 3499 B11R0.160 CCOCC(NC(C)=O)C(=O)O Amb33308943 [0,1,0,0,0,1|1,0,1]=4 3500 B11R0.160 COCCC(NC(C)=O)C(=O)O Amb13952178 [0,1,0,0,0,1|1,0,1]=4 3501 B11R0.160 CSCCC(NC(C)=O)C(=O)O Amb9706349 [0,1,0,0,0,1|1,0,1]=4 3502 B11R0.160 CSCC[C@@H](NC(C)=O)C(=O)O Amb8629159 [0,1,0,0,0,1|1,0,1]=4 3503 B11R0.160 CSCC[C@H](NC(C)=O)C(=O)O Amb2720580 [0,1,0,0,0,1|1,0,1]=4 3504 B11R0.166 CCCCC(CC)CC(=O)CC Amb18802033 [0,1,0,0,0,1|1,0,0]=3 3505 B11R0.166 CCCCC(CN)CC(=O)OC Amb33428106 [0,1,0,0,0,1|1,0,0]=3 3506 B11R0.166 CCCC\C(=C\C(=O)OC)CC Amb33492878 [0,1,0,0,0,1|1,0,1]=4 3507 B11R0.166 CCSCC(CN)CC(=O)OC Amb33323719 [0,1,0,0,0,1|2,0,0]=4 3508 B11R0.166 COC(=O)CC(CN)CCSC Amb33198267 [0,1,0,0,0,1|2,0,0]=4 3509 B11R0.166 COCCC(CN)CC(=O)OC Amb33224044 [0,1,0,0,0,1|2,0,0]=4 3510 B11R0.190 CCCCC(CCl)OS(C)(=O)=O Amb27873282 [0,1,0,0,0,1|2,0,0]=4 3511 B11R0.216 CCCCC(N)(CC)CC(=O)O Amb33255462 [0,1,0,0,0,1|2,0,0]=4 3512 B11R0.216 CCCCC(N)(CC)CC(N)=O Amb33255017 [0,1,0,0,0,1|2,0,0]=4 3513 B11R0.216 CCCCC(O)(CN)CC(=O)O Amb33346940 [0,1,0,0,0,1|2,0,0]=4 3514 B11R0.153 CCCCCC(C(=O)O)C(=O)O Amb9786433 [0,2,0,0,0,0|1,0,1]=4 3515 B11R0.153 CCCCCC(C(=O)O)C(C)C Amb18794409 [0,2,0,0,0,0|2,0,0]=4 3516 B11R0.153 CCCCNC(C(=O)O)C(C)C Amb9327923 [0,2,0,0,0,0|2,0,0]=4 3517 B11R0.167 CCCCC(C(=O)OC)N(C)C Amb24116644 [0,2,0,0,0,0|2,0,0]=4 3518 B11R0.167 CCCNC(C(=O)OC)C(C)C Amb33529209 [0,2,0,0,0,0|2,0,0]=4 3519 B11R0.175 CCCC(C)C(C(=O)O)C(C)C Amb33323205 [0,2,0,0,0,0|2,0,0]=4 3520 B11R0.55 COCC(C)CC(CN)C(=O)O Amb32664169 [0,2,0,0,0,0|2,0,0]=4 3521 B11R0.55 COCC(C)CC(CN)C(=O)O Amb32664170 [0,2,0,0,0,0|2,0,0]=4 3522 B11R0.88 CCC(C)CC(ON)C(=O)OC Amb32660229 [0,2,0,0,0,0|2,0,0]=4 3523 B11R0.118 COC(=O)C(CN)CCN(C)C Amb33271967 [0,2,0,0,0,0|2,0,0]=4 3524 B11R0.118 COC(=O)C(CN)COC(C)C Amb33274113 [0,2,0,0,0,0|2,0,0]=4 3525 B11R0.146 CC(=O)N(CCO)CCC(C)C Amb18266501 [0,2,0,0,0,0|1,0,0]=3 3526 B11R0.371 CCC(C)(CCC(C)C)C(=O)O Amb16232095 [0,2,0,0,0,0|2,0,0]=4 3527 B11R0.38 CCCCC(N=C=O)C(=O)OC Amb33471485 [0,2,0,0,0,0|0,0,2]=4 3528 B11R0.38 CCCCC(N=C=S)C(=O)OC Amb19883886 [0,2,0,0,0,0|0,1,1]=4 3529 B11R0.53 CCCC(=O)C(CC)C(=O)OC Amb8390501 [0,2,0,0,0,0|1,0,1]=4 3530 B11R0.53 CCCC(C)C(CN)C(=O)OC Amb32954943 [0,2,0,0,0,0|1,0,0]=3 3531 B11R0.53 CCOC(C)C(CN)C(=O)OC Amb33425033 [0,2,0,0,0,0|2,0,0]=4 3532 B11R0.75 CCCCN[C@@H](CO)C(=O)OC Amb32412154 [0,2,0,0,0,0|0,0,0]=2 3533 B11R0.75 CCC\C=C\C(CN)C(=O)OC Amb33424814 [0,2,0,0,0,0|1,0,1]=4 3534 B11R0.132 CCCCC(CC)S(=O)(=O)NC Amb32692394 [0,2,0,0,0,0|2,0,0]=4 3535 B11R0.191 CCCCC(CC)C(=O)OCC Amb9339887 [0,2,0,0,0,0|1,0,0]=3 3536 B11R0.191 CCCCN(CC)C(=O)CCCl Amb6250621 [0,2,0,0,0,0|2,0,0]=4 3537 B11R0.191 CCCCN(CC)C(=O)CNC Amb6260977 [0,2,0,0,0,0|2,0,0]=4 3538 B11R0.191 CCCNC(CC)C(=O)OCC Amb28872376 [0,2,0,0,0,0|2,0,0]=4 3539 B11R0.76 CCCCCCC(CC)C(=O)O Amb18794406 [0,2,0,0,0,0|2,0,0]=4 3540 B11R0.78 CCCC(CCCCN)C(=O)O Amb28653062 [0,2,0,0,0,0|2,0,0]=4 3541 B11R0.78 CCCC(CCCCN)C(=O)O Amb8506428 [0,2,0,0,0,0|2,0,0]=4 3542 B11R0.78 CCCCCC(CCC)C(=O)O Amb18794407 [0,2,0,0,0,0|2,0,0]=4 3543 B11R0.273 CCC(SCCC(C)C)C(=O)O Amb17501350 [0,2,0,0,0,0|2,0,0]=4 3544 B11R0.329 CCCCCC(C)(CC)C(=O)O Amb18803025 [0,2,0,0,0,0|2,0,0]=4 3545 B11R0.36 CCCCC(CCCC)C(C)=O Amb4017818 [0,2,0,0,0,0|1,0,0]=3 3546 B11R0.36 CCCCN(CCCC)C(C)=O Amb6366485 [0,2,0,0,0,0|2,0,0]=4 3547 B11R0.36 CCCCN(CCCO)C(C)=O Amb18262963 [0,2,0,0,0,0|1,0,0]=3 3548 B11R0.356 CCCCC(CC)(CC)C(=O)O Amb18803023 [0,2,0,0,0,0|2,0,0]=4 3549 B9R1.5 C=C1CCCCCC1C Amb35681188 [1,0,0,1,0,0|1,0,0]=3 3550 B9R1.5 C=C1CCCCC[C@@H]1O Amb27456695 [1,0,0,1,0,0|1,0,0]=3 3551 B9R1.5 CC1=CCCCCC1O Amb27184844 [1,0,0,1,0,0|1,0,0]=3 3552 B9R1.5 CC1C=CCCCC1=O Amb27600759 [1,0,0,1,0,0|0,0,2]=4 3553 B9R1.5 CC1CCCC=CC1=O Amb27838624 [1,0,0,1,0,0|0,0,2]=4 3554 B9R1.5 CC1CCCCCC1=O Amb26348270 [1,0,0,1,0,0|0,0,0]=2 3555 B9R1.5 CC1CCCCCC1Br Amb18329569 [1,0,0,1,0,0|1,0,1]=4 3556 B9R1.5 CC1CCCCCC1Cl Amb27164800 [1,0,0,1,0,0|1,0,1]=4 3557 B9R1.5 CC1CCCCCC1N Amb33539533 [1,0,0,1,0,0|1,0,1]=4 3558 B9R1.5 CC1CCCCCC1O Amb27243169 [1,0,0,1,0,0|0,0,2]=4 3559 B9R1.5 CC1CCCCCC1S Amb32788094 [1,0,0,1,0,0|0,1,1]=4 3560 B9R1.5 CC1CCNCCC1=O Amb22886271 [1,0,0,1,0,0|1,0,0]=3 3561 B9R1.5 CC1CCNCCS1=O Amb25948110 [1,0,0,1,0,0|2,0,0]=4 3562 B9R1.5 CC1CCNCCS1=O Amb28555359 [1,0,0,1,0,0|2,0,0]=4 3563 B9R1.5 CC1CNCCNC1=O Amb27228560 [1,0,0,1,0,0|2,0,0]=4 3564 B9R1.5 CC1NCCCNC1=O Amb33545017 [1,0,0,1,0,0|2,0,0]=4 3565 B9R1.5 CC1SCCCCC1=O Amb28048147 [1,0,0,1,0,0|1,0,0]=3 3566 B9R1.5 CN1CCCCCC1=O Amb2779825 [1,0,0,1,0,0|1,0,0]=3 3567 B9R1.5 CN1CCCNCC1=O Amb15690772 [1,0,0,1,0,0|2,0,0]=4 3568 B9R1.5 CN1CCCNCC1=O Amb21960817 [1,0,0,1,0,0|2,0,0]=4 3569 B9R1.5 CN1CCNCCC1=O Amb16231373 [1,0,0,1,0,0|2,0,0]=4 3570 B9R1.5 CN1CCNCCC1=O Amb21959037 [1,0,0,1,0,0|2,0,0]=4 3571 B9R1.5 CN1CCNCCC1=O Amb28934999 [1,0,0,1,0,0|2,0,0]=4 3572 B9R1.5 C[C@@H]1CCCCC[C@@H]1N Amb28346949 [1,0,0,1,0,0|1,0,1]=4 3573 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [1,0,0,1,0,0|0,0,2]=4 3574 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [1,0,0,1,0,0|1,0,0]=3 3575 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [1,0,0,1,0,0|2,0,0]=4 3576 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [1,0,0,1,0,0|0,0,2]=4 3577 B9R1.5 C[C@H]1CCCCC[C@H]1Br Amb28428934 [1,0,0,1,0,0|1,0,1]=4 3578 B9R1.5 C[C@H]1CCCCC[C@H]1N Amb28388330 [1,0,0,1,0,0|1,0,1]=4 3579 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [1,0,0,1,0,0|0,0,2]=4 3580 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [1,0,0,1,0,0|2,0,0]=4 3581 B9R1.5 NC1CCCCCC1=O Amb18276126 [1,0,0,1,0,0|1,0,0]=3 3582 B9R1.5 NC1CCCCCC1=O Amb28934932 [1,0,0,1,0,0|1,0,0]=3 3583 B9R1.5 NC1CCCCCC1O Amb8855257 [1,0,0,1,0,0|1,0,1]=4 3584 B9R1.5 NC1CCCCNC1=O Amb19958477 [1,0,0,1,0,0|2,0,0]=4 3585 B9R1.5 NC1CCCCNC1=O Amb9721937 [1,0,0,1,0,0|2,0,0]=4 3586 B9R1.5 NN1CCCCCC1=O Amb22495331 [1,0,0,1,0,0|2,0,0]=4 3587 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [1,0,0,1,0,0|1,0,1]=4 3588 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [1,0,0,1,0,0|1,0,1]=4 3589 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [1,0,0,1,0,0|2,0,0]=4 3590 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [1,0,0,1,0,0|2,0,0]=4 3591 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [1,0,0,1,0,0|1,0,1]=4 3592 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [1,0,0,1,0,0|2,0,0]=4 3593 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [1,0,0,1,0,0|2,0,0]=4 3594 B9R1.5 O=C1C=CCCCC1O Amb27838742 [1,0,0,1,0,0|0,0,2]=4 3595 B9R1.5 O=C1CCCCCC1=O Amb17593310 [1,0,0,1,0,0|0,0,2]=4 3596 B9R1.5 O=C1CCCCCC1Br Amb18325296 [1,0,0,1,0,0|1,0,0]=3 3597 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [1,0,0,1,0,0|1,0,0]=3 3598 B9R1.5 O=C1CCCCCC1F Amb21965071 [1,0,0,1,0,0|1,0,0]=3 3599 B9R1.5 O=C1CCCCCC1O Amb25284997 [1,0,0,1,0,0|0,0,0]=2 3600 B9R1.5 O=C1CCCCCC1S Amb28199868 [1,0,0,1,0,0|0,1,0]=3 3601 B9R1.5 O=C1CCCCCN1Br Amb9786551 [1,0,0,1,0,0|2,0,0]=4 3602 B9R1.5 O=C1CCCCCN1Cl Amb10572732 [1,0,0,1,0,0|2,0,0]=4 3603 B9R1.5 O=C1CCCNCC1F Amb22886244 [1,0,0,1,0,0|2,0,0]=4 3604 B9R1.5 O=C1CCNCCC1Br Amb27201712 [1,0,0,1,0,0|2,0,0]=4 3605 B9R1.5 O=C1CCNCCC1Br Amb33621267 [1,0,0,1,0,0|2,0,0]=4 3606 B9R1.5 O=C1CCNCCC1F Amb22886247 [1,0,0,1,0,0|2,0,0]=4 3607 B9R1.5 O=C1CNCCCC1F Amb22886238 [1,0,0,1,0,0|2,0,0]=4 3608 B9R1.5 O=C1NCCCCC1Br Amb9781677 [1,0,0,1,0,0|2,0,0]=4 3609 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [1,0,0,1,0,0|2,0,0]=4 3610 B9R1.5 O=C1NCCCCC1I Amb35751097 [1,0,0,1,0,0|2,0,0]=4 3611 B9R1.5 OC1CCCCC=C1Br Amb27604372 [1,0,0,1,0,0|1,0,1]=4 3612 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [1,0,0,1,0,0|1,0,1]=4 3613 B9R1.5 OC1CCCCCC1Br Amb24480058 [1,0,0,1,0,0|1,0,1]=4 3614 B9R1.5 OC1CCCCCC1Cl Amb27974196 [1,0,0,1,0,0|1,0,1]=4 3615 B9R1.5 OC1CCCCCC1I Amb27640772 [1,0,0,1,0,0|1,0,1]=4 3616 B9R1.5 OC1CCCCCC1O Amb2196454 [1,0,0,1,0,0|0,0,2]=4 3617 B9R1.5 O[C@@H]1CCCCC[C@H]1F Amb27853128 [1,0,0,1,0,0|1,0,1]=4 3618 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [1,0,0,1,0,0|0,0,2]=4 3619 B9R1.5 O[C@H]1CCCCC[C@@H]1Cl Amb27440550 [1,0,0,1,0,0|1,0,1]=4 3620 B9R1.5 O[C@H]1CCCCC[C@@H]1F Amb28344995 [1,0,0,1,0,0|1,0,1]=4 3621 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [1,0,0,1,0,0|0,0,2]=4 3622 B9R1.5 O[C@H]1CCCCC[C@H]1Br Amb28051852 [1,0,0,1,0,0|1,0,1]=4 3623 B9R1.5 O[C@H]1CCCCC[C@H]1Cl Amb27657604 [1,0,0,1,0,0|1,0,1]=4 3624 B9R1.6 C=C(Br)C1CCCCC1 Amb27812306 [1,0,0,1,0,0|1,0,1]=4 3625 B9R1.6 C=C(C)C1CCCCC1 Amb24478631 [1,0,0,1,0,0|1,0,0]=3 3626 B9R1.6 C=C(C)C1CCCCN1 Amb23536631 [1,0,0,1,0,0|2,0,0]=4 3627 B9R1.6 C=C(C)C1CCCNC1 Amb23536695 [1,0,0,1,0,0|2,0,0]=4 3628 B9R1.6 C=C(C)C1CCNCC1 Amb23536711 [1,0,0,1,0,0|2,0,0]=4 3629 B9R1.6 C=C(C)C1CNCCO1 Amb30036474 [1,0,0,1,0,0|2,0,0]=4 3630 B9R1.6 C=C(C)C1OCCCO1 Amb17334098 [1,0,0,1,0,0|2,0,0]=4 3631 B9R1.6 CC(=N)N1CCCCC1 Amb27985971 [1,0,0,1,0,0|2,0,0]=4 3632 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [1,0,0,1,0,0|0,0,2]=4 3633 B9R1.6 CC(=O)C1C=CCCC1 Amb17593287 [1,0,0,1,0,0|0,0,2]=4 3634 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [1,0,0,1,0,0|0,0,2]=4 3635 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [1,0,0,1,0,0|0,0,2]=4 3636 B9R1.6 CC(=O)C1CCC=NC1 Amb25073951 [1,0,0,1,0,0|1,0,1]=4 3637 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [1,0,0,1,0,0|0,0,0]=2 3638 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [1,0,0,1,0,0|1,0,0]=3 3639 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [1,0,0,1,0,0|1,0,0]=3 3640 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [1,0,0,1,0,0|0,0,0]=2 3641 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [1,0,0,1,0,0|0,1,0]=3 3642 B9R1.6 CC(=O)C1CCCNC1 Amb22496258 [1,0,0,1,0,0|1,0,0]=3 3643 B9R1.6 CC(=O)C1CCCNC1 Amb3941186 [1,0,0,1,0,0|1,0,0]=3 3644 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [1,0,0,1,0,0|1,0,0]=3 3645 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [1,0,0,1,0,0|1,0,0]=3 3646 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [1,0,0,1,0,0|1,0,0]=3 3647 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [1,0,0,1,0,0|1,0,0]=3 3648 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [1,0,0,1,0,0|1,0,0]=3 3649 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [1,0,0,1,0,0|1,0,0]=3 3650 B9R1.6 CC(=O)C1CNCCS1 Amb24105963 [1,0,0,1,0,0|1,1,0]=4 3651 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [1,0,0,1,0,0|2,0,0]=4 3652 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [1,0,0,1,0,0|1,0,0]=3 3653 B9R1.6 CC(=O)C1COCOC1 Amb27838787 [1,0,0,1,0,0|2,0,0]=4 3654 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [1,0,0,1,0,0|2,0,0]=4 3655 B9R1.6 CC(=O)C1OCCCS1 Amb28350938 [1,0,0,1,0,0|1,0,0]=3 3656 B9R1.6 CC(=O)C1SCCCS1 Amb17594050 [1,0,0,1,0,0|1,1,0]=4 3657 B9R1.6 CC(=O)N1CCCCC1 Amb2694530 [1,0,0,1,0,0|1,0,0]=3 3658 B9R1.6 CC(=O)N1CCNCC1 Amb4424006 [1,0,0,1,0,0|2,0,0]=4 3659 B9R1.6 CC(=O)N1CCNCC1 Amb535516 [1,0,0,1,0,0|2,0,0]=4 3660 B9R1.6 CC(=O)N1CCOCC1 Amb3886545 [1,0,0,1,0,0|2,0,0]=4 3661 B9R1.6 CC(=O)[C@@H]1C=CCCC1 Amb25683968 [1,0,0,1,0,0|0,0,2]=4 3662 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [1,0,0,1,0,0|0,0,2]=4 3663 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [1,0,0,1,0,0|1,0,0]=3 3664 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [1,0,0,1,0,0|1,0,0]=3 3665 B9R1.6 CC(=O)[C@@H]1CCCNC1 Amb33131879 [1,0,0,1,0,0|1,0,0]=3 3666 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [1,0,0,1,0,0|0,0,2]=4 3667 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [1,0,0,1,0,0|1,0,0]=3 3668 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [1,0,0,1,0,0|1,0,0]=3 3669 B9R1.6 CC(=O)[C@H]1CCCNC1 Amb33131684 [1,0,0,1,0,0|1,0,0]=3 3670 B9R1.6 CC(Br)C1CCCCC1 Amb9672122 [1,0,0,1,0,0|1,0,1]=4 3671 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [1,0,0,1,0,0|1,0,1]=4 3672 B9R1.6 CC(N)C1CCCCC1 Amb9283568 [1,0,0,1,0,0|1,0,1]=4 3673 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [1,0,0,1,0,0|1,0,1]=4 3674 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [1,0,0,1,0,0|1,0,1]=4 3675 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [1,0,0,1,0,0|0,0,2]=4 3676 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [1,0,0,1,0,0|0,0,2]=4 3677 B9R1.6 CC(S)C1CCCCC1 Amb9672127 [1,0,0,1,0,0|0,1,1]=4 3678 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [1,0,0,1,0,0|0,1,1]=4 3679 B9R1.6 CN(C)C1CCCCC1 Amb8516598 [1,0,0,1,0,0|2,0,0]=4 3680 B9R1.6 CN(C)C1CCCCO1 Amb22523025 [1,0,0,1,0,0|2,0,0]=4 3681 B9R1.6 CN(N)C1CCCCC1 Amb27979124 [1,0,0,1,0,0|2,0,0]=4 3682 B9R1.6 CS(=O)C1CCCNC1 Amb27750943 [1,0,0,1,0,0|2,0,0]=4 3683 B9R1.6 C[C@@H](N)C1CCCCC1 Amb3940038 [1,0,0,1,0,0|1,0,1]=4 3684 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [1,0,0,1,0,0|1,0,1]=4 3685 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [1,0,0,1,0,0|1,0,1]=4 3686 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [1,0,0,1,0,0|0,0,2]=4 3687 B9R1.6 C[C@H](N)C1CCCCC1 Amb3939178 [1,0,0,1,0,0|1,0,1]=4 3688 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [1,0,0,1,0,0|1,0,1]=4 3689 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [1,0,0,1,0,0|0,0,2]=4 3690 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [1,0,0,1,0,0|0,0,2]=4 3691 B9R1.6 C[SiH](C)C1CCCCC1 Amb22336516 [1,0,0,1,0,0|1,1,0]=4 3692 B9R1.6 N=C(N)C1CCCCC1 Amb2695062 [1,0,0,1,0,0|2,0,0]=4 3693 B9R1.6 N=C(N)C1CCCCC1 Amb8630087 [1,0,0,1,0,0|2,0,0]=4 3694 B9R1.6 N=C(N)C1CCCCO1 Amb25212338 [1,0,0,1,0,0|2,0,0]=4 3695 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [1,0,0,1,0,0|1,0,0]=3 3696 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [1,0,0,1,0,0|2,0,0]=4 3697 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [1,0,0,1,0,0|2,0,0]=4 3698 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [1,0,0,1,0,0|1,1,0]=4 3699 B9R1.6 NC(=O)C1CCCNC1 Amb33527502 [1,0,0,1,0,0|2,0,0]=4 3700 B9R1.6 NC(=O)C1CCCNC1 Amb9702850 [1,0,0,1,0,0|2,0,0]=4 3701 B9R1.6 NC(=O)C1CCCOC1 Amb9173672 [1,0,0,1,0,0|2,0,0]=4 3702 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [1,0,0,1,0,0|2,0,0]=4 3703 B9R1.6 NC(=O)C1CCNCC1 Amb2720321 [1,0,0,1,0,0|2,0,0]=4 3704 B9R1.6 NC(=O)C1CCOCC1 Amb7990052 [1,0,0,1,0,0|2,0,0]=4 3705 B9R1.6 NC(=O)C1CCSCC1 Amb27252383 [1,0,0,1,0,0|2,0,0]=4 3706 B9R1.6 NC(=O)C1CNCCO1 Amb13951857 [1,0,0,1,0,0|2,0,0]=4 3707 B9R1.6 NC(=O)C1CNCCO1 Amb22587273 [1,0,0,1,0,0|2,0,0]=4 3708 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [1,0,0,1,0,0|2,0,0]=4 3709 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [1,0,0,1,0,0|2,0,0]=4 3710 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb25757310 [1,0,0,1,0,0|2,0,0]=4 3711 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb31204722 [1,0,0,1,0,0|2,0,0]=4 3712 B9R1.6 NC(=O)[C@@H]1CNCCO1 Amb28049786 [1,0,0,1,0,0|2,0,0]=4 3713 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [1,0,0,1,0,0|2,0,0]=4 3714 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23401436 [1,0,0,1,0,0|2,0,0]=4 3715 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23439159 [1,0,0,1,0,0|2,0,0]=4 3716 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb27758345 [1,0,0,1,0,0|2,0,0]=4 3717 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb28555661 [1,0,0,1,0,0|2,0,0]=4 3718 B9R1.6 NC(=S)C1CCCCC1 Amb6373985 [1,0,0,1,0,0|1,1,0]=4 3719 B9R1.6 NC(=S)C1CCCCO1 Amb33377342 [1,0,0,1,0,0|1,1,0]=4 3720 B9R1.6 NS(=O)C1CCCCC1 Amb26389954 [1,0,0,1,0,0|2,0,0]=4 3721 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [1,0,0,1,0,0|1,0,0]=3 3722 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [1,0,0,1,0,0|1,0,0]=3 3723 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [1,0,0,1,0,0|1,1,0]=4 3724 B9R1.6 O=C(Cl)C1CCCOC1 Amb18280558 [1,0,0,1,0,0|2,0,0]=4 3725 B9R1.6 O=C(Cl)C1CCOCC1 Amb2723452 [1,0,0,1,0,0|2,0,0]=4 3726 B9R1.6 O=C(Cl)C1CCSCC1 Amb6572254 [1,0,0,1,0,0|2,0,0]=4 3727 B9R1.6 O=C(Cl)N1CCCCC1 Amb17563099 [1,0,0,1,0,0|2,0,0]=4 3728 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [1,0,0,1,0,0|1,0,0]=3 3729 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [1,0,0,1,0,0|1,0,0]=3 3730 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [1,0,0,1,0,0|2,0,0]=4 3731 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [1,0,0,1,0,0|2,0,0]=4 3732 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [1,0,0,1,0,0|1,0,0]=3 3733 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,1,0]=4 3734 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [1,0,0,1,0,0|2,0,0]=4 3735 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [1,0,0,1,0,0|2,0,0]=4 3736 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|2,0,0]=4 3737 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [1,0,0,1,0,0|2,0,0]=4 3738 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [1,0,0,1,0,0|2,0,0]=4 3739 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [1,0,0,1,0,0|2,0,0]=4 3740 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [1,0,0,1,0,0|2,0,0]=4 3741 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [1,0,0,1,0,0|2,0,0]=4 3742 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [1,0,0,1,0,0|2,0,0]=4 3743 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [1,0,0,1,0,0|2,0,0]=4 3744 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [1,0,0,1,0,0|2,0,0]=4 3745 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [1,0,0,1,0,0|2,0,0]=4 3746 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [1,0,0,1,0,0|2,0,0]=4 3747 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|2,0,0]=4 3748 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [1,0,0,1,0,0|2,0,0]=4 3749 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [1,0,0,1,0,0|2,0,0]=4 3750 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [1,0,0,1,0,0|2,0,0]=4 3751 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,0]=3 3752 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|2,0,0]=4 3753 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [1,0,0,1,0,0|2,0,0]=4 3754 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [1,0,0,1,0,0|2,0,0]=4 3755 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [1,0,0,1,0,0|2,0,0]=4 3756 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [1,0,0,1,0,0|2,0,0]=4 3757 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [1,0,0,1,0,0|2,0,0]=4 3758 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [1,0,0,1,0,0|2,0,0]=4 3759 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [1,0,0,1,0,0|2,0,0]=4 3760 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [1,0,0,1,0,0|2,0,0]=4 3761 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [1,0,0,1,0,0|1,0,0]=3 3762 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [1,0,0,1,0,0|2,0,0]=4 3763 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [1,0,0,1,0,0|2,0,0]=4 3764 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [1,0,0,1,0,0|2,0,0]=4 3765 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [1,0,0,1,0,0|2,0,0]=4 3766 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [1,0,0,1,0,0|2,0,0]=4 3767 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [1,0,0,1,0,0|2,0,0]=4 3768 B9R1.6 O=S(Cl)C1CCCCC1 Amb25305792 [1,0,0,1,0,0|2,0,0]=4 3769 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|2,0,0]=4 3770 B9R1.6 O=S([O-])C1CCCCC1 Amb19893330 [1,0,0,1,0,0|2,0,0]=4 3771 B9R1.6 O=[N+]([O-])C1CCCCC1 Amb10604036 [1,0,0,1,0,0|2,0,0]=4 3772 B9R1.6 [O-]C(=S)C1CCCCO1 Amb27262534 [1,0,0,1,0,0|1,0,1]=4 3773 B9R1.23 CC1CC(CO)CC1=O Amb27222031 [1,0,0,1,0,0|1,0,0]=3 3774 B9R1.23 CC1CC(CO)NC1=O Amb2695752 [1,0,0,1,0,0|2,0,0]=4 3775 B9R1.23 CC1OC(CI)CC1=O Amb27842117 [1,0,0,1,0,0|2,0,0]=4 3776 B9R1.23 CC1OC(CO)CC1=O Amb28122421 [1,0,0,1,0,0|2,0,0]=4 3777 B9R1.23 CCC1CC(C)C(=N)N1 Amb27952045 [1,0,0,1,0,0|2,0,0]=4 3778 B9R1.23 CCC1CC(C)C(=O)N1 Amb20623299 [1,0,0,1,0,0|1,0,0]=3 3779 B9R1.23 CCC1CC(N)C(=O)O1 Amb27647519 [1,0,0,1,0,0|2,0,0]=4 3780 B9R1.23 CCC1CC(O)C(=O)O1 Amb28049114 [1,0,0,1,0,0|1,0,0]=3 3781 B9R1.23 CCC1CC(O)C(C)N1 Amb23453816 [1,0,0,1,0,0|1,0,1]=4 3782 B9R1.23 CCC1N=C(C)C(C)S1 Amb15691844 [1,0,0,1,0,0|2,0,0]=4 3783 B9R1.23 CCC1NC(=O)C(C)O1 Amb27598696 [1,0,0,1,0,0|2,0,0]=4 3784 B9R1.23 CCN1CC(=O)C(C)C1 Amb20667767 [1,0,0,1,0,0|1,0,0]=3 3785 B9R1.23 CCN1CC(=O)N(C)C1 Amb27447020 [1,0,0,1,0,0|2,0,0]=4 3786 B9R1.23 CC[C@@H]1C[C@@H](O)C(=O)O1 Amb27472678 [1,0,0,1,0,0|1,0,0]=3 3787 B9R1.23 CC[C@@H]1C[C@H](O)C(=O)O1 Amb27184446 [1,0,0,1,0,0|1,0,0]=3 3788 B9R1.23 CC[C@@H]1NC(=O)[C@@H](C)O1 Amb27422034 [1,0,0,1,0,0|2,0,0]=4 3789 B9R1.23 CC[C@@H]1NC(=O)[C@H](C)O1 Amb27436685 [1,0,0,1,0,0|2,0,0]=4 3790 B9R1.23 CC[C@H]1C[C@@H](O)C(=O)O1 Amb27428268 [1,0,0,1,0,0|1,0,0]=3 3791 B9R1.23 CN1CC(CBr)CC1=O Amb27838585 [1,0,0,1,0,0|2,0,0]=4 3792 B9R1.23 CN1CC(CCl)CC1=O Amb35781907 [1,0,0,1,0,0|2,0,0]=4 3793 B9R1.23 CN1CC(CN)CC1=O Amb22587624 [1,0,0,1,0,0|2,0,0]=4 3794 B9R1.23 CN1CC(CN)CC1=O Amb28991376 [1,0,0,1,0,0|2,0,0]=4 3795 B9R1.23 CN1CC(CN)CC1=O Amb33542734 [1,0,0,1,0,0|2,0,0]=4 3796 B9R1.23 CN1CC(CO)CC1=O Amb10607401 [1,0,0,1,0,0|2,0,0]=4 3797 B9R1.23 CNC1CC(=O)N(C)C1 Amb25142512 [1,0,0,1,0,0|2,0,0]=4 3798 B9R1.23 C[C@@H]1C[C@@H](CN)OC1=O Amb27440489 [1,0,0,1,0,0|2,0,0]=4 3799 B9R1.23 C[C@@H]1O[C@@H](CI)CC1=O Amb27857507 [1,0,0,1,0,0|2,0,0]=4 3800 B9R1.23 C[C@@H]1O[C@H](CI)CC1=O Amb27486233 [1,0,0,1,0,0|2,0,0]=4 3801 B9R1.23 C[C@H]1C[C@@H](CBr)SC1=O Amb27439099 [1,0,0,1,0,0|2,0,0]=4 3802 B9R1.23 C[C@H]1C[C@@H](CO)OC1=O Amb28429767 [1,0,0,1,0,0|2,0,0]=4 3803 B9R1.23 C[C@H]1C[C@H](CO)NC1=O Amb27422040 [1,0,0,1,0,0|2,0,0]=4 3804 B9R1.23 C[C@H]1O[C@H](CI)CC1=O Amb28053405 [1,0,0,1,0,0|2,0,0]=4 3805 B9R1.23 O=C1OC(CBr)CC1O Amb27760415 [1,0,0,1,0,0|2,0,0]=4 3806 B9R1.23 O=C1OC(CCl)CC1O Amb27841626 [1,0,0,1,0,0|2,0,0]=4 3807 B9R1.23 O=C1O[C@@H](CO)C[C@@H]1O Amb27783829 [1,0,0,1,0,0|2,0,0]=4 3808 B9R1.35 C=C(C)C1CCC(O)C1 Amb27807267 [1,0,0,1,0,0|2,0,0]=4 3809 B9R1.35 C=C(C)[C@@H]1CC[C@H](O)C1 Amb27857420 [1,0,0,1,0,0|2,0,0]=4 3810 B9R1.35 C=C1CCC(C(C)=O)C1 Amb27476121 [1,0,0,1,0,0|0,0,2]=4 3811 B9R1.35 CC(=O)C1C=C(C)CC1 Amb28137737 [1,0,0,1,0,0|0,0,2]=4 3812 B9R1.35 CC(=O)C1CC(C)CO1 Amb27780018 [1,0,0,1,0,0|1,0,0]=3 3813 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [1,0,0,1,0,0|0,0,2]=4 3814 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [1,0,0,1,0,0|1,0,1]=4 3815 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [1,0,0,1,0,0|1,0,1]=4 3816 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [1,0,0,1,0,0|1,0,0]=3 3817 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [1,0,0,1,0,0|1,0,0]=3 3818 B9R1.35 CC(=O)C1CCC(O)O1 Amb27838664 [1,0,0,1,0,0|1,0,0]=3 3819 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [1,0,0,1,0,0|1,0,0]=3 3820 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [1,0,0,1,0,0|0,0,0]=2 3821 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [1,0,0,1,0,0|0,0,0]=2 3822 B9R1.35 CC(=O)C1CN=C(C)O1 Amb26529070 [1,0,0,1,0,0|1,0,1]=4 3823 B9R1.35 CC(=O)C1SCC(C)S1 Amb24676738 [1,0,0,1,0,0|1,1,0]=4 3824 B9R1.35 CC(=O)N1CCC(F)C1 Amb35614292 [1,0,0,1,0,0|2,0,0]=4 3825 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [1,0,0,1,0,0|2,0,0]=4 3826 B9R1.35 CC(=O)N1CCC(N)C1 Amb33549525 [1,0,0,1,0,0|2,0,0]=4 3827 B9R1.35 CC(=O)N1CCC(O)C1 Amb20622704 [1,0,0,1,0,0|2,0,0]=4 3828 B9R1.35 CC(=O)N1CC[C@@H](Br)C1 Amb22227483 [1,0,0,1,0,0|2,0,0]=4 3829 B9R1.35 CC(=O)N1CC[C@@H](Cl)C1 Amb22227481 [1,0,0,1,0,0|2,0,0]=4 3830 B9R1.35 CC(=O)N1CC[C@@H](I)C1 Amb22227495 [1,0,0,1,0,0|2,0,0]=4 3831 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb19891343 [1,0,0,1,0,0|2,0,0]=4 3832 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb22227487 [1,0,0,1,0,0|2,0,0]=4 3833 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [1,0,0,1,0,0|2,0,0]=4 3834 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 Amb22227524 [1,0,0,1,0,0|2,0,0]=4 3835 B9R1.35 CC(=O)N1CC[C@H](I)C1 Amb22227531 [1,0,0,1,0,0|2,0,0]=4 3836 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb19890016 [1,0,0,1,0,0|2,0,0]=4 3837 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb22227520 [1,0,0,1,0,0|2,0,0]=4 3838 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [1,0,0,1,0,0|2,0,0]=4 3839 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [1,0,0,1,0,0|1,0,1]=4 3840 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [1,0,0,1,0,0|1,0,1]=4 3841 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [1,0,0,1,0,0|0,0,0]=2 3842 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [1,0,0,1,0,0|0,0,0]=2 3843 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [1,0,0,1,0,0|0,0,0]=2 3844 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [1,0,0,1,0,0|1,0,1]=4 3845 B9R1.35 CC(N)C1CC[C@@H](C)O1 Amb33423876 [1,0,0,1,0,0|1,0,1]=4 3846 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [1,0,0,1,0,0|2,0,0]=4 3847 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [1,0,0,1,0,0|2,0,0]=4 3848 B9R1.35 CC1CC(C(N)=O)CN1 Amb27665690 [1,0,0,1,0,0|2,0,0]=4 3849 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [1,0,0,1,0,0|1,0,0]=3 3850 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [1,0,0,1,0,0|1,0,0]=3 3851 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [1,0,0,1,0,0|2,0,0]=4 3852 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [1,0,0,1,0,0|2,0,0]=4 3853 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [1,0,0,1,0,0|1,0,0]=3 3854 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [1,0,0,1,0,0|1,1,0]=4 3855 B9R1.35 CC1CCC(C(C)N)C1 Amb25742195 [1,0,0,1,0,0|1,0,1]=4 3856 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [1,0,0,1,0,0|1,0,0]=3 3857 B9R1.35 CC1CCC(C(N)=S)O1 Amb27858136 [1,0,0,1,0,0|1,1,0]=4 3858 B9R1.35 CC1CCC(S(=O)Cl)C1 Amb32720564 [1,0,0,1,0,0|2,0,0]=4 3859 B9R1.35 CC1CCC(S(=O)[O-])C1 Amb32755283 [1,0,0,1,0,0|2,0,0]=4 3860 B9R1.35 CC1CCC(S(N)=O)C1 Amb32720565 [1,0,0,1,0,0|2,0,0]=4 3861 B9R1.35 CC1CCC([C@@H](C)N)C1 Amb25147002 [1,0,0,1,0,0|1,0,1]=4 3862 B9R1.35 CC1CCC([C@H](C)N)C1 Amb27628570 [1,0,0,1,0,0|1,0,1]=4 3863 B9R1.35 CC1CCC([C@H](C)N)O1 Amb28072103 [1,0,0,1,0,0|1,0,1]=4 3864 B9R1.35 CC1CCC([C@H](C)O)O1 Amb27959437 [1,0,0,1,0,0|0,0,2]=4 3865 B9R1.35 CC1CCN(C(=O)Cl)C1 Amb27391470 [1,0,0,1,0,0|2,0,0]=4 3866 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [1,0,0,1,0,0|2,0,0]=4 3867 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [1,0,0,1,0,0|2,0,0]=4 3868 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [1,0,0,1,0,0|2,0,0]=4 3869 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [1,0,0,1,0,0|2,0,0]=4 3870 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [1,0,0,1,0,0|2,0,0]=4 3871 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [1,0,0,1,0,0|2,0,0]=4 3872 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [1,0,0,1,0,0|2,0,0]=4 3873 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [1,0,0,1,0,0|2,0,0]=4 3874 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [1,0,0,1,0,0|2,0,0]=4 3875 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [1,0,0,1,0,0|2,0,0]=4 3876 B9R1.35 CS(=O)C1CCC(N)C1 Amb27229434 [1,0,0,1,0,0|2,0,0]=4 3877 B9R1.35 CS(=O)C1CCC(O)C1 Amb33620330 [1,0,0,1,0,0|2,0,0]=4 3878 B9R1.35 C[C@@H]1CCC(C(=N)N)O1 Amb32730393 [1,0,0,1,0,0|2,0,0]=4 3879 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [1,0,0,1,0,0|1,0,0]=3 3880 B9R1.35 C[C@@H]1CCC(C(N)=S)O1 Amb32730369 [1,0,0,1,0,0|1,1,0]=4 3881 B9R1.35 C[C@@H]1CCC([C@@H](C)N)O1 Amb33423296 [1,0,0,1,0,0|1,0,1]=4 3882 B9R1.35 C[C@@H]1CCC([C@@H](C)O)O1 Amb33423376 [1,0,0,1,0,0|0,0,2]=4 3883 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [1,0,0,1,0,0|1,0,0]=3 3884 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [1,0,0,1,0,0|2,0,0]=4 3885 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [1,0,0,1,0,0|2,0,0]=4 3886 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [1,0,0,1,0,0|1,0,0]=3 3887 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [1,0,0,1,0,0|2,0,0]=4 3888 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [1,0,0,1,0,0|2,0,0]=4 3889 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [1,0,0,1,0,0|1,0,0]=3 3890 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [1,0,0,1,0,0|2,0,0]=4 3891 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [1,0,0,1,0,0|2,0,0]=4 3892 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [1,0,0,1,0,0|2,0,0]=4 3893 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [1,0,0,1,0,0|2,0,0]=4 3894 B9R1.35 C[C@H](N)C1CC[C@@H](C)O1 Amb33423377 [1,0,0,1,0,0|1,0,1]=4 3895 B9R1.35 C[C@H](O)C1CC[C@@H](C)O1 Amb33423345 [1,0,0,1,0,0|0,0,2]=4 3896 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [1,0,0,1,0,0|2,0,0]=4 3897 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [1,0,0,1,0,0|2,0,0]=4 3898 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [1,0,0,1,0,0|1,0,0]=3 3899 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [1,0,0,1,0,0|1,0,0]=3 3900 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [1,0,0,1,0,0|2,0,0]=4 3901 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [1,0,0,1,0,0|1,0,0]=3 3902 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [1,0,0,1,0,0|2,0,0]=4 3903 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [1,0,0,1,0,0|2,0,0]=4 3904 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [1,0,0,1,0,0|2,0,0]=4 3905 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [1,0,0,1,0,0|2,0,0]=4 3906 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [1,0,0,1,0,0|2,0,0]=4 3907 B9R1.35 NC(=O)C1CCC(Cl)C1 Amb27253059 [1,0,0,1,0,0|2,0,0]=4 3908 B9R1.35 NC(=O)C1CCC(F)C1 Amb27155322 [1,0,0,1,0,0|2,0,0]=4 3909 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [1,0,0,1,0,0|2,0,0]=4 3910 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [1,0,0,1,0,0|2,0,0]=4 3911 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [1,0,0,1,0,0|2,0,0]=4 3912 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [1,0,0,1,0,0|2,0,0]=4 3913 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [1,0,0,1,0,0|2,0,0]=4 3914 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [1,0,0,1,0,0|2,0,0]=4 3915 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [1,0,0,1,0,0|2,0,0]=4 3916 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [1,0,0,1,0,0|2,0,0]=4 3917 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [1,0,0,1,0,0|2,0,0]=4 3918 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [1,0,0,1,0,0|2,0,0]=4 3919 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [1,0,0,1,0,0|2,0,0]=4 3920 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [1,0,0,1,0,0|2,0,0]=4 3921 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [1,0,0,1,0,0|2,0,0]=4 3922 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [1,0,0,1,0,0|2,0,0]=4 3923 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [1,0,0,1,0,0|2,0,0]=4 3924 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [1,0,0,1,0,0|2,0,0]=4 3925 B9R1.35 O=C(Cl)C1CCC(Cl)C1 Amb24707520 [1,0,0,1,0,0|2,0,0]=4 3926 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [1,0,0,1,0,0|2,0,0]=4 3927 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [1,0,0,1,0,0|2,0,0]=4 3928 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [1,0,0,1,0,0|2,0,0]=4 3929 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [1,0,0,1,0,0|2,0,0]=4 3930 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [1,0,0,1,0,0|2,0,0]=4 3931 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [1,0,0,1,0,0|2,0,0]=4 3932 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [1,0,0,1,0,0|2,0,0]=4 3933 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [1,0,0,1,0,0|2,0,0]=4 3934 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [1,0,0,1,0,0|2,0,0]=4 3935 B9R1.39 CCCCC1CCC1N Amb27193785 [1,0,0,1,0,0|1,0,1]=4 3936 B9R1.39 CCCCC1CCC1O Amb32950020 [1,0,0,1,0,0|0,0,2]=4 3937 B9R1.39 NCCCN1CCC1=O Amb27209792 [1,0,0,1,0,0|2,0,0]=4 3938 B9R1.39 O=C1CCC1CCCCl Amb32684692 [1,0,0,1,0,0|1,0,0]=3 3939 B9R1.40 CC1(Br)CCCCC1O Amb28064001 [1,0,0,1,0,0|1,0,1]=4 3940 B9R1.40 CC1(C)CCCCC1O Amb22748701 [1,0,0,1,0,0|1,0,1]=4 3941 B9R1.40 CC1(C)CCCC[C@@H]1O Amb28318455 [1,0,0,1,0,0|1,0,1]=4 3942 B9R1.40 CC1(C)CCCC[C@H]1O Amb28256801 [1,0,0,1,0,0|1,0,1]=4 3943 B9R1.40 CC1(Cl)CCCCC1O Amb28315439 [1,0,0,1,0,0|1,0,1]=4 3944 B9R1.40 CC1(N)CCCCC1O Amb28436950 [1,0,0,1,0,0|1,0,1]=4 3945 B9R1.40 CC1CCCCC1(C)C Amb22227673 [1,0,0,1,0,0|1,0,1]=4 3946 B9R1.40 CC1CCCCC1(C)Cl Amb27789616 [1,0,0,1,0,0|1,0,1]=4 3947 B9R1.40 CC1CCCCC1(C)N Amb9676158 [1,0,0,1,0,0|1,0,1]=4 3948 B9R1.40 CC1CCCCC1(C)O Amb9675954 [1,0,0,1,0,0|0,0,2]=4 3949 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [1,0,0,1,0,0|0,0,2]=4 3950 B9R1.40 C[C@@]1(Br)CCCC[C@@H]1O Amb27978301 [1,0,0,1,0,0|1,0,1]=4 3951 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [1,0,0,1,0,0|1,0,1]=4 3952 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1O Amb27463688 [1,0,0,1,0,0|1,0,1]=4 3953 B9R1.40 C[C@@]1(F)CCCC[C@H]1O Amb28205454 [1,0,0,1,0,0|1,0,1]=4 3954 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [1,0,0,1,0,0|1,0,1]=4 3955 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [1,0,0,1,0,0|0,0,2]=4 3956 B9R1.40 C[C@]1(N)CCCC[C@H]1O Amb28061920 [1,0,0,1,0,0|1,0,1]=4 3957 B9R1.40 C[C@]1(O)CCCC[C@@H]1O Amb27427705 [1,0,0,1,0,0|0,0,2]=4 3958 B9R1.40 C[Si]1(C)CCCCC1O Amb27981646 [1,0,0,1,0,0|1,1,0]=4 3959 B9R1.45 CC(C)C(O)C1CC1C Amb28197492 [1,0,0,1,0,0|1,0,1]=4 3960 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [1,0,0,1,0,0|1,0,0]=3 3961 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [1,0,0,1,0,0|2,0,0]=4 3962 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [1,0,0,1,0,0|1,0,0]=3 3963 B9R1.59 C=C(C)C1CC1CCO Amb28400433 [1,0,0,1,0,0|2,0,0]=4 3964 B9R1.59 CC(=O)C1CC1CC=O Amb28058511 [1,0,0,1,0,0|1,0,1]=4 3965 B9R1.59 CC(=O)[C@@H]1C[C@@H]1CC=O Amb27229169 [1,0,0,1,0,0|1,0,1]=4 3966 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [1,0,0,1,0,0|1,0,0]=3 3967 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [1,0,0,1,0,0|1,0,0]=3 3968 B9R1.59 CCCC1OC1C(C)=O Amb25888683 [1,0,0,1,0,0|0,0,0]=2 3969 B9R1.59 CCCC1OC1C(C)O Amb26924649 [1,0,0,1,0,0|0,0,2]=4 3970 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [1,0,0,1,0,0|1,0,0]=3 3971 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [1,0,0,1,0,0|1,0,0]=3 3972 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [1,0,0,1,0,0|1,0,0]=3 3973 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [1,0,0,1,0,0|1,0,0]=3 3974 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [1,0,0,1,0,0|0,0,0]=2 3975 B9R1.59 CCC[C@@H]1O[C@H]1[C@@H](C)O Amb27255265 [1,0,0,1,0,0|0,0,2]=4 3976 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [1,0,0,1,0,0|1,0,0]=3 3977 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [1,0,0,1,0,0|1,0,0]=3 3978 B9R1.59 CCC[C@H]1O[C@@H]1C(C)=O Amb28325243 [1,0,0,1,0,0|0,0,0]=2 3979 B9R1.59 CCOC1CC1C(=O)Cl Amb35717348 [1,0,0,1,0,0|2,0,0]=4 3980 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [1,0,0,1,0,0|2,0,0]=4 3981 B9R1.59 CCOC1CC1C(C)=O Amb27838755 [1,0,0,1,0,0|1,0,0]=3 3982 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [1,0,0,1,0,0|2,0,0]=4 3983 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [1,0,0,1,0,0|2,0,0]=4 3984 B9R1.59 COCC1CC1C(=O)O Amb27404704 [1,0,0,1,0,0|2,0,0]=4 3985 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [1,0,0,1,0,0|2,0,0]=4 3986 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [1,0,0,1,0,0|2,0,0]=4 3987 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [1,0,0,1,0,0|2,0,0]=4 3988 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [1,0,0,1,0,0|2,0,0]=4 3989 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [1,0,0,1,0,0|2,0,0]=4 3990 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [1,0,0,1,0,0|2,0,0]=4 3991 B9R1.69 C=C1CC(O)CCC1C Amb28401292 [1,0,0,1,0,0|2,0,0]=4 3992 B9R1.69 C=C1C[C@@H](O)CC[C@H]1C Amb27650219 [1,0,0,1,0,0|2,0,0]=4 3993 B9R1.69 CC1=C(C)CC(C)CC1 Amb26603643 [1,0,0,1,0,0|1,0,1]=4 3994 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [1,0,0,1,0,0|0,0,2]=4 3995 B9R1.69 CC1=CC(=O)C(O)CC1 Amb27838713 [1,0,0,1,0,0|0,0,2]=4 3996 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [1,0,0,1,0,0|0,0,2]=4 3997 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [1,0,0,1,0,0|2,0,0]=4 3998 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [1,0,0,1,0,0|2,0,0]=4 3999 B9R1.69 CC1=C[C@@H](O)CC[C@H]1O Amb27970996 [1,0,0,1,0,0|2,0,0]=4 4000 B9R1.69 CC1CC(=O)C(C)CN1 Amb32757537 [1,0,0,1,0,0|1,0,0]=3 4001 B9R1.69 CC1CC(=O)C(C)CN1 Amb792443 [1,0,0,1,0,0|1,0,0]=3 4002 B9R1.69 CC1CC(=O)C(C)CS1 Amb4399940 [1,0,0,1,0,0|1,0,0]=3 4003 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [1,0,0,1,0,0|1,0,1]=4 4004 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [1,0,0,1,0,0|1,0,0]=3 4005 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [1,0,0,1,0,0|0,0,0]=2 4006 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [1,0,0,1,0,0|1,0,0]=3 4007 B9R1.69 CC1CCC(C)C(C)C1 Amb4017852 [1,0,0,1,0,0|1,0,1]=4 4008 B9R1.69 CC1CCC(C)C(C)N1 Amb28046662 [1,0,0,1,0,0|1,0,1]=4 4009 B9R1.69 CC1CCC(C)C(N)C1 Amb6374323 [1,0,0,1,0,0|1,0,1]=4 4010 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [1,0,0,1,0,0|0,0,2]=4 4011 B9R1.69 CC1CCC(C)C(S)C1 Amb25296681 [1,0,0,1,0,0|0,1,1]=4 4012 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [1,0,0,1,0,0|1,0,0]=3 4013 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [1,0,0,1,0,0|1,0,0]=3 4014 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [1,0,0,1,0,0|2,0,0]=4 4015 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [1,0,0,1,0,0|1,0,0]=3 4016 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [1,0,0,1,0,0|1,0,1]=4 4017 B9R1.69 CC1CCC(O)C(Cl)C1 Amb28291502 [1,0,0,1,0,0|1,0,1]=4 4018 B9R1.69 CC1CCC(O)C(F)C1 Amb33229936 [1,0,0,1,0,0|1,0,1]=4 4019 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [1,0,0,1,0,0|1,0,1]=4 4020 B9R1.69 CC1CCC(O)C(S)C1 Amb27495493 [1,0,0,1,0,0|0,1,1]=4 4021 B9R1.69 CC1CCN(C)CC1=O Amb27861305 [1,0,0,1,0,0|1,0,0]=3 4022 B9R1.69 CC1CC[C@@H](O)[C@H](N)C1 Amb25912139 [1,0,0,1,0,0|1,0,1]=4 4023 B9R1.69 CC1CNC(C)C(=O)N1 Amb18642668 [1,0,0,1,0,0|2,0,0]=4 4024 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [1,0,0,1,0,0|2,0,0]=4 4025 B9R1.69 CN1CCC(N)CC1=O Amb28895935 [1,0,0,1,0,0|2,0,0]=4 4026 B9R1.69 CN1CCC(N)CC1=O Amb8010833 [1,0,0,1,0,0|2,0,0]=4 4027 B9R1.69 C[C@@H]1CC(=O)[C@H](C)CN1 Amb27188273 [1,0,0,1,0,0|1,0,0]=3 4028 B9R1.69 C[C@@H]1CC[C@@H](C)[C@@H](N)C1 Amb28055512 [1,0,0,1,0,0|1,0,1]=4 4029 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](C)C1 Amb28061313 [1,0,0,1,0,0|1,0,1]=4 4030 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [1,0,0,1,0,0|0,0,2]=4 4031 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [1,0,0,1,0,0|1,0,0]=3 4032 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](O)C1 Amb28204040 [1,0,0,1,0,0|0,0,2]=4 4033 B9R1.69 C[C@@H]1CN[C@H](C)C(=O)N1 Amb23385259 [1,0,0,1,0,0|2,0,0]=4 4034 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [1,0,0,1,0,0|2,0,0]=4 4035 B9R1.69 C[C@@H]1OC[C@@H](C)NC1=O Amb27216673 [1,0,0,1,0,0|2,0,0]=4 4036 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [1,0,0,1,0,0|0,0,2]=4 4037 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [1,0,0,1,0,0|0,0,2]=4 4038 B9R1.69 C[C@H]1CC[C@@H](C)N[C@H]1C Amb27667416 [1,0,0,1,0,0|1,0,1]=4 4039 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [1,0,0,1,0,0|1,0,0]=3 4040 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [1,0,0,1,0,0|1,0,0]=3 4041 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [1,0,0,1,0,0|0,0,2]=4 4042 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [1,0,0,1,0,0|1,0,0]=3 4043 B9R1.69 C[C@H]1CN[C@@H](C)C(=O)N1 Amb23385307 [1,0,0,1,0,0|2,0,0]=4 4044 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb22587547 [1,0,0,1,0,0|2,0,0]=4 4045 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb23385266 [1,0,0,1,0,0|2,0,0]=4 4046 B9R1.69 C[C@H]1CO[C@@H](C)C(=O)N1 Amb26975581 [1,0,0,1,0,0|2,0,0]=4 4047 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1C Amb26026793 [1,0,0,1,0,0|1,0,1]=4 4048 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [1,0,0,1,0,0|1,0,1]=4 4049 B9R1.93 C=C[C@H]1C[C@@]1(C)C(C)=O Amb27440389 [1,0,0,1,0,0|0,0,2]=4 4050 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [1,0,0,1,0,0|2,0,0]=4 4051 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [1,0,0,1,0,0|2,0,0]=4 4052 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [1,0,0,1,0,0|1,0,0]=3 4053 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [1,0,0,1,0,0|2,0,0]=4 4054 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [1,0,0,1,0,0|1,0,0]=3 4055 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [1,0,0,1,0,0|2,0,0]=4 4056 B9R1.93 CC[C@@H]1C[C@@]1(N)C(N)=O Amb27215769 [1,0,0,1,0,0|2,0,0]=4 4057 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [1,0,0,1,0,0|2,0,0]=4 4058 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [1,0,0,1,0,0|1,0,0]=3 4059 B9R1.93 CC[C@H]1C[C@@]1(N)C(N)=O Amb28286397 [1,0,0,1,0,0|2,0,0]=4 4060 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [1,0,0,1,0,0|2,0,0]=4 4061 B9R1.93 CC[C@H]1C[C@]1(N)C(N)=O Amb28286982 [1,0,0,1,0,0|2,0,0]=4 4062 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [1,0,0,1,0,0|2,0,0]=4 4063 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [1,0,0,1,0,0|2,0,0]=4 4064 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [1,0,0,1,0,0|2,0,0]=4 4065 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [1,0,0,1,0,0|2,0,0]=4 4066 B9R1.95 C#CC1CC(C(C)=O)C1 Amb27669434 [1,0,0,1,0,0|0,0,2]=4 4067 B9R1.95 C#C[C@H]1C[C@@H](C(C)=O)C1 Amb27211903 [1,0,0,1,0,0|0,0,2]=4 4068 B9R1.95 CC(=O)C1CC(C=O)C1 Amb32669290 [1,0,0,1,0,0|1,0,1]=4 4069 B9R1.95 CC(=O)N1CC(CBr)C1 Amb27813085 [1,0,0,1,0,0|2,0,0]=4 4070 B9R1.95 CC(=O)N1CC(CN)C1 Amb28436806 [1,0,0,1,0,0|2,0,0]=4 4071 B9R1.95 CC(=O)N1CC(CN)C1 Amb33463045 [1,0,0,1,0,0|2,0,0]=4 4072 B9R1.95 CC(=O)N1CC(CO)C1 Amb26549681 [1,0,0,1,0,0|2,0,0]=4 4073 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [1,0,0,1,0,0|1,0,0]=3 4074 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [1,0,0,1,0,0|1,0,0]=3 4075 B9R1.95 CCC1CN(C(=O)Cl)C1 Amb35667759 [1,0,0,1,0,0|2,0,0]=4 4076 B9R1.95 CCC1CN(C(C)=N)C1 Amb30023414 [1,0,0,1,0,0|2,0,0]=4 4077 B9R1.95 CCC1CN(C(C)=O)C1 Amb35645756 [1,0,0,1,0,0|1,0,0]=3 4078 B9R1.95 CCC1CN(C(N)=O)C1 Amb30039311 [1,0,0,1,0,0|2,0,0]=4 4079 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [1,0,0,1,0,0|2,0,0]=4 4080 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [1,0,0,1,0,0|1,0,0]=3 4081 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [1,0,0,1,0,0|2,0,0]=4 4082 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [1,0,0,1,0,0|2,0,0]=4 4083 B9R1.95 CNC1CC(C(C)=O)C1 Amb30032621 [1,0,0,1,0,0|1,0,0]=3 4084 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670672 [1,0,0,1,0,0|2,0,0]=4 4085 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670673 [1,0,0,1,0,0|2,0,0]=4 4086 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [1,0,0,1,0,0|2,0,0]=4 4087 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [1,0,0,1,0,0|2,0,0]=4 4088 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670695 [1,0,0,1,0,0|2,0,0]=4 4089 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670696 [1,0,0,1,0,0|2,0,0]=4 4090 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [1,0,0,1,0,0|2,0,0]=4 4091 B9R1.95 COC1CC(C(C)=O)C1 Amb24595933 [1,0,0,1,0,0|1,0,0]=3 4092 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [1,0,0,1,0,0|2,0,0]=4 4093 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [1,0,0,1,0,0|2,0,0]=4 4094 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [1,0,0,1,0,0|2,0,0]=4 4095 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [1,0,0,1,0,0|2,0,0]=4 4096 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [1,0,0,1,0,0|2,0,0]=4 4097 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [1,0,0,1,0,0|2,0,0]=4 4098 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [1,0,0,1,0,0|2,0,0]=4 4099 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [1,0,0,1,0,0|2,0,0]=4 4100 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [1,0,0,1,0,0|2,0,0]=4 4101 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [1,0,0,1,0,0|2,0,0]=4 4102 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [1,0,0,1,0,0|2,0,0]=4 4103 B9R1.100 CCCCC(C)C1CC1 Amb25286937 [1,0,0,1,0,0|1,0,1]=4 4104 B9R1.100 CCCCC(O)C1CC1 Amb27837486 [1,0,0,1,0,0|1,0,1]=4 4105 B9R1.100 CCCCC(O)C1CO1 Amb28048180 [1,0,0,1,0,0|0,0,2]=4 4106 B9R1.100 CCCC[C@@H](O)[C@@H]1CO1 Amb27186933 [1,0,0,1,0,0|0,0,2]=4 4107 B9R1.100 CCCC[C@@H](O)[C@H]1CO1 Amb27219813 [1,0,0,1,0,0|0,0,2]=4 4108 B9R1.100 CCCC[C@H](O)[C@H]1CO1 Amb27197461 [1,0,0,1,0,0|0,0,2]=4 4109 B9R1.106 CC1CCC(C)S1(=O)=O Amb2813294 [1,0,0,1,0,0|2,0,0]=4 4110 B9R1.110 C=C(C)C(O)C1CCC1 Amb28364580 [1,0,0,1,0,0|1,0,0]=3 4111 B9R1.110 C=C(C)C(O)C1CNC1 Amb30026477 [1,0,0,1,0,0|2,0,0]=4 4112 B9R1.110 C=C(C)C(O)C1CSC1 Amb35711351 [1,0,0,1,0,0|2,0,0]=4 4113 B9R1.110 CC(=N)N(C)C1CCC1 Amb27812898 [1,0,0,1,0,0|2,0,0]=4 4114 B9R1.110 CC(=O)C(C)C1CCC1 Amb35603891 [1,0,0,1,0,0|0,0,0]=2 4115 B9R1.110 CC(=O)C(C)C1CNC1 Amb24673466 [1,0,0,1,0,0|1,0,0]=3 4116 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [1,0,0,1,0,0|1,0,0]=3 4117 B9R1.110 CC(=O)N(C)C1CCC1 Amb26025919 [1,0,0,1,0,0|1,0,0]=3 4118 B9R1.110 CC(=O)N(C)C1CNC1 Amb21960866 [1,0,0,1,0,0|2,0,0]=4 4119 B9R1.110 CC(=O)N(C)C1CNC1 Amb26326635 [1,0,0,1,0,0|2,0,0]=4 4120 B9R1.110 CC(C(=O)Cl)C1CCC1 Amb29849535 [1,0,0,1,0,0|1,0,0]=3 4121 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [1,0,0,1,0,0|1,0,0]=3 4122 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [1,0,0,1,0,0|2,0,0]=4 4123 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [1,0,0,1,0,0|2,0,0]=4 4124 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [1,0,0,1,0,0|2,0,0]=4 4125 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [1,0,0,1,0,0|2,0,0]=4 4126 B9R1.110 CC(C(=O)O)N1CCC1 Amb24178905 [1,0,0,1,0,0|2,0,0]=4 4127 B9R1.110 CC(C(=O)O)N1CCC1 Amb33329262 [1,0,0,1,0,0|2,0,0]=4 4128 B9R1.110 CC(C(=O)[O-])C1COC1 Amb35752725 [1,0,0,1,0,0|2,0,0]=4 4129 B9R1.110 CC(C(N)=O)C1CCC1 Amb30008333 [1,0,0,1,0,0|1,0,0]=3 4130 B9R1.110 CC(C(N)=O)C1CNC1 Amb27593677 [1,0,0,1,0,0|2,0,0]=4 4131 B9R1.110 CC(Cl)C(C)C1CCC1 Amb27879003 [1,0,0,1,0,0|1,0,1]=4 4132 B9R1.110 CC(O)C(C)C1CCC1 Amb24481851 [1,0,0,1,0,0|0,0,2]=4 4133 B9R1.110 CN(C(=O)Cl)C1CCC1 Amb32863940 [1,0,0,1,0,0|2,0,0]=4 4134 B9R1.110 CN(C(N)=O)C1CCC1 Amb27465967 [1,0,0,1,0,0|2,0,0]=4 4135 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [1,0,0,1,0,0|2,0,0]=4 4136 B9R1.110 C[C@@H](N)C(O)C1CCC1 Amb35624101 [1,0,0,1,0,0|1,0,1]=4 4137 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [1,0,0,1,0,0|2,0,0]=4 4138 B9R1.110 C[C@H](N)C(O)C1CCC1 Amb35737943 [1,0,0,1,0,0|1,0,1]=4 4139 B9R1.110 NC(=O)C(N)C1CCC1 Amb27237393 [1,0,0,1,0,0|2,0,0]=4 4140 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [1,0,0,1,0,0|2,0,0]=4 4141 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [1,0,0,1,0,0|2,0,0]=4 4142 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [1,0,0,1,0,0|2,0,0]=4 4143 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [1,0,0,1,0,0|2,0,0]=4 4144 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [1,0,0,1,0,0|2,0,0]=4 4145 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [1,0,0,1,0,0|1,0,0]=3 4146 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [1,0,0,1,0,0|2,0,0]=4 4147 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [1,0,0,1,0,0|1,0,0]=3 4148 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [1,0,0,1,0,0|1,0,0]=3 4149 B9R1.110 O=C([O-])C(O)C1COC1 Amb32650165 [1,0,0,1,0,0|2,0,0]=4 4150 B9R1.112 C=C(C)C(N)CC1CC1 Amb28313656 [1,0,0,1,0,0|2,0,0]=4 4151 B9R1.112 CC(=O)C(C)NC1CC1 Amb25119978 [1,0,0,1,0,0|1,0,0]=3 4152 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [1,0,0,1,0,0|1,0,0]=3 4153 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [1,0,0,1,0,0|1,0,0]=3 4154 B9R1.112 CC(CC1CC1)C(N)=O Amb33495655 [1,0,0,1,0,0|1,0,0]=3 4155 B9R1.112 CC(N)C(O)CC1CC1 Amb35588688 [1,0,0,1,0,0|1,0,1]=4 4156 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [1,0,0,1,0,0|2,0,0]=4 4157 B9R1.112 CC(NC1CC1)C(N)=O Amb7758269 [1,0,0,1,0,0|2,0,0]=4 4158 B9R1.112 CC(O)C(C)CC1CC1 Amb24429505 [1,0,0,1,0,0|0,0,2]=4 4159 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [1,0,0,1,0,0|2,0,0]=4 4160 B9R1.112 CN(CC1CC1)C(=O)Cl Amb32863866 [1,0,0,1,0,0|2,0,0]=4 4161 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [1,0,0,1,0,0|1,0,0]=3 4162 B9R1.112 C[C@@H](N)C(O)CC1CC1 Amb35624306 [1,0,0,1,0,0|1,0,1]=4 4163 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [1,0,0,1,0,0|2,0,0]=4 4164 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [1,0,0,1,0,0|1,0,0]=3 4165 B9R1.112 C[C@H](N)C(O)CC1CC1 Amb35618417 [1,0,0,1,0,0|1,0,1]=4 4166 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [1,0,0,1,0,0|2,0,0]=4 4167 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [1,0,0,1,0,0|2,0,0]=4 4168 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [1,0,0,1,0,0|2,0,0]=4 4169 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [1,0,0,1,0,0|2,0,0]=4 4170 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [1,0,0,1,0,0|2,0,0]=4 4171 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [1,0,0,1,0,0|2,0,0]=4 4172 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [1,0,0,1,0,0|2,0,0]=4 4173 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [1,0,0,1,0,0|1,0,0]=3 4174 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [1,0,0,1,0,0|1,1,0]=4 4175 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [1,0,0,1,0,0|1,0,0]=3 4176 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [1,0,0,1,0,0|1,0,0]=3 4177 B9R1.135 CCCC1NC(=O)C1C Amb27193222 [1,0,0,1,0,0|1,0,0]=3 4178 B9R1.135 CCC[C@@H]1NC(=O)[C@@H]1C Amb28320522 [1,0,0,1,0,0|1,0,0]=3 4179 B9R1.135 CCC[C@@H]1NC(=O)[C@H]1C Amb27229291 [1,0,0,1,0,0|1,0,0]=3 4180 B9R1.135 CCOC1CC(=O)C1C Amb25257374 [1,0,0,1,0,0|1,0,0]=3 4181 B9R1.135 CCOC1CC(=O)C1Cl Amb25221976 [1,0,0,1,0,0|2,0,0]=4 4182 B9R1.135 CCOC1CC(=O)N1C Amb25346887 [1,0,0,1,0,0|2,0,0]=4 4183 B9R1.135 CCO[C@@H]1CC(=O)[C@H]1C Amb28198608 [1,0,0,1,0,0|1,0,0]=3 4184 B9R1.135 COC[C@@H]1NC(=O)[C@@H]1O Amb27451137 [1,0,0,1,0,0|2,0,0]=4 4185 B9R1.159 C=C(C)C1(O)CCC1C Amb28071760 [1,0,0,1,0,0|1,0,0]=3 4186 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [1,0,0,1,0,0|2,0,0]=4 4187 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [1,0,0,1,0,0|1,0,0]=3 4188 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [1,0,0,1,0,0|2,0,0]=4 4189 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [1,0,0,1,0,0|1,0,0]=3 4190 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [1,0,0,1,0,0|2,0,0]=4 4191 B9R1.159 C[C@@H]1CC[C@@]1(N)C(N)=O Amb28346845 [1,0,0,1,0,0|2,0,0]=4 4192 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [1,0,0,1,0,0|2,0,0]=4 4193 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [1,0,0,1,0,0|2,0,0]=4 4194 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [1,0,0,1,0,0|2,0,0]=4 4195 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [1,0,0,1,0,0|2,0,0]=4 4196 B9R1.163 C=C(C)C1(N)CCCC1 Amb33201934 [1,0,0,1,0,0|2,0,0]=4 4197 B9R1.163 C=C(C)C1(O)CCCC1 Amb28246362 [1,0,0,1,0,0|1,0,0]=3 4198 B9R1.163 CC(=O)C1(C)C=CCC1 Amb28199940 [1,0,0,1,0,0|0,0,2]=4 4199 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [1,0,0,1,0,0|0,0,0]=2 4200 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [1,0,0,1,0,0|1,0,0]=3 4201 B9R1.163 CC(=O)C1(C)CCCO1 Amb24332633 [1,0,0,1,0,0|1,0,0]=3 4202 B9R1.163 CC(=O)C1(C)CCNC1 Amb25698020 [1,0,0,1,0,0|1,0,0]=3 4203 B9R1.163 CC(=O)C1(C)NCCO1 Amb27795907 [1,0,0,1,0,0|2,0,0]=4 4204 B9R1.163 CC(=O)C1(C)OCCO1 Amb27955538 [1,0,0,1,0,0|2,0,0]=4 4205 B9R1.163 CC(=O)C1(C)OCCS1 Amb25188965 [1,0,0,1,0,0|2,0,0]=4 4206 B9R1.163 CC(=O)C1(C)SCCS1 Amb28458583 [1,0,0,1,0,0|2,0,0]=4 4207 B9R1.163 CC(=O)C1(Cl)CCCC1 Amb27950094 [1,0,0,1,0,0|1,0,0]=3 4208 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [1,0,0,1,0,0|1,0,0]=3 4209 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [1,0,0,1,0,0|1,0,0]=3 4210 B9R1.163 CC(=O)C1(N)CCOC1 Amb24427660 [1,0,0,1,0,0|2,0,0]=4 4211 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [1,0,0,1,0,0|0,0,0]=2 4212 B9R1.163 CC(=O)[C@@]1(C)CCCN1 Amb33307927 [1,0,0,1,0,0|1,0,0]=3 4213 B9R1.163 CC(=O)[C@]1(C)CCCN1 Amb33307921 [1,0,0,1,0,0|1,0,0]=3 4214 B9R1.163 CC(C)C1(O)CCCC1 Amb9675984 [1,0,0,1,0,0|1,0,1]=4 4215 B9R1.163 CC(N)C1(C)CCCC1 Amb24587997 [1,0,0,1,0,0|1,0,1]=4 4216 B9R1.163 CC(N)C1(O)CCCC1 Amb25145994 [1,0,0,1,0,0|1,0,1]=4 4217 B9R1.163 CC1(C(=O)Cl)CCCC1 Amb24476587 [1,0,0,1,0,0|1,0,0]=3 4218 B9R1.163 CC1(C(=O)Cl)CCCO1 Amb26359915 [1,0,0,1,0,0|2,0,0]=4 4219 B9R1.163 CC1(C(=O)Cl)CCCS1 Amb27838547 [1,0,0,1,0,0|2,0,0]=4 4220 B9R1.163 CC1(C(=O)O)CCCC1 Amb482493 [1,0,0,1,0,0|1,0,0]=3 4221 B9R1.163 CC1(C(=O)O)CCCN1 Amb15701407 [1,0,0,1,0,0|2,0,0]=4 4222 B9R1.163 CC1(C(=O)O)CCCN1 Amb22587331 [1,0,0,1,0,0|2,0,0]=4 4223 B9R1.163 CC1(C(=O)O)CCCO1 Amb1088877 [1,0,0,1,0,0|2,0,0]=4 4224 B9R1.163 CC1(C(=O)O)CCCS1 Amb20623191 [1,0,0,1,0,0|2,0,0]=4 4225 B9R1.163 CC1(C(=O)O)CCNC1 Amb20634439 [1,0,0,1,0,0|2,0,0]=4 4226 B9R1.163 CC1(C(=O)O)CCNC1 Amb2683246 [1,0,0,1,0,0|2,0,0]=4 4227 B9R1.163 CC1(C(=O)O)CCOC1 Amb18280535 [1,0,0,1,0,0|2,0,0]=4 4228 B9R1.163 CC1(C(=O)O)CCSC1 Amb27782020 [1,0,0,1,0,0|2,0,0]=4 4229 B9R1.163 CC1(C(N)=O)CCCC1 Amb4018896 [1,0,0,1,0,0|1,0,0]=3 4230 B9R1.163 CC1(C(N)=O)CCCN1 Amb20061427 [1,0,0,1,0,0|2,0,0]=4 4231 B9R1.163 CC1(C(N)=O)CCNC1 Amb27474417 [1,0,0,1,0,0|2,0,0]=4 4232 B9R1.163 CC1([N+](=O)[O-])CCCC1 Amb27643895 [1,0,0,1,0,0|2,0,0]=4 4233 B9R1.163 CN(C)C1(C)CCCC1 Amb27485740 [1,0,0,1,0,0|2,0,0]=4 4234 B9R1.163 C[C@@H](N)C1(C)CCCC1 Amb28385735 [1,0,0,1,0,0|1,0,1]=4 4235 B9R1.163 C[C@@H](O)C1(C)CCCC1 Amb27591700 [1,0,0,1,0,0|0,0,2]=4 4236 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb10603262 [1,0,0,1,0,0|2,0,0]=4 4237 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb22405952 [1,0,0,1,0,0|2,0,0]=4 4238 B9R1.163 C[C@@]1(C(=O)O)CCCO1 Amb27600317 [1,0,0,1,0,0|2,0,0]=4 4239 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Amb26869183 [1,0,0,1,0,0|2,0,0]=4 4240 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb24410858 [1,0,0,1,0,0|2,0,0]=4 4241 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb33457642 [1,0,0,1,0,0|2,0,0]=4 4242 B9R1.163 C[C@H](N)C1(C)CCCC1 Amb27400446 [1,0,0,1,0,0|1,0,1]=4 4243 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb22406107 [1,0,0,1,0,0|2,0,0]=4 4244 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb8630480 [1,0,0,1,0,0|2,0,0]=4 4245 B9R1.163 C[C@]1(C(=O)O)CCCO1 Amb24117235 [1,0,0,1,0,0|2,0,0]=4 4246 B9R1.163 C[C@]1(C(=O)O)CCNC1 Amb24346794 [1,0,0,1,0,0|2,0,0]=4 4247 B9R1.163 C[C@]1(C(N)=O)CCCN1 Amb25146194 [1,0,0,1,0,0|2,0,0]=4 4248 B9R1.163 N=C(N)C1(O)CCCC1 Amb27876344 [1,0,0,1,0,0|2,0,0]=4 4249 B9R1.163 NC(=O)C1(Cl)CCCC1 Amb27879093 [1,0,0,1,0,0|2,0,0]=4 4250 B9R1.163 NC(=O)C1(F)CCCC1 Amb28193242 [1,0,0,1,0,0|2,0,0]=4 4251 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [1,0,0,1,0,0|2,0,0]=4 4252 B9R1.163 NC(=O)C1(N)CCCC1 Amb8628017 [1,0,0,1,0,0|2,0,0]=4 4253 B9R1.163 NC(=O)C1(O)CCCC1 Amb33529797 [1,0,0,1,0,0|1,0,0]=3 4254 B9R1.163 NC(=O)C1(O)CCNC1 Amb23515119 [1,0,0,1,0,0|2,0,0]=4 4255 B9R1.163 NC(=O)C1(O)CCNC1 Amb28555395 [1,0,0,1,0,0|2,0,0]=4 4256 B9R1.163 NC(=O)C1(O)CCSC1 Amb24116837 [1,0,0,1,0,0|2,0,0]=4 4257 B9R1.163 NC1(C(=O)Cl)CCCC1 Amb27236109 [1,0,0,1,0,0|2,0,0]=4 4258 B9R1.163 NC1(C(=O)O)CCCC1 Amb1838882 [1,0,0,1,0,0|2,0,0]=4 4259 B9R1.163 O=C(Cl)C1(Br)CCCC1 Amb25888908 [1,0,0,1,0,0|2,0,0]=4 4260 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [1,0,0,1,0,0|2,0,0]=4 4261 B9R1.163 O=C(O)C1(Br)CCCC1 Amb17595053 [1,0,0,1,0,0|2,0,0]=4 4262 B9R1.163 O=C(O)C1(Cl)CCCC1 Amb32716554 [1,0,0,1,0,0|2,0,0]=4 4263 B9R1.163 O=C(O)C1(F)CCCC1 Amb26957187 [1,0,0,1,0,0|2,0,0]=4 4264 B9R1.163 O=C(O)C1(O)CCCC1 Amb1159211 [1,0,0,1,0,0|1,0,0]=3 4265 B9R1.163 O=C(O)C1(O)CCNC1 Amb22500918 [1,0,0,1,0,0|2,0,0]=4 4266 B9R1.163 O=C(O)C1(O)CCNC1 Amb22899772 [1,0,0,1,0,0|2,0,0]=4 4267 B9R1.163 O=C(O)C1(O)CCOC1 Amb26332318 [1,0,0,1,0,0|2,0,0]=4 4268 B9R1.163 O=C(O)C1(O)CCSC1 Amb18944714 [1,0,0,1,0,0|2,0,0]=4 4269 B9R1.163 O=C(O)C1(S)CCCC1 Amb27185727 [1,0,0,1,0,0|1,1,0]=4 4270 B9R1.163 O=C(O)[C@@]1(O)CCSC1 Amb28119971 [1,0,0,1,0,0|2,0,0]=4 4271 B9R1.1 C=CC1CCC(C)CC1 Amb26849223 [1,0,0,1,0,0|1,0,1]=4 4272 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [1,0,0,1,0,0|1,0,1]=4 4273 B9R1.1 CC1CC=C(CO)CN1 Amb27186346 [1,0,0,1,0,0|1,0,1]=4 4274 B9R1.1 CC1CCC(C#N)CO1 Amb29849402 [1,0,0,1,0,0|1,0,1]=4 4275 B9R1.1 CC1CCC(C=O)CC1 Amb18642467 [1,0,0,1,0,0|1,0,0]=3 4276 B9R1.1 CC1CCC(C=O)CO1 Amb35732769 [1,0,0,1,0,0|0,0,0]=2 4277 B9R1.1 CC1CCC(C=O)OC1 Amb27827433 [1,0,0,1,0,0|2,0,0]=4 4278 B9R1.1 CC1CCC(CBr)CC1 Amb22886696 [1,0,0,1,0,0|1,0,1]=4 4279 B9R1.1 CC1CCC(CBr)CO1 Amb35679306 [1,0,0,1,0,0|1,0,1]=4 4280 B9R1.1 CC1CCC(CBr)OC1 Amb35788523 [1,0,0,1,0,0|2,0,0]=4 4281 B9R1.1 CC1CCC(CCl)CC1 Amb26498565 [1,0,0,1,0,0|1,0,1]=4 4282 B9R1.1 CC1CCC(CCl)CO1 Amb35679305 [1,0,0,1,0,0|1,0,1]=4 4283 B9R1.1 CC1CCC(CN)CC1 Amb8950179 [1,0,0,1,0,0|1,0,1]=4 4284 B9R1.1 CC1CCC(CN)CO1 Amb29860382 [1,0,0,1,0,0|1,0,1]=4 4285 B9R1.1 CC1CCC(CN)NC1 Amb25379312 [1,0,0,1,0,0|2,0,0]=4 4286 B9R1.1 CC1CCC(CN)NC1 Amb35749606 [1,0,0,1,0,0|2,0,0]=4 4287 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [1,0,0,1,0,0|0,0,1]=3 4288 B9R1.1 CC1CCC(CO)CN1 Amb22886321 [1,0,0,1,0,0|1,0,1]=4 4289 B9R1.1 CC1CCC(CO)CO1 Amb35678925 [1,0,0,1,0,0|0,0,2]=4 4290 B9R1.1 CC1CCC(CO)NC1 Amb22886337 [1,0,0,1,0,0|1,0,0]=3 4291 B9R1.1 CC1CCC(CO)OC1 Amb27833600 [1,0,0,1,0,0|1,0,0]=3 4292 B9R1.1 CC1CCC(CS)CC1 Amb25188956 [1,0,0,1,0,0|0,1,1]=4 4293 B9R1.1 CC1CCC(NN)CO1 Amb35682289 [1,0,0,1,0,0|2,0,0]=4 4294 B9R1.1 CC1CCC(NO)CO1 Amb35703066 [1,0,0,1,0,0|1,0,1]=4 4295 B9R1.1 CC1CNC(CO)CN1 Amb17578108 [1,0,0,1,0,0|2,0,0]=4 4296 B9R1.1 CC1CNC(CO)CS1 Amb27424676 [1,0,0,1,0,0|2,0,0]=4 4297 B9R1.1 CC1COC(CO)CN1 Amb20669470 [1,0,0,1,0,0|2,0,0]=4 4298 B9R1.1 CC1CSC(CO)CN1 Amb28318729 [1,0,0,1,0,0|2,0,0]=4 4299 B9R1.1 CCC1CCC(C)CC1 Amb22227949 [1,0,0,1,0,0|1,0,1]=4 4300 B9R1.1 CCC1CCC(C)CN1 Amb27668440 [1,0,0,1,0,0|2,0,0]=4 4301 B9R1.1 CCC1CCC(C)NC1 Amb2782904 [1,0,0,1,0,0|1,0,1]=4 4302 B9R1.1 CCC1CCC(C)NC1 Amb28934993 [1,0,0,1,0,0|1,0,1]=4 4303 B9R1.1 CCC1COC(C)CN1 Amb9702470 [1,0,0,1,0,0|1,0,1]=4 4304 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb32665354 [1,0,0,1,0,0|1,0,1]=4 4305 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb33484385 [1,0,0,1,0,0|1,0,1]=4 4306 B9R1.1 CC[C@@H]1CC[C@H](C)NC1 Amb26423925 [1,0,0,1,0,0|1,0,1]=4 4307 B9R1.1 CC[C@H]1CCC(C)NC1 Amb28196699 [1,0,0,1,0,0|1,0,1]=4 4308 B9R1.1 CC[C@H]1CC[C@@H](C)CC1 Amb22230416 [1,0,0,1,0,0|1,0,1]=4 4309 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb26528612 [1,0,0,1,0,0|1,0,1]=4 4310 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb32652730 [1,0,0,1,0,0|1,0,1]=4 4311 B9R1.1 CN1CC=C(CO)CC1 Amb22754040 [1,0,0,1,0,0|1,0,1]=4 4312 B9R1.1 CN1CC=C(CO)CC1 Amb32662654 [1,0,0,1,0,0|1,0,1]=4 4313 B9R1.1 CN1CCC(C=O)CC1 Amb22394884 [1,0,0,1,0,0|2,0,0]=4 4314 B9R1.1 CN1CCC(C=O)CC1 Amb22587018 [1,0,0,1,0,0|2,0,0]=4 4315 B9R1.1 CN1CCC(C=O)CC1 Amb7808814 [1,0,0,1,0,0|2,0,0]=4 4316 B9R1.1 CN1CCC(CO)CC1 Amb1099350 [1,0,0,1,0,0|1,0,1]=4 4317 B9R1.1 CN1CCC(CO)CC1 Amb32410101 [1,0,0,1,0,0|1,0,1]=4 4318 B9R1.1 CNC1CCC(C)CC1 Amb33334646 [1,0,0,1,0,0|2,0,0]=4 4319 B9R1.1 CNC1CCC(C)CC1 Amb426857 [1,0,0,1,0,0|2,0,0]=4 4320 B9R1.1 CNC1CCC(C)OC1 Amb35703065 [1,0,0,1,0,0|1,0,0]=3 4321 B9R1.1 CNC1CCC(C)SC1 Amb35698163 [1,0,0,1,0,0|1,1,0]=4 4322 B9R1.1 CN[C@H]1CC[C@H](C)CC1 Amb24745527 [1,0,0,1,0,0|2,0,0]=4 4323 B9R1.1 COC1CCC(C)CC1 Amb24323754 [1,0,0,1,0,0|2,0,0]=4 4324 B9R1.1 COC1CCC(C)NC1 Amb18946448 [1,0,0,1,0,0|2,0,0]=4 4325 B9R1.1 COC1CCC(O)OC1 Amb27805680 [1,0,0,1,0,0|2,0,0]=4 4326 B9R1.1 CO[C@H]1CC[C@@H](O)OC1 Amb28344966 [1,0,0,1,0,0|2,0,0]=4 4327 B9R1.1 C[C@@H]1CCC(CO)CN1 Amb27424728 [1,0,0,1,0,0|1,0,1]=4 4328 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35788826 [1,0,0,1,0,0|2,0,0]=4 4329 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35789057 [1,0,0,1,0,0|2,0,0]=4 4330 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24062957 [1,0,0,1,0,0|1,0,1]=4 4331 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24515133 [1,0,0,1,0,0|1,0,1]=4 4332 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb26027160 [1,0,0,1,0,0|1,0,0]=3 4333 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb35750775 [1,0,0,1,0,0|1,0,0]=3 4334 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb27986119 [1,0,0,1,0,0|1,0,1]=4 4335 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb30869370 [1,0,0,1,0,0|1,0,1]=4 4336 B9R1.1 C[C@@H]1CN[C@@H](CO)CN1 Amb30868000 [1,0,0,1,0,0|2,0,0]=4 4337 B9R1.1 C[C@@H]1CO[C@H](CO)CN1 Amb27259238 [1,0,0,1,0,0|2,0,0]=4 4338 B9R1.1 C[C@H]1CC[C@@H](C=O)CC1 Amb27614173 [1,0,0,1,0,0|1,0,0]=3 4339 B9R1.1 C[C@H]1CC[C@@H](CBr)CC1 Amb27185733 [1,0,0,1,0,0|1,0,1]=4 4340 B9R1.1 C[C@H]1CC[C@@H](CO)CC1 Amb26407994 [1,0,0,1,0,0|0,0,1]=3 4341 B9R1.1 C[C@H]1CC[C@@H](CO)CN1 Amb33801087 [1,0,0,1,0,0|1,0,1]=4 4342 B9R1.1 C[C@H]1CC[C@@H](CO)NC1 Amb27630533 [1,0,0,1,0,0|1,0,0]=3 4343 B9R1.1 C[C@H]1CC[C@H](C=O)CC1 Amb25075627 [1,0,0,1,0,0|1,0,0]=3 4344 B9R1.1 C[C@H]1CC[C@H](CBr)CC1 Amb28458303 [1,0,0,1,0,0|1,0,1]=4 4345 B9R1.1 C[C@H]1CC[C@H](CN)CC1 Amb27393144 [1,0,0,1,0,0|1,0,1]=4 4346 B9R1.1 C[C@H]1CC[C@H](CO)CC1 Amb22886817 [1,0,0,1,0,0|0,0,1]=3 4347 B9R1.1 C\C=C1\CCC(O)OC1 Amb27652876 [1,0,0,1,0,0|1,0,1]=4 4348 B9R1.1 NC1CCC(CO)CC1 Amb6740014 [1,0,0,1,0,0|1,0,1]=4 4349 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [1,0,0,1,0,0|1,0,1]=4 4350 B9R1.1 N[C@@H]1CC[C@@H](CO)OC1 Amb28204004 [1,0,0,1,0,0|2,0,0]=4 4351 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [1,0,0,1,0,0|1,0,1]=4 4352 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb20668772 [1,0,0,1,0,0|1,0,1]=4 4353 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb22899692 [1,0,0,1,0,0|1,0,1]=4 4354 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb17607961 [1,0,0,1,0,0|1,0,1]=4 4355 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb22747955 [1,0,0,1,0,0|1,0,1]=4 4356 B9R1.1 O=CC1CCC(F)CC1 Amb27795353 [1,0,0,1,0,0|2,0,0]=4 4357 B9R1.1 O=CC1CCC(O)CC1 Amb26974592 [1,0,0,1,0,0|2,0,0]=4 4358 B9R1.1 O=C[C@H]1CC[C@H](O)CC1 Amb27799758 [1,0,0,1,0,0|2,0,0]=4 4359 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [1,0,0,1,0,0|1,0,1]=4 4360 B9R1.1 OCC1CCC(F)CC1 Amb24122685 [1,0,0,1,0,0|1,0,1]=4 4361 B9R1.1 OCC1CCC(O)CC1 Amb13883568 [1,0,0,1,0,0|1,0,1]=4 4362 B9R1.1 OCC1CCC(O)CN1 Amb5720009 [1,0,0,1,0,0|2,0,0]=4 4363 B9R1.1 OCC1CCC(O)CO1 Amb28312865 [1,0,0,1,0,0|2,0,0]=4 4364 B9R1.1 OC[C@@H]1CC[C@@H](O)CN1 Amb27249840 [1,0,0,1,0,0|2,0,0]=4 4365 B9R1.1 OC[C@@H]1CC[C@H](O)CO1 Amb27457666 [1,0,0,1,0,0|2,0,0]=4 4366 B9R1.1 OC[C@H]1CC[C@@H](F)CC1 Amb34163407 [1,0,0,1,0,0|1,0,1]=4 4367 B9R1.1 OC[C@H]1CC[C@@H](O)CC1 Amb26345146 [1,0,0,1,0,0|1,0,1]=4 4368 B9R1.1 OC[C@H]1CC[C@H](F)CC1 Amb34165509 [1,0,0,1,0,0|1,0,1]=4 4369 B9R1.1 OC[C@H]1CC[C@H](O)CC1 Amb25320791 [1,0,0,1,0,0|1,0,1]=4 4370 B9R1.4 CCCC1CCC1CBr Amb33512086 [1,0,0,1,0,0|1,0,1]=4 4371 B9R1.4 CCCC1CCC1CN Amb27252657 [1,0,0,1,0,0|1,0,1]=4 4372 B9R1.4 CCC[C@H]1CN[C@@H]1CO Amb27194660 [1,0,0,1,0,0|1,0,0]=3 4373 B9R1.4 CCOC1CCC1CO Amb27456621 [1,0,0,1,0,0|1,0,1]=4 4374 B9R1.12 BrCCCC1CCOC1 Amb26961533 [1,0,0,1,0,0|1,0,1]=4 4375 B9R1.12 CCCCC1=CCCC1 Amb22227915 [1,0,0,1,0,0|1,0,1]=4 4376 B9R1.12 CCCCC1CCCC1 Amb22053873 [1,0,0,1,0,0|1,0,1]=4 4377 B9R1.12 CCCCC1CCCN1 Amb22587191 [1,0,0,1,0,0|2,0,0]=4 4378 B9R1.12 CCCCC1CCCN1 Amb9712880 [1,0,0,1,0,0|2,0,0]=4 4379 B9R1.12 CCCCC1CCCO1 Amb25238477 [1,0,0,1,0,0|2,0,0]=4 4380 B9R1.12 CCCCC1CCNC1 Amb2237160 [1,0,0,1,0,0|1,0,1]=4 4381 B9R1.12 CCCCN1CCOC1 Amb27838563 [1,0,0,1,0,0|1,0,1]=4 4382 B9R1.12 CCCC[C@H]1CNCN1 Amb28239669 [1,0,0,1,0,0|2,0,0]=4 4383 B9R1.12 CCNCC1CCOC1 Amb32410098 [1,0,0,1,0,0|1,0,1]=4 4384 B9R1.12 CCNCC1CCOC1 Amb9721559 [1,0,0,1,0,0|1,0,1]=4 4385 B9R1.12 CNCCC1CCOC1 Amb18993054 [1,0,0,1,0,0|1,0,1]=4 4386 B9R1.12 CNCCC1CCOC1 Amb32410667 [1,0,0,1,0,0|1,0,1]=4 4387 B9R1.12 ClCCCC1CCOC1 Amb27832511 [1,0,0,1,0,0|1,0,1]=4 4388 B9R1.12 ICCCC1CCOC1 Amb27172797 [1,0,0,1,0,0|1,0,1]=4 4389 B9R1.12 NCCCC1CCOC1 Amb1090895 [1,0,0,1,0,0|1,0,1]=4 4390 B9R1.12 NCCCC1CCOC1 Amb21954298 [1,0,0,1,0,0|1,0,1]=4 4391 B9R1.12 SCCCC1CCOC1 Amb27221392 [1,0,0,1,0,0|1,0,1]=4 4392 B9R1.15 C#CC1CCCCC1O Amb27466451 [1,0,0,1,0,0|0,0,2]=4 4393 B9R1.15 C#C[C@@H]1CCCC[C@@H]1O Amb26892452 [1,0,0,1,0,0|0,0,2]=4 4394 B9R1.15 C#C[C@@H]1CCCC[C@H]1O Amb25990553 [1,0,0,1,0,0|0,0,2]=4 4395 B9R1.15 C=C1CCCCC1CC Amb27952112 [1,0,0,1,0,0|1,0,1]=4 4396 B9R1.15 C=CC1CCCCC1Br Amb27430278 [1,0,0,1,0,0|1,0,1]=4 4397 B9R1.15 C=CC1CCCCC1O Amb25706048 [1,0,0,1,0,0|0,0,1]=3 4398 B9R1.15 C=CC1OCCCC1O Amb27972502 [1,0,0,1,0,0|1,0,1]=4 4399 B9R1.15 C=C[C@@H]1CCCC[C@@H]1O Amb27427803 [1,0,0,1,0,0|0,0,1]=3 4400 B9R1.15 C=C[C@@H]1CCCC[C@H]1O Amb22802080 [1,0,0,1,0,0|0,0,1]=3 4401 B9R1.15 C=C[C@@H]1COCC[C@@H]1O Amb28129747 [1,0,0,1,0,0|1,0,1]=4 4402 B9R1.15 C=C[C@@H]1OCCC[C@H]1O Amb27205666 [1,0,0,1,0,0|1,0,1]=4 4403 B9R1.15 C=C[C@H]1CCCC[C@@H]1O Amb28256773 [1,0,0,1,0,0|0,0,1]=3 4404 B9R1.15 C=C[C@H]1CCCC[C@H]1N Amb28428608 [1,0,0,1,0,0|1,0,1]=4 4405 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [1,0,0,1,0,0|0,0,1]=3 4406 B9R1.15 CC1CCCCC1C=O Amb18642449 [1,0,0,1,0,0|1,0,0]=3 4407 B9R1.15 CC1CCCCC1CBr Amb28458445 [1,0,0,1,0,0|1,0,1]=4 4408 B9R1.15 CC1CCCCC1CN Amb10610368 [1,0,0,1,0,0|1,0,1]=4 4409 B9R1.15 CC1CCCCC1CN Amb8950173 [1,0,0,1,0,0|1,0,1]=4 4410 B9R1.15 CC1CCCCC1CO Amb25804856 [1,0,0,1,0,0|0,0,1]=3 4411 B9R1.15 CC1CCCCC1CS Amb27231870 [1,0,0,1,0,0|0,1,1]=4 4412 B9R1.15 CC1CCCNC1CO Amb22886363 [1,0,0,1,0,0|1,0,1]=4 4413 B9R1.15 CC1CCCNC1CO Amb32658045 [1,0,0,1,0,0|1,0,1]=4 4414 B9R1.15 CC1CCNCC1CO Amb24117064 [1,0,0,1,0,0|1,0,1]=4 4415 B9R1.15 CC1CNCCC1CO Amb27766043 [1,0,0,1,0,0|1,0,1]=4 4416 B9R1.15 CC1NCCCC1CO Amb22886280 [1,0,0,1,0,0|1,0,1]=4 4417 B9R1.15 CC1OCCCC1C=O Amb27872989 [1,0,0,1,0,0|2,0,0]=4 4418 B9R1.15 CCC1CCCCC1=O Amb22002104 [1,0,0,1,0,0|1,0,0]=3 4419 B9R1.15 CCC1CCCCC1Br Amb19076564 [1,0,0,1,0,0|1,0,1]=4 4420 B9R1.15 CCC1CCCCC1C Amb22232355 [1,0,0,1,0,0|1,0,1]=4 4421 B9R1.15 CCC1CCCCC1Cl Amb27751430 [1,0,0,1,0,0|1,0,1]=4 4422 B9R1.15 CCC1CCCCC1N Amb9776218 [1,0,0,1,0,0|1,0,1]=4 4423 B9R1.15 CCC1CCCCC1O Amb6608702 [1,0,0,1,0,0|0,0,1]=3 4424 B9R1.15 CCC1CCCCC1S Amb25360773 [1,0,0,1,0,0|0,1,1]=4 4425 B9R1.15 CCC1CCCCN1O Amb27483076 [1,0,0,1,0,0|1,0,1]=4 4426 B9R1.15 CCC1CCCNC1=O Amb22276357 [1,0,0,1,0,0|2,0,0]=4 4427 B9R1.15 CCC1CCOCC1=O Amb33295409 [1,0,0,1,0,0|2,0,0]=4 4428 B9R1.15 CCC1CNCCC1=O Amb18642532 [1,0,0,1,0,0|2,0,0]=4 4429 B9R1.15 CCC1CNCCC1=O Amb23400918 [1,0,0,1,0,0|2,0,0]=4 4430 B9R1.15 CCC1COCCC1=O Amb25687037 [1,0,0,1,0,0|2,0,0]=4 4431 B9R1.15 CCC1NCCCC1=O Amb19888368 [1,0,0,1,0,0|2,0,0]=4 4432 B9R1.15 CCC1NCCCC1=O Amb28055859 [1,0,0,1,0,0|2,0,0]=4 4433 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [1,0,0,1,0,0|1,0,0]=3 4434 B9R1.15 CC[C@@H]1CCCC[C@@H]1N Amb27438938 [1,0,0,1,0,0|1,0,1]=4 4435 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [1,0,0,1,0,0|0,0,1]=3 4436 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [1,0,0,1,0,0|2,0,0]=4 4437 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [1,0,0,1,0,0|2,0,0]=4 4438 B9R1.15 CC[C@H]1CCCCC1N Amb27412189 [1,0,0,1,0,0|1,0,1]=4 4439 B9R1.15 CC[C@H]1CCCC[C@@H]1C Amb25911410 [1,0,0,1,0,0|1,0,1]=4 4440 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [1,0,0,1,0,0|0,0,1]=3 4441 B9R1.15 CC[C@H]1CCCC[C@H]1C Amb25294655 [1,0,0,1,0,0|1,0,1]=4 4442 B9R1.15 CC[C@H]1CCCC[C@H]1N Amb27848812 [1,0,0,1,0,0|1,0,1]=4 4443 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [1,0,0,1,0,0|0,0,1]=3 4444 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [1,0,0,1,0,0|2,0,0]=4 4445 B9R1.15 CN1CCCCC1CBr Amb21961477 [1,0,0,1,0,0|2,0,0]=4 4446 B9R1.15 CN1CCCCC1CBr Amb6316170 [1,0,0,1,0,0|2,0,0]=4 4447 B9R1.15 CN1CCCCC1CCl Amb10068244 [1,0,0,1,0,0|2,0,0]=4 4448 B9R1.15 CN1CCCCC1CCl Amb9174214 [1,0,0,1,0,0|2,0,0]=4 4449 B9R1.15 CN1CCCCC1CN Amb22727986 [1,0,0,1,0,0|2,0,0]=4 4450 B9R1.15 CN1CCCCC1CN Amb8503454 [1,0,0,1,0,0|2,0,0]=4 4451 B9R1.15 CN1CCCCC1CN Amb9731145 [1,0,0,1,0,0|2,0,0]=4 4452 B9R1.15 CN1CCCCC1CO Amb607577 [1,0,0,1,0,0|1,0,0]=3 4453 B9R1.15 CN1CCCCC1CS Amb27272821 [1,0,0,1,0,0|1,1,0]=4 4454 B9R1.15 CN1CCCC[C@@H]1CN Amb24411478 [1,0,0,1,0,0|2,0,0]=4 4455 B9R1.15 CN1CCCC[C@@H]1CO Amb22744972 [1,0,0,1,0,0|1,0,0]=3 4456 B9R1.15 CN1CCCC[C@H]1C=O Amb27798376 [1,0,0,1,0,0|2,0,0]=4 4457 B9R1.15 CN1CCCC[C@H]1CCl Amb27831756 [1,0,0,1,0,0|2,0,0]=4 4458 B9R1.15 CN1CCCC[C@H]1CN Amb27249510 [1,0,0,1,0,0|2,0,0]=4 4459 B9R1.15 CN1CCCC[C@H]1CO Amb26917816 [1,0,0,1,0,0|1,0,0]=3 4460 B9R1.15 CN1CCNCC1CO Amb17578109 [1,0,0,1,0,0|2,0,0]=4 4461 B9R1.15 CN1CCNCC1CO Amb22587293 [1,0,0,1,0,0|2,0,0]=4 4462 B9R1.15 CN1CCOCC1CO Amb27664360 [1,0,0,1,0,0|2,0,0]=4 4463 B9R1.15 CN1CCOCC1CO Amb30867931 [1,0,0,1,0,0|2,0,0]=4 4464 B9R1.15 CN1CCOC[C@@H]1CO Amb26026394 [1,0,0,1,0,0|2,0,0]=4 4465 B9R1.15 CN1CCOC[C@@H]1CO Amb34916358 [1,0,0,1,0,0|2,0,0]=4 4466 B9R1.15 CN1CCOC[C@H]1CO Amb28429680 [1,0,0,1,0,0|2,0,0]=4 4467 B9R1.15 CN1CCOC[C@H]1CO Amb33743375 [1,0,0,1,0,0|2,0,0]=4 4468 B9R1.15 CNC1CCCCC1=O Amb28984230 [1,0,0,1,0,0|2,0,0]=4 4469 B9R1.15 CNC1CCCCC1=O Amb3644506 [1,0,0,1,0,0|2,0,0]=4 4470 B9R1.15 CNC1CCCCC1C Amb1116060 [1,0,0,1,0,0|2,0,0]=4 4471 B9R1.15 CNC1CCCCC1C Amb6239354 [1,0,0,1,0,0|2,0,0]=4 4472 B9R1.15 CNC1CCCCC1F Amb23443827 [1,0,0,1,0,0|2,0,0]=4 4473 B9R1.15 CNC1CCCCC1O Amb2607700 [1,0,0,1,0,0|1,0,0]=3 4474 B9R1.15 CNC1CCCCC1S Amb18644222 [1,0,0,1,0,0|1,1,0]=4 4475 B9R1.15 CNC1CNCCC1O Amb32753118 [1,0,0,1,0,0|2,0,0]=4 4476 B9R1.15 CN[C@@H]1CCCC[C@@H]1C Amb25742534 [1,0,0,1,0,0|2,0,0]=4 4477 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993808 [1,0,0,1,0,0|1,0,0]=3 4478 B9R1.15 CN[C@@H]1CCCC[C@@H]1S Amb27249842 [1,0,0,1,0,0|1,1,0]=4 4479 B9R1.15 CN[C@@H]1CCCC[C@H]1N Amb27467467 [1,0,0,1,0,0|2,0,0]=4 4480 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993807 [1,0,0,1,0,0|1,0,0]=3 4481 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993918 [1,0,0,1,0,0|1,0,0]=3 4482 B9R1.15 CN[C@@H]1CCCC[C@H]1S Amb27188343 [1,0,0,1,0,0|1,1,0]=4 4483 B9R1.15 CN[C@H]1CCCC[C@@H]1C Amb27195019 [1,0,0,1,0,0|2,0,0]=4 4484 B9R1.15 CN[C@H]1CCCC[C@@H]1O Amb5562396 [1,0,0,1,0,0|1,0,0]=3 4485 B9R1.15 CN[C@H]1CCCC[C@H]1O Amb2786031 [1,0,0,1,0,0|1,0,0]=3 4486 B9R1.15 CN[C@H]1CNCC[C@@H]1O Amb32657883 [1,0,0,1,0,0|2,0,0]=4 4487 B9R1.15 COC1CCCCC1=O Amb4606000 [1,0,0,1,0,0|2,0,0]=4 4488 B9R1.15 COC1CCCCC1Br Amb18321009 [1,0,0,1,0,0|2,0,0]=4 4489 B9R1.15 COC1CCCCC1I Amb25189979 [1,0,0,1,0,0|2,0,0]=4 4490 B9R1.15 COC1CCCCC1N Amb23438872 [1,0,0,1,0,0|2,0,0]=4 4491 B9R1.15 COC1CCCCC1N Amb6660864 [1,0,0,1,0,0|2,0,0]=4 4492 B9R1.15 COC1CCCCC1O Amb9283578 [1,0,0,1,0,0|1,0,0]=3 4493 B9R1.15 COC1CCCCC1S Amb25868109 [1,0,0,1,0,0|1,1,0]=4 4494 B9R1.15 COC1CCCC[C@H]1N Amb27430189 [1,0,0,1,0,0|2,0,0]=4 4495 B9R1.15 COC1CCCOC1O Amb27196451 [1,0,0,1,0,0|2,0,0]=4 4496 B9R1.15 COC1CCOCC1O Amb27838564 [1,0,0,1,0,0|2,0,0]=4 4497 B9R1.15 COC1CNCCC1O Amb24624663 [1,0,0,1,0,0|2,0,0]=4 4498 B9R1.15 COC1COCCC1O Amb25733031 [1,0,0,1,0,0|2,0,0]=4 4499 B9R1.15 COC1OCCCC1O Amb25284546 [1,0,0,1,0,0|2,0,0]=4 4500 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [1,0,0,1,0,0|2,0,0]=4 4501 B9R1.15 CO[C@@H]1CCCC[C@@H]1Br Amb27777572 [1,0,0,1,0,0|2,0,0]=4 4502 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Amb25026218 [1,0,0,1,0,0|2,0,0]=4 4503 B9R1.15 CO[C@@H]1CCCC[C@@H]1O Amb24671865 [1,0,0,1,0,0|1,0,0]=3 4504 B9R1.15 CO[C@@H]1CCCC[C@H]1Br Amb25968817 [1,0,0,1,0,0|2,0,0]=4 4505 B9R1.15 CO[C@@H]1CCCC[C@H]1I Amb33733603 [1,0,0,1,0,0|2,0,0]=4 4506 B9R1.15 CO[C@@H]1CCCC[C@H]1N Amb26887845 [1,0,0,1,0,0|2,0,0]=4 4507 B9R1.15 CO[C@@H]1CCCC[C@H]1O Amb17940177 [1,0,0,1,0,0|1,0,0]=3 4508 B9R1.15 CO[C@@H]1CCNC[C@@H]1O Amb25691574 [1,0,0,1,0,0|2,0,0]=4 4509 B9R1.15 CO[C@@H]1CCNC[C@@H]1O Amb30594247 [1,0,0,1,0,0|2,0,0]=4 4510 B9R1.15 CO[C@@H]1CCNC[C@H]1O Amb23439820 [1,0,0,1,0,0|2,0,0]=4 4511 B9R1.15 CO[C@@H]1CCNC[C@H]1O Amb31028944 [1,0,0,1,0,0|2,0,0]=4 4512 B9R1.15 CO[C@@H]1CCOC[C@H]1O Amb27202827 [1,0,0,1,0,0|2,0,0]=4 4513 B9R1.15 CO[C@@H]1OCCC[C@@H]1O Amb27844176 [1,0,0,1,0,0|2,0,0]=4 4514 B9R1.15 CO[C@H]1CCCCC1=O Amb8386937 [1,0,0,1,0,0|2,0,0]=4 4515 B9R1.15 CO[C@H]1CCCC[C@@H]1Br Amb28193934 [1,0,0,1,0,0|2,0,0]=4 4516 B9R1.15 CO[C@H]1CCCC[C@@H]1N Amb28383875 [1,0,0,1,0,0|2,0,0]=4 4517 B9R1.15 CO[C@H]1CCCC[C@@H]1O Amb22047253 [1,0,0,1,0,0|1,0,0]=3 4518 B9R1.15 CO[C@H]1CCCC[C@H]1Br Amb27444168 [1,0,0,1,0,0|2,0,0]=4 4519 B9R1.15 CO[C@H]1CCCC[C@H]1N Amb27961504 [1,0,0,1,0,0|2,0,0]=4 4520 B9R1.15 CO[C@H]1CCNC[C@@H]1O Amb25973383 [1,0,0,1,0,0|2,0,0]=4 4521 B9R1.15 CO[C@H]1CCNC[C@@H]1O Amb33806366 [1,0,0,1,0,0|2,0,0]=4 4522 B9R1.15 CO[C@H]1CNCC[C@@H]1O Amb34913075 [1,0,0,1,0,0|2,0,0]=4 4523 B9R1.15 CO[C@H]1CNCC[C@H]1O Amb34912825 [1,0,0,1,0,0|2,0,0]=4 4524 B9R1.15 CO[C@H]1OCCC[C@@H]1O Amb27221641 [1,0,0,1,0,0|2,0,0]=4 4525 B9R1.15 CSC1CCCCC1=O Amb19267090 [1,0,0,1,0,0|2,0,0]=4 4526 B9R1.15 CSC1CCCCC1Br Amb28381116 [1,0,0,1,0,0|2,0,0]=4 4527 B9R1.15 CSC1CCCCC1F Amb24382198 [1,0,0,1,0,0|2,0,0]=4 4528 B9R1.15 CSC1CCCCC1N Amb18644219 [1,0,0,1,0,0|2,0,0]=4 4529 B9R1.15 CSC1CCCCC1N Amb32665004 [1,0,0,1,0,0|2,0,0]=4 4530 B9R1.15 CSC1CCCCC1O Amb27810883 [1,0,0,1,0,0|1,0,0]=3 4531 B9R1.15 CS[C@@H]1CCCC[C@H]1F Amb26564270 [1,0,0,1,0,0|2,0,0]=4 4532 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb26952114 [1,0,0,1,0,0|2,0,0]=4 4533 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb32661030 [1,0,0,1,0,0|2,0,0]=4 4534 B9R1.15 CS[C@@H]1CCCC[C@H]1O Amb27822799 [1,0,0,1,0,0|1,0,0]=3 4535 B9R1.15 CS[C@H]1CCCC[C@@H]1N Amb28901399 [1,0,0,1,0,0|2,0,0]=4 4536 B9R1.15 CS[C@H]1CCCC[C@@H]1O Amb24424734 [1,0,0,1,0,0|1,0,0]=3 4537 B9R1.15 C[C@@H]1CCCC[C@H]1C=O Amb28248314 [1,0,0,1,0,0|1,0,0]=3 4538 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb27205665 [1,0,0,1,0,0|0,0,1]=3 4539 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb28247947 [1,0,0,1,0,0|1,0,1]=4 4540 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb32658745 [1,0,0,1,0,0|1,0,1]=4 4541 B9R1.15 C[C@@H]1CCCN[C@H]1CO Amb28456652 [1,0,0,1,0,0|1,0,1]=4 4542 B9R1.15 C[C@@H]1CCCO[C@H]1C=O Amb28255632 [1,0,0,1,0,0|2,0,0]=4 4543 B9R1.15 C[C@H]1CCCC[C@H]1CO Amb28250858 [1,0,0,1,0,0|0,0,1]=3 4544 B9R1.15 C[C@H]1CCCN[C@@H]1CO Amb34915744 [1,0,0,1,0,0|1,0,1]=4 4545 B9R1.15 C\C=C1/CCCC[C@H]1N Amb26977852 [1,0,0,1,0,0|1,0,1]=4 4546 B9R1.15 C\C=C1\CCCCC1N Amb27237317 [1,0,0,1,0,0|1,0,1]=4 4547 B9R1.15 N#CC1CCCCC1=O Amb2691377 [1,0,0,1,0,0|1,0,1]=4 4548 B9R1.15 N#CC1CCCCC1O Amb8904047 [1,0,0,1,0,0|1,0,1]=4 4549 B9R1.15 N#C[C@@H]1CCCC[C@@H]1O Amb27663158 [1,0,0,1,0,0|1,0,1]=4 4550 B9R1.15 N#C[C@@H]1CCCC[C@H]1O Amb1993741 [1,0,0,1,0,0|1,0,1]=4 4551 B9R1.15 N#C[C@H]1CCCC[C@@H]1O Amb27832404 [1,0,0,1,0,0|1,0,1]=4 4552 B9R1.15 NC1CCCCC1C=O Amb27607940 [1,0,0,1,0,0|1,0,0]=3 4553 B9R1.15 NC1CCCCC1CO Amb19515684 [1,0,0,1,0,0|1,0,1]=4 4554 B9R1.15 NC1CCCCC1CO Amb29083407 [1,0,0,1,0,0|1,0,1]=4 4555 B9R1.15 NCC1CCCCC1=O Amb18203259 [1,0,0,1,0,0|1,0,0]=3 4556 B9R1.15 NCC1CCCCC1O Amb22228582 [1,0,0,1,0,0|1,0,1]=4 4557 B9R1.15 NCC1CCCCC1O Amb9277099 [1,0,0,1,0,0|1,0,1]=4 4558 B9R1.15 NCC1CCCNC1=O Amb19514595 [1,0,0,1,0,0|2,0,0]=4 4559 B9R1.15 NCC1CCCNC1=O Amb23586199 [1,0,0,1,0,0|2,0,0]=4 4560 B9R1.15 NC[C@@H]1CCCCC1O Amb28120033 [1,0,0,1,0,0|1,0,1]=4 4561 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993771 [1,0,0,1,0,0|1,0,1]=4 4562 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb1993738 [1,0,0,1,0,0|1,0,1]=4 4563 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb32662843 [1,0,0,1,0,0|1,0,1]=4 4564 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb27267791 [1,0,0,1,0,0|1,0,1]=4 4565 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb32662911 [1,0,0,1,0,0|1,0,1]=4 4566 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb28134233 [1,0,0,1,0,0|1,0,1]=4 4567 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb33774712 [1,0,0,1,0,0|1,0,1]=4 4568 B9R1.15 NN1CCCC[C@@H]1CO Amb28048290 [1,0,0,1,0,0|2,0,0]=4 4569 B9R1.15 NNC1CCCCC1O Amb26054322 [1,0,0,1,0,0|2,0,0]=4 4570 B9R1.15 NN[C@@H]1CCCC[C@@H]1O Amb27204799 [1,0,0,1,0,0|2,0,0]=4 4571 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb10608261 [1,0,0,1,0,0|2,0,0]=4 4572 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb22754030 [1,0,0,1,0,0|2,0,0]=4 4573 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb32992354 [1,0,0,1,0,0|2,0,0]=4 4574 B9R1.15 NN[C@H]1CCCC[C@@H]1O Amb27208426 [1,0,0,1,0,0|2,0,0]=4 4575 B9R1.15 N[C@@H]1CCCC[C@@H]1CO Amb26867016 [1,0,0,1,0,0|1,0,1]=4 4576 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993740 [1,0,0,1,0,0|1,0,1]=4 4577 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993773 [1,0,0,1,0,0|1,0,1]=4 4578 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb30640024 [1,0,0,1,0,0|1,0,1]=4 4579 B9R1.15 N[C@H]1CCCC[C@H]1CO Amb1993772 [1,0,0,1,0,0|1,0,1]=4 4580 B9R1.15 O=C1CCCC=C1CO Amb24453147 [1,0,0,1,0,0|0,0,2]=4 4581 B9R1.15 O=C1CCCCC1CO Amb16231080 [1,0,0,1,0,0|0,0,0]=2 4582 B9R1.15 O=C1CCCCC1CS Amb27838753 [1,0,0,1,0,0|0,1,0]=3 4583 B9R1.15 O=C1CCCCN1CCl Amb2798048 [1,0,0,1,0,0|2,0,0]=4 4584 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [1,0,0,1,0,0|0,0,0]=2 4585 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [1,0,0,1,0,0|0,0,0]=2 4586 B9R1.15 O=C1CCCC\C1=C/O Amb33109815 [1,0,0,1,0,0|0,0,2]=4 4587 B9R1.15 O=C1CCCC\C1=C\O Amb20001480 [1,0,0,1,0,0|0,0,2]=4 4588 B9R1.15 O=C1CCCC\C1=N\O Amb27780978 [1,0,0,1,0,0|1,0,1]=4 4589 B9R1.15 O=C1CCOCC1CF Amb27623327 [1,0,0,1,0,0|2,0,0]=4 4590 B9R1.15 O=C1NCCCC1CO Amb27814971 [1,0,0,1,0,0|1,0,0]=3 4591 B9R1.15 O=C1NCCCC1CS Amb27473272 [1,0,0,1,0,0|1,1,0]=4 4592 B9R1.15 O=C1NCCNC1CO Amb8010659 [1,0,0,1,0,0|2,0,0]=4 4593 B9R1.15 O=C1NCCN[C@H]1CO Amb27391825 [1,0,0,1,0,0|2,0,0]=4 4594 B9R1.15 O=C1NCCOC1CO Amb25235028 [1,0,0,1,0,0|2,0,0]=4 4595 B9R1.15 O=CC1CCCCC1=O Amb19651323 [1,0,0,1,0,0|0,0,2]=4 4596 B9R1.15 O=CC1CCCCC1F Amb24554787 [1,0,0,1,0,0|1,0,0]=3 4597 B9R1.15 O=CC1CCCCC1O Amb25350532 [1,0,0,1,0,0|0,0,0]=2 4598 B9R1.15 O=CC1CSCCC1O Amb27255110 [1,0,0,1,0,0|1,0,0]=3 4599 B9R1.15 O=C[C@H]1CCC=C[C@H]1O Amb27854577 [1,0,0,1,0,0|0,0,2]=4 4600 B9R1.15 O=N[C@@H]1CCCC[C@H]1Cl Amb27491097 [1,0,0,1,0,0|2,0,0]=4 4601 B9R1.15 O=S1CCCS[C@H]1CO Amb28315427 [1,0,0,1,0,0|2,0,0]=4 4602 B9R1.15 OC1CCCCC1CBr Amb26848173 [1,0,0,1,0,0|1,0,1]=4 4603 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [1,0,0,1,0,0|1,0,1]=4 4604 B9R1.15 OCC1CCCCC1Br Amb25320883 [1,0,0,1,0,0|1,0,1]=4 4605 B9R1.15 OCC1CCCCC1Cl Amb26054589 [1,0,0,1,0,0|1,0,1]=4 4606 B9R1.15 OCC1CCCCC1F Amb25216302 [1,0,0,1,0,0|1,0,1]=4 4607 B9R1.15 OCC1CCCCC1O Amb2695584 [1,0,0,1,0,0|0,0,2]=4 4608 B9R1.15 OCC1CCCCC1S Amb28186091 [1,0,0,1,0,0|0,1,1]=4 4609 B9R1.15 OC[C@@H]1CCCC[C@@H]1O Amb27428210 [1,0,0,1,0,0|0,0,2]=4 4610 B9R1.15 OC[C@H]1CCCC[C@@H]1Cl Amb28429613 [1,0,0,1,0,0|1,0,1]=4 4611 B9R1.15 OC[C@H]1CCCC[C@@H]1O Amb28384576 [1,0,0,1,0,0|0,0,2]=4 4612 B9R1.15 OC[C@H]1CCCC[C@@H]1S Amb27652987 [1,0,0,1,0,0|0,1,1]=4 4613 B9R1.15 OC[C@H]1CCCC[C@H]1O Amb28430751 [1,0,0,1,0,0|0,0,2]=4 4614 B9R1.15 O[C@@H]1CCCC[C@H]1CCl Amb27420171 [1,0,0,1,0,0|1,0,1]=4 4615 B9R1.15 O[C@@H]1CCCC[C@H]1CS Amb27962214 [1,0,0,1,0,0|0,1,1]=4 4616 B9R1.15 O[C@H]1CCCC[C@H]1CCl Amb27962958 [1,0,0,1,0,0|1,0,1]=4 4617 B9R1.21 C=CC1COC(CBr)C1 Amb27863570 [1,0,0,1,0,0|1,0,1]=4 4618 B9R1.21 CCC1CC(C#N)CO1 Amb30028898 [1,0,0,1,0,0|1,0,1]=4 4619 B9R1.21 CCC1CC(C=O)CO1 Amb29870829 [1,0,0,1,0,0|0,0,0]=2 4620 B9R1.21 CCC1CC(CBr)CO1 Amb29883068 [1,0,0,1,0,0|1,0,1]=4 4621 B9R1.21 CCC1CC(CCl)CO1 Amb29883067 [1,0,0,1,0,0|1,0,1]=4 4622 B9R1.21 CCC1CC(CN)CO1 Amb35626392 [1,0,0,1,0,0|1,0,1]=4 4623 B9R1.21 CCC1CC(CO)CN1 Amb27621656 [1,0,0,1,0,0|1,0,1]=4 4624 B9R1.21 CCC1CC(CO)CO1 Amb29882990 [1,0,0,1,0,0|0,0,2]=4 4625 B9R1.21 CCC1CC(NC)CO1 Amb35734268 [1,0,0,1,0,0|1,0,0]=3 4626 B9R1.21 CCC1CC(NN)CO1 Amb35634237 [1,0,0,1,0,0|2,0,0]=4 4627 B9R1.21 CCC1CC(NO)CO1 Amb35614680 [1,0,0,1,0,0|1,0,1]=4 4628 B9R1.21 CCC1CC(OC)CN1 Amb23453856 [1,0,0,1,0,0|2,0,0]=4 4629 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [1,0,0,1,0,0|1,0,0]=3 4630 B9R1.21 CCC1CCC(CBr)C1 Amb26006974 [1,0,0,1,0,0|1,0,1]=4 4631 B9R1.21 CCC1CCC(CN)C1 Amb27869330 [1,0,0,1,0,0|1,0,1]=4 4632 B9R1.21 CCC1CCC(CO)C1 Amb26929311 [1,0,0,1,0,0|0,0,1]=3 4633 B9R1.21 CCC1CNC(CO)C1 Amb27876349 [1,0,0,1,0,0|1,0,0]=3 4634 B9R1.21 CCC1COC(CBr)C1 Amb32660773 [1,0,0,1,0,0|1,0,1]=4 4635 B9R1.21 CCC1COC(CI)C1 Amb32660826 [1,0,0,1,0,0|1,0,1]=4 4636 B9R1.21 CCC1COC(CN)C1 Amb32660887 [1,0,0,1,0,0|1,0,1]=4 4637 B9R1.21 CCC1COC(CO)C1 Amb28315434 [1,0,0,1,0,0|1,0,0]=3 4638 B9R1.21 CCN1CCC(C=O)C1 Amb23449544 [1,0,0,1,0,0|2,0,0]=4 4639 B9R1.21 CCN1CCC(CO)C1 Amb5494202 [1,0,0,1,0,0|1,0,1]=4 4640 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [1,0,0,1,0,0|1,0,1]=4 4641 B9R1.21 CN[C@@H]1CN[C@@H](CO)C1 Amb28051812 [1,0,0,1,0,0|2,0,0]=4 4642 B9R1.21 COC1C=CC(CO)C1 Amb28251444 [1,0,0,1,0,0|1,0,1]=4 4643 B9R1.21 COC1CNC(CO)C1 Amb26864113 [1,0,0,1,0,0|2,0,0]=4 4644 B9R1.21 COC1CNC(CO)C1 Amb32663020 [1,0,0,1,0,0|2,0,0]=4 4645 B9R1.21 COC1COC(CN)C1 Amb27257458 [1,0,0,1,0,0|2,0,0]=4 4646 B9R1.21 CO[C@@H]1C=C[C@@H](CO)C1 Amb27862223 [1,0,0,1,0,0|1,0,1]=4 4647 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb26528627 [1,0,0,1,0,0|2,0,0]=4 4648 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb32662679 [1,0,0,1,0,0|2,0,0]=4 4649 B9R1.21 CO[C@H]1CN[C@@H](CO)C1 Amb28057437 [1,0,0,1,0,0|2,0,0]=4 4650 B9R1.21 CO[C@H]1CN[C@H](CO)C1 Amb27436445 [1,0,0,1,0,0|2,0,0]=4 4651 B9R1.21 CO[C@H]1C[C@H](C=O)CO1 Amb28057458 [1,0,0,1,0,0|1,0,0]=3 4652 B9R1.21 NCC1CCC(CO)C1 Amb27859685 [1,0,0,1,0,0|1,0,1]=4 4653 B9R1.21 NC[C@H]1CC[C@@H](CO)C1 Amb27631261 [1,0,0,1,0,0|1,0,1]=4 4654 B9R1.21 O=CC1CCC(CO)C1 Amb26516032 [1,0,0,1,0,0|2,0,0]=4 4655 B9R1.21 OCC1CCC(CF)C1 Amb28435218 [1,0,0,1,0,0|1,0,1]=4 4656 B9R1.21 OCC1CCC(CO)C1 Amb27975602 [1,0,0,1,0,0|1,0,1]=4 4657 B9R1.21 OCC1CNC(CO)C1 Amb33042677 [1,0,0,1,0,0|2,0,0]=4 4658 B9R1.21 OCC1CNC(CO)C1 Amb33042748 [1,0,0,1,0,0|2,0,0]=4 4659 B9R1.21 OC[C@@H]1C=C[C@H](CO)C1 Amb28045576 [1,0,0,1,0,0|1,0,1]=4 4660 B9R1.21 OC[C@@H]1CC[C@@H](CO)C1 Amb28138723 [1,0,0,1,0,0|1,0,1]=4 4661 B9R1.57 CCCC1C(CO)S1=O Amb27605367 [1,0,0,1,0,0|1,0,0]=3 4662 B9R1.57 CCCC1C(Cl)C1CO Amb27764896 [1,0,0,1,0,0|1,0,1]=4 4663 B9R1.57 CCCC1C(F)C1CO Amb27651625 [1,0,0,1,0,0|1,0,1]=4 4664 B9R1.57 CCC[C@@H]1[C@H](CO)S1=O Amb27440847 [1,0,0,1,0,0|1,0,0]=3 4665 B9R1.70 CCC(CBr)C1CCC1 Amb25999551 [1,0,0,1,0,0|1,0,1]=4 4666 B9R1.70 CCC(CCl)C1CCC1 Amb25266530 [1,0,0,1,0,0|1,0,1]=4 4667 B9R1.70 CCC(CO)C1CNC1 Amb34152615 [1,0,0,1,0,0|1,0,1]=4 4668 B9R1.70 CCC(CO)C1COC1 Amb28196648 [1,0,0,1,0,0|1,0,1]=4 4669 B9R1.70 CCC(CO)C1CSC1 Amb27214713 [1,0,0,1,0,0|1,0,1]=4 4670 B9R1.70 CCC(NC)C1CCC1 Amb28286135 [1,0,0,1,0,0|2,0,0]=4 4671 B9R1.70 CNC(CN)C1CCC1 Amb28118271 [1,0,0,1,0,0|2,0,0]=4 4672 B9R1.70 CNC(CO)C1COC1 Amb27796631 [1,0,0,1,0,0|2,0,0]=4 4673 B9R1.70 CNC(CO)C1CSC1 Amb27667345 [1,0,0,1,0,0|2,0,0]=4 4674 B9R1.70 COC(C=O)C1CCC1 Amb28043280 [1,0,0,1,0,0|2,0,0]=4 4675 B9R1.70 COC(CBr)C1CCC1 Amb32666935 [1,0,0,1,0,0|2,0,0]=4 4676 B9R1.70 COC(CCl)C1CCC1 Amb35593190 [1,0,0,1,0,0|2,0,0]=4 4677 B9R1.70 COC(CN)C1CCC1 Amb26950458 [1,0,0,1,0,0|2,0,0]=4 4678 B9R1.70 COC(CO)C1CCC1 Amb32666933 [1,0,0,1,0,0|1,0,0]=3 4679 B9R1.70 NCC(CO)C1CCC1 Amb23452569 [1,0,0,1,0,0|1,0,1]=4 4680 B9R1.70 OCC(CBr)C1CCC1 Amb33471883 [1,0,0,1,0,0|1,0,1]=4 4681 B9R1.70 OCC(CO)C1CCC1 Amb23452570 [1,0,0,1,0,0|0,0,2]=4 4682 B9R1.72 C=CC(CBr)CC1CC1 Amb27455610 [1,0,0,1,0,0|1,0,1]=4 4683 B9R1.72 C=C[C@H](CO)CC1CC1 Amb27396103 [1,0,0,1,0,0|0,0,1]=3 4684 B9R1.72 CCC(CO)NC1CC1 Amb19009186 [1,0,0,1,0,0|1,0,1]=4 4685 B9R1.72 COC(CN)CC1CC1 Amb25255675 [1,0,0,1,0,0|2,0,0]=4 4686 B9R1.72 N#CC(CO)CC1CC1 Amb27618176 [1,0,0,1,0,0|1,0,1]=4 4687 B9R1.72 NCC(CO)CC1CC1 Amb26470640 [1,0,0,1,0,0|1,0,1]=4 4688 B9R1.89 BrCC1C=CCCCC1 Amb33329273 [1,0,0,1,0,0|1,0,1]=4 4689 B9R1.89 BrCC1CCCCCC1 Amb19073228 [1,0,0,1,0,0|1,0,1]=4 4690 B9R1.89 C=CC1CCCCCC1 Amb25068667 [1,0,0,1,0,0|1,0,1]=4 4691 B9R1.89 CCC1CCCCCC1 Amb26390826 [1,0,0,1,0,0|1,0,1]=4 4692 B9R1.89 CCC1CCCCCN1 Amb3788103 [1,0,0,1,0,0|2,0,0]=4 4693 B9R1.89 CCC1CNCCOC1 Amb28400754 [1,0,0,1,0,0|1,0,1]=4 4694 B9R1.89 CCC1COCCCN1 Amb18106727 [1,0,0,1,0,0|1,0,1]=4 4695 B9R1.89 CC[C@@H]1CCCCCN1 Amb28136573 [1,0,0,1,0,0|2,0,0]=4 4696 B9R1.89 CC[C@H]1CCCCCN1 Amb27459025 [1,0,0,1,0,0|2,0,0]=4 4697 B9R1.89 CNC1CCCCCC1 Amb1106215 [1,0,0,1,0,0|2,0,0]=4 4698 B9R1.89 CNC1CCCCCC1 Amb22587117 [1,0,0,1,0,0|2,0,0]=4 4699 B9R1.89 CNC1CCCCNC1 Amb10576552 [1,0,0,1,0,0|2,0,0]=4 4700 B9R1.89 CN[C@@H]1CCCCNC1 Amb27630678 [1,0,0,1,0,0|2,0,0]=4 4701 B9R1.89 CSC1CCCCNC1 Amb20668460 [1,0,0,1,0,0|2,0,0]=4 4702 B9R1.89 ClCC1CCCCCC1 Amb26317790 [1,0,0,1,0,0|1,0,1]=4 4703 B9R1.89 ClCC1CCCCCN1 Amb26567233 [1,0,0,1,0,0|2,0,0]=4 4704 B9R1.89 ClCC1CCCCCN1 Amb32665018 [1,0,0,1,0,0|2,0,0]=4 4705 B9R1.89 FCC1CCCCCN1 Amb28129640 [1,0,0,1,0,0|2,0,0]=4 4706 B9R1.89 ICC1CCCCCC1 Amb27596090 [1,0,0,1,0,0|1,0,1]=4 4707 B9R1.89 ICC1CCCCCO1 Amb22489614 [1,0,0,1,0,0|2,0,0]=4 4708 B9R1.89 NCC1=CCCCCC1 Amb27403312 [1,0,0,1,0,0|1,0,1]=4 4709 B9R1.89 NCC1C=CCCCC1 Amb28184480 [1,0,0,1,0,0|1,0,1]=4 4710 B9R1.89 NCC1C=CCCCC1 Amb33744094 [1,0,0,1,0,0|1,0,1]=4 4711 B9R1.89 NCC1CCCCCC1 Amb22001955 [1,0,0,1,0,0|1,0,1]=4 4712 B9R1.89 NCC1CCCCCC1 Amb8943673 [1,0,0,1,0,0|1,0,1]=4 4713 B9R1.89 NCC1CCCCCN1 Amb26045142 [1,0,0,1,0,0|2,0,0]=4 4714 B9R1.89 O=CC1CCCCCC1 Amb9786985 [1,0,0,1,0,0|1,0,0]=3 4715 B9R1.89 O=CC1CCCOCC1 Amb18832626 [1,0,0,1,0,0|2,0,0]=4 4716 B9R1.89 O=CC1CCCSCC1 Amb18202390 [1,0,0,1,0,0|2,0,0]=4 4717 B9R1.89 OCC1=CCCCCC1 Amb27424682 [1,0,0,1,0,0|0,0,1]=3 4718 B9R1.89 OCC1C=CCCCC1 Amb27662352 [1,0,0,1,0,0|0,0,1]=3 4719 B9R1.89 OCC1CCCCCC1 Amb20240529 [1,0,0,1,0,0|0,0,1]=3 4720 B9R1.89 OCC1CCCCCC1 Amb34916703 [1,0,0,1,0,0|0,0,1]=3 4721 B9R1.89 OCC1CCCCCN1 Amb33551226 [1,0,0,1,0,0|1,0,0]=3 4722 B9R1.89 OCC1CCCCCN1 Amb8009310 [1,0,0,1,0,0|1,0,0]=3 4723 B9R1.89 OCC1CCCCCO1 Amb25687959 [1,0,0,1,0,0|1,0,0]=3 4724 B9R1.89 OCC1CCCCNC1 Amb19149352 [1,0,0,1,0,0|1,0,1]=4 4725 B9R1.89 OCC1CCCCNC1 Amb8630389 [1,0,0,1,0,0|1,0,1]=4 4726 B9R1.89 OCC1CCCNCC1 Amb22886282 [1,0,0,1,0,0|1,0,1]=4 4727 B9R1.89 OCC1CCCNCC1 Amb33545032 [1,0,0,1,0,0|1,0,1]=4 4728 B9R1.89 OCC1CCCOCC1 Amb18203196 [1,0,0,1,0,0|1,0,1]=4 4729 B9R1.89 OCC1CCCSCC1 Amb18202263 [1,0,0,1,0,0|1,0,1]=4 4730 B9R1.89 OCC1CCNCCN1 Amb27413110 [1,0,0,1,0,0|2,0,0]=4 4731 B9R1.89 OCC1CCNCCO1 Amb26354139 [1,0,0,1,0,0|2,0,0]=4 4732 B9R1.89 OCC1CCNCCO1 Amb33482558 [1,0,0,1,0,0|2,0,0]=4 4733 B9R1.89 OCC1CCOCCN1 Amb26354772 [1,0,0,1,0,0|2,0,0]=4 4734 B9R1.89 OCC1CCOCCN1 Amb33744058 [1,0,0,1,0,0|2,0,0]=4 4735 B9R1.89 OCC1CCOCCO1 Amb27838550 [1,0,0,1,0,0|2,0,0]=4 4736 B9R1.89 OCC1CCSCCN1 Amb27778584 [1,0,0,1,0,0|2,0,0]=4 4737 B9R1.89 OCC1CNCCCO1 Amb17935876 [1,0,0,1,0,0|2,0,0]=4 4738 B9R1.89 OCC1CNCCCO1 Amb22497000 [1,0,0,1,0,0|2,0,0]=4 4739 B9R1.89 OCC1COCCCO1 Amb25229839 [1,0,0,1,0,0|2,0,0]=4 4740 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [1,0,0,1,0,0|1,0,0]=3 4741 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [1,0,0,1,0,0|1,0,1]=4 4742 B9R1.89 SCC1CCCCCC1 Amb25960657 [1,0,0,1,0,0|0,1,1]=4 4743 B9R1.94 CCC1OC1(CC)CO Amb27213078 [1,0,0,1,0,0|1,0,1]=4 4744 B9R1.94 CC[C@@H]1O[C@@]1(CC)CO Amb27805398 [1,0,0,1,0,0|1,0,1]=4 4745 B9R1.94 CC[C@@H]1O[C@]1(C=O)CC Amb27645721 [1,0,0,1,0,0|2,0,0]=4 4746 B9R1.120 CC1CCC1(CO)CO Amb33611590 [1,0,0,1,0,0|0,0,2]=4 4747 B9R1.120 COC1(CN)CCC1C Amb26496366 [1,0,0,1,0,0|2,0,0]=4 4748 B9R1.132 C=CC1COC(C)C1O Amb27456549 [1,0,0,1,0,0|1,0,1]=4 4749 B9R1.132 C=C[C@@H]1CO[C@H](C)[C@H]1O Amb27261735 [1,0,0,1,0,0|1,0,1]=4 4750 B9R1.132 CC1C(CO)CCN1C Amb32752568 [1,0,0,1,0,0|1,0,1]=4 4751 B9R1.132 CC1CCC(C#N)C1=O Amb25714272 [1,0,0,1,0,0|1,0,1]=4 4752 B9R1.132 CC1CCC(CN)N1C Amb27830663 [1,0,0,1,0,0|2,0,0]=4 4753 B9R1.132 CC1CCC(CN)N1C Amb33314316 [1,0,0,1,0,0|2,0,0]=4 4754 B9R1.132 CC1CCC(CO)C1=O Amb27486136 [1,0,0,1,0,0|0,0,0]=2 4755 B9R1.132 CC1NCC(CO)C1C Amb27403724 [1,0,0,1,0,0|1,0,1]=4 4756 B9R1.132 CC1OCC(C=O)C1C Amb35732633 [1,0,0,1,0,0|2,0,0]=4 4757 B9R1.132 CC1OCC(CO)C1C Amb35732623 [1,0,0,1,0,0|1,0,1]=4 4758 B9R1.132 CCC1CCC(C)N1C Amb27604766 [1,0,0,1,0,0|2,0,0]=4 4759 B9R1.132 CC[C@@H]1CC[C@H](C)C1=O Amb28052450 [1,0,0,1,0,0|1,0,0]=3 4760 B9R1.132 CN1CCC(CBr)C1=O Amb28318638 [1,0,0,1,0,0|2,0,0]=4 4761 B9R1.132 CN1CCC(CI)C1=O Amb35723927 [1,0,0,1,0,0|2,0,0]=4 4762 B9R1.132 CN1CCC(CN)C1=O Amb30982588 [1,0,0,1,0,0|2,0,0]=4 4763 B9R1.132 CN1CCC(CN)C1=O Amb33550142 [1,0,0,1,0,0|2,0,0]=4 4764 B9R1.132 CN1CCC(CO)C1=O Amb22236004 [1,0,0,1,0,0|1,0,0]=3 4765 B9R1.132 CN1CCC(CO)N1C Amb27966753 [1,0,0,1,0,0|2,0,0]=4 4766 B9R1.132 CN1CCC(CS)C1=O Amb35686181 [1,0,0,1,0,0|1,1,0]=4 4767 B9R1.132 CNC1CCC(C)C1C Amb27780076 [1,0,0,1,0,0|2,0,0]=4 4768 B9R1.132 CN[C@@H]1CC[C@@H](O)[C@@H]1O Amb30530996 [1,0,0,1,0,0|2,0,0]=4 4769 B9R1.132 CO[C@@H]1CC[C@@H](N)[C@H]1O Amb30530997 [1,0,0,1,0,0|2,0,0]=4 4770 B9R1.132 CO[C@@H]1CC[C@H](Cl)[C@H]1O Amb27419907 [1,0,0,1,0,0|2,0,0]=4 4771 B9R1.132 C[C@@H]1CC[C@H](CN)N1C Amb24652858 [1,0,0,1,0,0|2,0,0]=4 4772 B9R1.132 C[C@@H]1CC[C@H](CN)N1C Amb33314322 [1,0,0,1,0,0|2,0,0]=4 4773 B9R1.132 C[C@@H]1[C@H](CO)CCN1C Amb28722267 [1,0,0,1,0,0|1,0,1]=4 4774 B9R1.132 C[C@H]1CC[C@@H](CN)N1C Amb35746774 [1,0,0,1,0,0|2,0,0]=4 4775 B9R1.132 C[C@H]1CC[C@@H](CO)N1C Amb27421578 [1,0,0,1,0,0|1,0,0]=3 4776 B9R1.132 C[C@H]1[C@H](CO)CCN1C Amb27981620 [1,0,0,1,0,0|1,0,1]=4 4777 B9R1.132 O=CC1OCC(O)C1O Amb27256563 [1,0,0,1,0,0|2,0,0]=4 4778 B9R1.132 O=C[C@@H]1OC[C@@H](O)[C@H]1O Amb27629808 [1,0,0,1,0,0|2,0,0]=4 4779 B9R1.132 O=C[C@@H]1OC[C@H](O)[C@@H]1O Amb28457584 [1,0,0,1,0,0|2,0,0]=4 4780 B9R1.184 CC1CC1C(CN)CO Amb33144263 [1,0,0,1,0,0|1,0,1]=4 4781 B9R1.184 CCC(NC)C1CC1C Amb27248082 [1,0,0,1,0,0|2,0,0]=4 4782 B9R1.184 COC(CN)C1CC1C Amb33034755 [1,0,0,1,0,0|2,0,0]=4 4783 B9R1.193 CCCCC1(C=O)CC1 Amb24740046 [1,0,0,1,0,0|1,0,0]=3 4784 B9R1.193 CCCCC1(CBr)CC1 Amb26913839 [1,0,0,1,0,0|1,0,1]=4 4785 B9R1.193 CCCCC1(CCl)CC1 Amb24478712 [1,0,0,1,0,0|1,0,1]=4 4786 B9R1.193 CCCCC1(CN)CC1 Amb18062376 [1,0,0,1,0,0|1,0,1]=4 4787 B9R1.193 CCCCC1(CO)CC1 Amb24478733 [1,0,0,1,0,0|0,0,1]=3 4788 B9R1.193 CCCCC1(NC)CC1 Amb33374809 [1,0,0,1,0,0|2,0,0]=4 4789 B9R1.193 CCOCC1(C=O)CC1 Amb26350925 [1,0,0,1,0,0|2,0,0]=4 4790 B9R1.193 CCSCC1(C=O)CC1 Amb33324035 [1,0,0,1,0,0|2,0,0]=4 4791 B9R1.193 CCSCC1(CO)CC1 Amb33324036 [1,0,0,1,0,0|1,0,1]=4 4792 B9R1.193 CNCCC1(CO)CC1 Amb27224210 [1,0,0,1,0,0|1,0,1]=4 4793 B9R1.193 COCCC1(C=O)CC1 Amb25162054 [1,0,0,1,0,0|2,0,0]=4 4794 B9R1.193 COCCC1(CO)CC1 Amb27842053 [1,0,0,1,0,0|1,0,1]=4 4795 B9R1.193 CSCCC1(C=O)CC1 Amb26491651 [1,0,0,1,0,0|2,0,0]=4 4796 B9R1.193 CSCCC1(CO)CC1 Amb24481657 [1,0,0,1,0,0|1,0,1]=4 4797 B9R1.193 O=CC1(CCCCl)CC1 Amb25109461 [1,0,0,1,0,0|2,0,0]=4 4798 B9R1.193 O=CC1(CCCF)CC1 Amb28075057 [1,0,0,1,0,0|2,0,0]=4 4799 B9R1.193 O=CC1(CCCO)CC1 Amb28313350 [1,0,0,1,0,0|2,0,0]=4 4800 B9R1.193 OCC1(CCCF)CC1 Amb33196076 [1,0,0,1,0,0|1,0,1]=4 4801 B9R1.204 CCC1(C=O)CCCC1 Amb25048609 [1,0,0,1,0,0|1,0,0]=3 4802 B9R1.204 CCC1(C=O)CCCO1 Amb33039758 [1,0,0,1,0,0|2,0,0]=4 4803 B9R1.204 CCC1(C=O)CCCS1 Amb28342510 [1,0,0,1,0,0|2,0,0]=4 4804 B9R1.204 CCC1(C=O)CCOC1 Amb28421691 [1,0,0,1,0,0|2,0,0]=4 4805 B9R1.204 CCC1(CBr)CCCC1 Amb27180157 [1,0,0,1,0,0|1,0,1]=4 4806 B9R1.204 CCC1(CCl)CCCC1 Amb27390618 [1,0,0,1,0,0|1,0,1]=4 4807 B9R1.204 CCC1(CN)CCCC1 Amb18287099 [1,0,0,1,0,0|1,0,1]=4 4808 B9R1.204 CCC1(CO)CCCN1 Amb15701610 [1,0,0,1,0,0|1,0,1]=4 4809 B9R1.204 CCC1(CO)CCNC1 Amb25960714 [1,0,0,1,0,0|1,0,1]=4 4810 B9R1.204 CNC1(CCl)CCCC1 Amb27647960 [1,0,0,1,0,0|2,0,0]=4 4811 B9R1.204 CNC1(CN)CCCC1 Amb18284346 [1,0,0,1,0,0|2,0,0]=4 4812 B9R1.204 CNC1(CO)CCCC1 Amb18951166 [1,0,0,1,0,0|1,0,0]=3 4813 B9R1.204 CNC1(CO)CCOC1 Amb19148094 [1,0,0,1,0,0|2,0,0]=4 4814 B9R1.204 CNC1(CO)CCOC1 Amb27268227 [1,0,0,1,0,0|2,0,0]=4 4815 B9R1.204 CNC1(CO)CCSC1 Amb18951161 [1,0,0,1,0,0|2,0,0]=4 4816 B9R1.204 COC1(C=O)CCCC1 Amb26516105 [1,0,0,1,0,0|2,0,0]=4 4817 B9R1.204 COC1(CBr)CCCC1 Amb19050009 [1,0,0,1,0,0|2,0,0]=4 4818 B9R1.204 COC1(CCl)CCCC1 Amb27769465 [1,0,0,1,0,0|2,0,0]=4 4819 B9R1.204 COC1(CI)CCCC1 Amb24591048 [1,0,0,1,0,0|2,0,0]=4 4820 B9R1.204 COC1(CN)CCCC1 Amb18284761 [1,0,0,1,0,0|2,0,0]=4 4821 B9R1.204 COC1(CO)CCCC1 Amb24684440 [1,0,0,1,0,0|1,0,0]=3 4822 B9R1.204 COC1(CO)CCCO1 Amb28315477 [1,0,0,1,0,0|2,0,0]=4 4823 B9R1.204 COC1(CO)CCNC1 Amb32664617 [1,0,0,1,0,0|2,0,0]=4 4824 B9R1.204 COC1(CO)CCNC1 Amb33465401 [1,0,0,1,0,0|2,0,0]=4 4825 B9R1.204 COC1(CO)CCOC1 Amb28142449 [1,0,0,1,0,0|2,0,0]=4 4826 B9R1.204 COC1(CS)CCCC1 Amb26481556 [1,0,0,1,0,0|1,1,0]=4 4827 B9R1.204 CSC1(C=O)CCCC1 Amb27262856 [1,0,0,1,0,0|2,0,0]=4 4828 B9R1.204 N#CC1(C=O)CCCC1 Amb27196814 [1,0,0,1,0,0|1,0,1]=4 4829 B9R1.204 N#CC1(CO)CCCC1 Amb17334081 [1,0,0,1,0,0|1,0,1]=4 4830 B9R1.204 NCC1(CO)CCCC1 Amb33529528 [1,0,0,1,0,0|1,0,1]=4 4831 B9R1.204 NCC1(CO)CCCC1 Amb33549067 [1,0,0,1,0,0|1,0,1]=4 4832 B9R1.204 O=CC1(CCl)CCCC1 Amb24408869 [1,0,0,1,0,0|1,0,0]=3 4833 B9R1.204 O=CC1(CCl)CCCO1 Amb32943532 [1,0,0,1,0,0|2,0,0]=4 4834 B9R1.204 O=CC1(CCl)CCCS1 Amb25773123 [1,0,0,1,0,0|2,0,0]=4 4835 B9R1.204 O=CC1(CCl)CCOC1 Amb25162231 [1,0,0,1,0,0|2,0,0]=4 4836 B9R1.204 O=CC1(CO)CCCC1 Amb26516097 [1,0,0,1,0,0|0,0,0]=2 4837 B9R1.204 O=CC1(CO)CCCO1 Amb33503816 [1,0,0,1,0,0|1,0,0]=3 4838 B9R1.204 O=CC1(CO)CCCS1 Amb26884619 [1,0,0,1,0,0|1,0,0]=3 4839 B9R1.204 O=CC1(CO)CCOC1 Amb25101829 [1,0,0,1,0,0|1,0,0]=3 4840 B9R1.204 OCC1(CO)CCCC1 Amb4020194 [1,0,0,1,0,0|0,0,2]=4 4841 B9R1.22 CC1CC(=O)C(C=O)C1 Amb27234402 [1,0,0,1,0,0|0,0,2]=4 4842 B9R1.22 CCC1CN(C)CC1=O Amb27589818 [1,0,0,1,0,0|2,0,0]=4 4843 B9R1.22 CO[C@@H]1C[C@@H](C)CC1=O Amb27802508 [1,0,0,1,0,0|2,0,0]=4 4844 B9R1.22 C[C@H]1C[C@@H](C)CC1CO Amb28319916 [1,0,0,1,0,0|1,0,1]=4 4845 B9R1.24 CC1(C)CCCC1CO Amb25698070 [1,0,0,1,0,0|1,0,1]=4 4846 B9R1.24 CC1(O)CCCC1CO Amb28315472 [1,0,0,1,0,0|0,0,2]=4 4847 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [1,0,0,1,0,0|1,0,1]=4 4848 B9R1.24 C[C@@]1(N)CCC[C@H]1CO Amb28055666 [1,0,0,1,0,0|1,0,1]=4 4849 B9R1.24 C[C@]1(N)CCC[C@H]1CO Amb1993801 [1,0,0,1,0,0|1,0,1]=4 4850 B9R1.24 O=S1(=O)CCCC1CO Amb26400526 [1,0,0,1,0,0|2,0,0]=4 4851 B9R1.25 CCC1C(Cl)C1C(=O)O Amb32656378 [1,0,0,1,0,0|2,0,0]=4 4852 B9R1.33 C#CCC1COCC1=O Amb35635975 [1,0,0,1,0,0|0,0,2]=4 4853 B9R1.33 C=C1COCC1CCC Amb35646841 [1,0,0,1,0,0|1,0,0]=3 4854 B9R1.33 C=CCC1COCC1=O Amb27235559 [1,0,0,1,0,0|0,0,2]=4 4855 B9R1.33 CCCC1CC=CC1=O Amb27838711 [1,0,0,1,0,0|1,0,1]=4 4856 B9R1.33 CCCC1CCCC1=O Amb8503562 [1,0,0,1,0,0|1,0,0]=3 4857 B9R1.33 CCCC1COCC1=O Amb35639022 [1,0,0,1,0,0|0,0,0]=2 4858 B9R1.33 CCCC1COCC1Br Amb35736880 [1,0,0,1,0,0|1,0,1]=4 4859 B9R1.33 CCCC1COCC1Cl Amb35736785 [1,0,0,1,0,0|1,0,1]=4 4860 B9R1.33 CCCC1COCC1N Amb29877503 [1,0,0,1,0,0|1,0,1]=4 4861 B9R1.33 CCCC1COCC1O Amb33213638 [1,0,0,1,0,0|0,0,2]=4 4862 B9R1.33 CCCC1COCC1S Amb32788392 [1,0,0,1,0,0|0,1,1]=4 4863 B9R1.33 CCCN1CCCC1=O Amb15691721 [1,0,0,1,0,0|2,0,0]=4 4864 B9R1.33 CCCN1CNCC1=O Amb24481722 [1,0,0,1,0,0|2,0,0]=4 4865 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [1,0,0,1,0,0|1,0,0]=3 4866 B9R1.33 CCC[C@@H]1COC[C@H]1O Amb32950257 [1,0,0,1,0,0|0,0,2]=4 4867 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [1,0,0,1,0,0|2,0,0]=4 4868 B9R1.33 CCOC1CCCC1=O Amb25147133 [1,0,0,1,0,0|2,0,0]=4 4869 B9R1.33 CNCC1CCCC1=O Amb27202013 [1,0,0,1,0,0|2,0,0]=4 4870 B9R1.33 COCC1CCCC1=O Amb25766356 [1,0,0,1,0,0|2,0,0]=4 4871 B9R1.33 COCC1COCC1=O Amb35639023 [1,0,0,1,0,0|1,0,0]=3 4872 B9R1.33 CSCC1CCCC1=O Amb27838797 [1,0,0,1,0,0|2,0,0]=4 4873 B9R1.33 NCCC1CCCC1=O Amb18832679 [1,0,0,1,0,0|2,0,0]=4 4874 B9R1.33 O=C1CCCC1CCBr Amb20623655 [1,0,0,1,0,0|2,0,0]=4 4875 B9R1.33 O=C1CCCC1CCF Amb33551119 [1,0,0,1,0,0|2,0,0]=4 4876 B9R1.33 O=C1CCCC1CCO Amb27221111 [1,0,0,1,0,0|2,0,0]=4 4877 B9R1.41 C=C(C)C1CCCC1O Amb26956818 [1,0,0,1,0,0|1,0,0]=3 4878 B9R1.41 C=C(C)C1CNCC1O Amb24568954 [1,0,0,1,0,0|2,0,0]=4 4879 B9R1.41 C=C(C)C1COCC1O Amb33213980 [1,0,0,1,0,0|2,0,0]=4 4880 B9R1.41 C=C(C)[C@@H]1CCC[C@H]1O Amb33212935 [1,0,0,1,0,0|1,0,0]=3 4881 B9R1.41 C=C(C)[C@@H]1CNC[C@H]1O Amb32944875 [1,0,0,1,0,0|2,0,0]=4 4882 B9R1.41 C=C(C)[C@@H]1COC[C@H]1O Amb32945151 [1,0,0,1,0,0|2,0,0]=4 4883 B9R1.41 C=C(C)[C@H]1CCC[C@@H]1O Amb27618794 [1,0,0,1,0,0|1,0,0]=3 4884 B9R1.41 C=C1CCCC1C(C)=O Amb27164651 [1,0,0,1,0,0|1,0,1]=4 4885 B9R1.41 CC(=O)C1=CCCC1O Amb27634181 [1,0,0,1,0,0|0,0,2]=4 4886 B9R1.41 CC(=O)C1CCCC1=O Amb6600481 [1,0,0,1,0,0|0,0,2]=4 4887 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [1,0,0,1,0,0|1,0,0]=3 4888 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [1,0,0,1,0,0|0,0,0]=2 4889 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [1,0,0,1,0,0|2,0,0]=4 4890 B9R1.41 CC(=O)C1CCNC1C Amb24393053 [1,0,0,1,0,0|2,0,0]=4 4891 B9R1.41 CC(=O)C1CCOC1C Amb25882003 [1,0,0,1,0,0|2,0,0]=4 4892 B9R1.41 CC(=O)C1CNCC1C Amb28346154 [1,0,0,1,0,0|2,0,0]=4 4893 B9R1.41 CC(=O)C1CNCC1O Amb33213407 [1,0,0,1,0,0|1,0,0]=3 4894 B9R1.41 CC(=O)C1COCC1N Amb25918760 [1,0,0,1,0,0|2,0,0]=4 4895 B9R1.41 CC(=O)C1COCC1O Amb32951053 [1,0,0,1,0,0|1,0,0]=3 4896 B9R1.41 CC(=O)C1CSCC1C Amb32988245 [1,0,0,1,0,0|2,0,0]=4 4897 B9R1.41 CC(=O)C1OCCC1N Amb33307372 [1,0,0,1,0,0|2,0,0]=4 4898 B9R1.41 CC(=O)N1CCCC1C Amb26494370 [1,0,0,1,0,0|2,0,0]=4 4899 B9R1.41 CC(=O)[C@@H]1CCCN1N Amb26968682 [1,0,0,1,0,0|2,0,0]=4 4900 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [1,0,0,1,0,0|1,0,0]=3 4901 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [1,0,0,1,0,0|1,0,0]=3 4902 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [1,0,0,1,0,0|0,0,0]=2 4903 B9R1.41 CC(=O)[C@@H]1CNC[C@H]1O Amb32945575 [1,0,0,1,0,0|1,0,0]=3 4904 B9R1.41 CC(=O)[C@@H]1COC[C@H]1O Amb32951076 [1,0,0,1,0,0|1,0,0]=3 4905 B9R1.41 CC(=O)[C@@H]1OCC[C@@H]1N Amb33307350 [1,0,0,1,0,0|2,0,0]=4 4906 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [1,0,0,1,0,0|1,0,0]=3 4907 B9R1.41 CC(C)C1CCCC1O Amb25749420 [1,0,0,1,0,0|1,0,1]=4 4908 B9R1.41 CC(C)[C@@H]1CCC[C@H]1O Amb25998901 [1,0,0,1,0,0|1,0,1]=4 4909 B9R1.41 CC(C)[C@H]1CCC[C@@H]1O Amb27238582 [1,0,0,1,0,0|1,0,1]=4 4910 B9R1.41 CC(C)[C@H]1CCC[C@H]1O Amb28053553 [1,0,0,1,0,0|1,0,1]=4 4911 B9R1.41 CC(N)[C@@H]1CCC[C@@H]1O Amb27654093 [1,0,0,1,0,0|1,0,1]=4 4912 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [1,0,0,1,0,0|2,0,0]=4 4913 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [1,0,0,1,0,0|2,0,0]=4 4914 B9R1.41 CN(C)C1CCCC1O Amb19650708 [1,0,0,1,0,0|2,0,0]=4 4915 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1O Amb22899696 [1,0,0,1,0,0|2,0,0]=4 4916 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O Amb16230278 [1,0,0,1,0,0|2,0,0]=4 4917 B9R1.41 CN(C)[C@H]1CCC[C@H]1O Amb27185740 [1,0,0,1,0,0|2,0,0]=4 4918 B9R1.41 CN(N)[C@H]1CCC[C@@H]1O Amb27420294 [1,0,0,1,0,0|2,0,0]=4 4919 B9R1.41 CN(N)[C@H]1CCC[C@H]1O Amb28064055 [1,0,0,1,0,0|2,0,0]=4 4920 B9R1.41 CS(=O)C1CCCC1N Amb27862371 [1,0,0,1,0,0|2,0,0]=4 4921 B9R1.41 C[C@@H](N)[C@@H]1CCC[C@@H]1O Amb35752723 [1,0,0,1,0,0|1,0,1]=4 4922 B9R1.41 C[C@@H](N)[C@H]1CCC[C@H]1O Amb28072273 [1,0,0,1,0,0|1,0,1]=4 4923 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [1,0,0,1,0,0|2,0,0]=4 4924 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|2,0,0]=4 4925 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|2,0,0]=4 4926 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|2,0,0]=4 4927 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|2,0,0]=4 4928 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [1,0,0,1,0,0|2,0,0]=4 4929 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [1,0,0,1,0,0|2,0,0]=4 4930 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [1,0,0,1,0,0|2,0,0]=4 4931 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [1,0,0,1,0,0|1,0,0]=3 4932 B9R1.41 NC(=O)C1CCCN1O Amb27607865 [1,0,0,1,0,0|2,0,0]=4 4933 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [1,0,0,1,0,0|2,0,0]=4 4934 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [1,0,0,1,0,0|2,0,0]=4 4935 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [1,0,0,1,0,0|1,0,0]=3 4936 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [1,0,0,1,0,0|2,0,0]=4 4937 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [1,0,0,1,0,0|2,0,0]=4 4938 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [1,0,0,1,0,0|2,0,0]=4 4939 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [1,0,0,1,0,0|2,0,0]=4 4940 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [1,0,0,1,0,0|2,0,0]=4 4941 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [1,0,0,1,0,0|1,0,0]=3 4942 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [1,0,0,1,0,0|2,0,0]=4 4943 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [1,0,0,1,0,0|2,0,0]=4 4944 B9R1.41 NC(=S)C1CCCC1O Amb27668651 [1,0,0,1,0,0|1,1,0]=4 4945 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [1,0,0,1,0,0|2,0,0]=4 4946 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [1,0,0,1,0,0|2,0,0]=4 4947 B9R1.41 NS(=O)[C@@H]1CCC[C@H]1O Amb32720921 [1,0,0,1,0,0|2,0,0]=4 4948 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [1,0,0,1,0,0|2,0,0]=4 4949 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [1,0,0,1,0,0|2,0,0]=4 4950 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [1,0,0,1,0,0|2,0,0]=4 4951 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [1,0,0,1,0,0|2,0,0]=4 4952 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [1,0,0,1,0,0|2,0,0]=4 4953 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [1,0,0,1,0,0|2,0,0]=4 4954 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|2,0,0]=4 4955 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|2,0,0]=4 4956 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [1,0,0,1,0,0|1,0,0]=3 4957 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [1,0,0,1,0,0|1,0,0]=3 4958 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,0,0,1,0,0|1,0,0]=3 4959 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,1,0]=4 4960 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [1,0,0,1,0,0|2,0,0]=4 4961 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [1,0,0,1,0,0|2,0,0]=4 4962 B9R1.41 O=C(O)C1COCC1O Amb27270738 [1,0,0,1,0,0|2,0,0]=4 4963 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [1,0,0,1,0,0|2,0,0]=4 4964 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [1,0,0,1,0,0|2,0,0]=4 4965 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [1,0,0,1,0,0|2,0,0]=4 4966 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [1,0,0,1,0,0|2,0,0]=4 4967 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [1,0,0,1,0,0|2,0,0]=4 4968 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [1,0,0,1,0,0|2,0,0]=4 4969 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [1,0,0,1,0,0|2,0,0]=4 4970 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [1,0,0,1,0,0|2,0,0]=4 4971 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [1,0,0,1,0,0|2,0,0]=4 4972 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [1,0,0,1,0,0|2,0,0]=4 4973 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,0,0,1,0,0|1,0,0]=3 4974 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,0,0,1,0,0|1,0,0]=3 4975 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [1,0,0,1,0,0|2,0,0]=4 4976 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [1,0,0,1,0,0|2,0,0]=4 4977 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [1,0,0,1,0,0|2,0,0]=4 4978 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [1,0,0,1,0,0|2,0,0]=4 4979 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [1,0,0,1,0,0|2,0,0]=4 4980 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [1,0,0,1,0,0|2,0,0]=4 4981 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [1,0,0,1,0,0|2,0,0]=4 4982 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [1,0,0,1,0,0|2,0,0]=4 4983 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [1,0,0,1,0,0|2,0,0]=4 4984 B9R1.41 O=S(Cl)[C@@H]1CCC[C@H]1O Amb32720922 [1,0,0,1,0,0|2,0,0]=4 4985 B9R1.41 O=S([O-])[C@@H]1CCC[C@H]1O Amb32755416 [1,0,0,1,0,0|2,0,0]=4 4986 B9R1.41 O=[N+]([O-])C1CCCC1O Amb18203186 [1,0,0,1,0,0|2,0,0]=4 4987 B9R1.43 CCCC(CO)C1CC1 Amb27237073 [1,0,0,1,0,0|1,0,1]=4 4988 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [1,0,0,1,0,0|2,0,0]=4 4989 B9R1.55 CC(=O)[C@@H]1C[C@H](Cl)[C@H]1Cl Amb27244175 [1,0,0,1,0,0|2,0,0]=4 4990 B9R1.55 CC1OC(C(=O)[O-])C1O Amb28069594 [1,0,0,1,0,0|2,0,0]=4 4991 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [1,0,0,1,0,0|2,0,0]=4 4992 B9R1.90 CCC1C(=O)CC1OC Amb27838695 [1,0,0,1,0,0|2,0,0]=4 4993 B9R1.90 CCC1NC(=O)C1CC Amb22364987 [1,0,0,1,0,0|2,0,0]=4 4994 B9R1.90 CC[C@@H]1NC(=O)[C@@H]1CC Amb28325086 [1,0,0,1,0,0|2,0,0]=4 4995 B9R1.90 CC[C@@H]1NC(=O)[C@H]1CC Amb27458919 [1,0,0,1,0,0|2,0,0]=4 4996 B9R1.90 O=C1CC(CO)C1CO Amb28200044 [1,0,0,1,0,0|1,0,0]=3 4997 B9R1.90 O=C1C[C@H](CO)[C@H]1CO Amb25328887 [1,0,0,1,0,0|1,0,0]=3 4998 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [1,0,0,1,0,0|2,0,0]=4 4999 B9R1.116 CCC(C(=O)O)C1CC1 Amb18832627 [1,0,0,1,0,0|2,0,0]=4 5000 B9R1.116 CN(C)C(CO)C1CC1 Amb24116631 [1,0,0,1,0,0|2,0,0]=4 5001 B9R1.116 COC(C(C)=O)C1CC1 Amb27235075 [1,0,0,1,0,0|2,0,0]=4 5002 B9R1.116 NCC(C(=O)O)C1CC1 Amb26482230 [1,0,0,1,0,0|2,0,0]=4 5003 B9R1.116 NCC(C(N)=O)C1CC1 Amb27642892 [1,0,0,1,0,0|2,0,0]=4 5004 B9R1.116 O=C(O)C(CF)C1CC1 Amb27816769 [1,0,0,1,0,0|2,0,0]=4 5005 B9R1.116 O=C(O)C(NO)C1CC1 Amb27410795 [1,0,0,1,0,0|2,0,0]=4 5006 B9R1.119 C=C(C)C1(CN)CCC1 Amb33199889 [1,0,0,1,0,0|2,0,0]=4 5007 B9R1.119 C=C(C)C1(CO)CCC1 Amb33199888 [1,0,0,1,0,0|1,0,0]=3 5008 B9R1.119 CC(=O)C1(C#N)CCC1 Amb23453405 [1,0,0,1,0,0|1,0,1]=4 5009 B9R1.119 CC(=O)C1(CN)CCC1 Amb25984648 [1,0,0,1,0,0|1,0,0]=3 5010 B9R1.119 CC(C)C1(CO)CCC1 Amb26390623 [1,0,0,1,0,0|1,0,1]=4 5011 B9R1.119 CC(N)C1(CO)CCC1 Amb27184650 [1,0,0,1,0,0|1,0,1]=4 5012 B9R1.119 CCC1(C(=O)O)CCC1 Amb20622799 [1,0,0,1,0,0|2,0,0]=4 5013 B9R1.119 CCC1(C(C)=O)CCC1 Amb33275008 [1,0,0,1,0,0|1,0,0]=3 5014 B9R1.119 CCC1(C(C)=O)CNC1 Amb33307015 [1,0,0,1,0,0|2,0,0]=4 5015 B9R1.119 CCC1(C(C)=O)COC1 Amb25675461 [1,0,0,1,0,0|2,0,0]=4 5016 B9R1.119 CN(C)C1(CO)CCC1 Amb24116653 [1,0,0,1,0,0|2,0,0]=4 5017 B9R1.119 CNC1(C(C)=O)CCC1 Amb25694506 [1,0,0,1,0,0|2,0,0]=4 5018 B9R1.119 COC1(C(C)=O)CCC1 Amb26658063 [1,0,0,1,0,0|2,0,0]=4 5019 B9R1.119 CS(=O)C1(CN)CCC1 Amb27185675 [1,0,0,1,0,0|2,0,0]=4 5020 B9R1.119 NC(=O)C1(CO)CCC1 Amb10608145 [1,0,0,1,0,0|1,0,0]=3 5021 B9R1.119 NCC1(C(=O)O)CCC1 Amb18284930 [1,0,0,1,0,0|2,0,0]=4 5022 B9R1.119 NCC1(C(=O)O)CCC1 Amb22371111 [1,0,0,1,0,0|2,0,0]=4 5023 B9R1.119 NCC1(C(N)=O)CCC1 Amb18908293 [1,0,0,1,0,0|2,0,0]=4 5024 B9R1.119 O=C(O)C1(CBr)CCC1 Amb26332547 [1,0,0,1,0,0|2,0,0]=4 5025 B9R1.119 O=C(O)C1(CF)CCC1 Amb26609390 [1,0,0,1,0,0|2,0,0]=4 5026 B9R1.119 O=C(O)C1(CI)CCC1 Amb27436444 [1,0,0,1,0,0|2,0,0]=4 5027 B9R1.119 O=C(O)C1(CO)CCC1 Amb20248637 [1,0,0,1,0,0|1,0,0]=3 5028 B9R1.119 O=C(O)C1(CO)CNC1 Amb24622488 [1,0,0,1,0,0|2,0,0]=4 5029 B9R1.119 O=C(O)C1(CO)COC1 Amb20668032 [1,0,0,1,0,0|2,0,0]=4 5030 B9R1.119 O=C(O)C1(NO)CCC1 Amb28127460 [1,0,0,1,0,0|2,0,0]=4 5031 B9R1.130 CC1CC1(CN)C(=O)O Amb24502348 [1,0,0,1,0,0|2,0,0]=4 5032 B9R1.130 CC1CC1(CN)C(=O)O Amb33747377 [1,0,0,1,0,0|2,0,0]=4 5033 B9R1.130 CC1CC1(CO)C(=O)O Amb27876946 [1,0,0,1,0,0|1,0,0]=3 5034 B9R1.130 CC1CC1(CO)N(C)C Amb27186316 [1,0,0,1,0,0|2,0,0]=4 5035 B9R1.130 CCC1(C(C)=O)OC1C Amb25242557 [1,0,0,1,0,0|2,0,0]=4 5036 B9R1.130 CC[C@@]1(C(C)=O)O[C@H]1C Amb27427845 [1,0,0,1,0,0|2,0,0]=4 5037 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33734028 [1,0,0,1,0,0|2,0,0]=4 5038 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33742278 [1,0,0,1,0,0|2,0,0]=4 5039 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [1,0,0,1,0,0|1,0,0]=3 5040 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [1,0,0,1,0,0|1,0,0]=3 5041 B9R1.154 CCOC1C(=O)CC1C Amb27838667 [1,0,0,1,0,0|2,0,0]=4 5042 B9R1.179 CC(=O)C1(CCF)CC1 Amb25889537 [1,0,0,1,0,0|2,0,0]=4 5043 B9R1.179 CC(=O)C1(CCO)CC1 Amb27969719 [1,0,0,1,0,0|2,0,0]=4 5044 B9R1.179 CCCC1(C(=O)Cl)CC1 Amb28366564 [1,0,0,1,0,0|2,0,0]=4 5045 B9R1.179 CCCC1(C(=O)O)CC1 Amb18062273 [1,0,0,1,0,0|2,0,0]=4 5046 B9R1.179 CCCC1(C(C)=O)CC1 Amb18062173 [1,0,0,1,0,0|1,0,0]=3 5047 B9R1.179 COCC1(C(C)=O)CC1 Amb33428662 [1,0,0,1,0,0|2,0,0]=4 5048 B9R1.179 CSCC1(C(C)=O)CC1 Amb33271703 [1,0,0,1,0,0|2,0,0]=4 5049 B11R1.9 COC1CC(=O)OC(CO)C1 Amb28294095 [0,0,0,1,0,1|1,0,0]=3 5050 B11R1.9 COC1CC(=S)NC(CO)C1 Amb27791961 [0,0,0,1,0,1|1,1,0]=4 5051 B11R1.9 CO[C@H]1CC(=O)O[C@@H](CO)C1 Amb27431377 [0,0,0,1,0,1|1,0,0]=3 5052 B11R1.9 O=C1NC(CO)CC(CO)N1 Amb27455149 [0,0,0,1,0,1|2,0,0]=4 5053 B11R1.9 O=C1N[C@@H](CO)C[C@H](CO)N1 Amb27431332 [0,0,0,1,0,1|2,0,0]=4 5054 B11R1.20 C=C(C)CC1CCC(C)CC1 Amb27617255 [0,0,0,1,0,1|2,0,0]=4 5055 B11R1.20 CC(=N)NC1CCC(C)OC1 Amb35698831 [0,0,0,1,0,1|1,0,0]=3 5056 B11R1.20 CC(=N)NC1CCC(C)SC1 Amb30016300 [0,0,0,1,0,1|1,1,0]=4 5057 B11R1.20 CC(=N)N[C@H]1CC[C@H](C)CC1 Amb27601399 [0,0,0,1,0,1|2,0,0]=4 5058 B11R1.20 CC(=O)CC1CCC(C)CC1 Amb25042793 [0,0,0,1,0,1|1,0,0]=3 5059 B11R1.20 CC(=O)CC1CCC(C)CN1 Amb28421909 [0,0,0,1,0,1|2,0,0]=4 5060 B11R1.20 CC(=O)CC1CCC(F)CC1 Amb28208692 [0,0,0,1,0,1|2,0,0]=4 5061 B11R1.20 CC(=O)CC1CCN(C)CC1 Amb27490863 [0,0,0,1,0,1|2,0,0]=4 5062 B11R1.20 CC(=O)C[C@H]1CC[C@@H](O)CC1 Amb28284896 [0,0,0,1,0,1|2,0,0]=4 5063 B11R1.20 CC(=O)NC1CCC(C)CC1 Amb25151290 [0,0,0,1,0,1|1,0,0]=3 5064 B11R1.20 CC(=O)NC1CCC(C)OC1 Amb29860494 [0,0,0,1,0,1|0,0,0]=2 5065 B11R1.20 CC(=O)NC1CCC(C)SC1 Amb35698171 [0,0,0,1,0,1|0,1,0]=3 5066 B11R1.20 CC(=O)NC1CCC(N)CC1 Amb32644842 [0,0,0,1,0,1|2,0,0]=4 5067 B11R1.20 CC(=O)NC1CCC(N)CC1 Amb6256147 [0,0,0,1,0,1|2,0,0]=4 5068 B11R1.20 CC(=O)NC1CCC(O)CC1 Amb9242511 [0,0,0,1,0,1|2,0,0]=4 5069 B11R1.20 CC(=O)N[C@H]1CC[C@@H](N)CC1 Amb27793268 [0,0,0,1,0,1|2,0,0]=4 5070 B11R1.20 CC(=O)N[C@H]1CC[C@@H](O)CC1 Amb10067907 [0,0,0,1,0,1|2,0,0]=4 5071 B11R1.20 CC(=O)N[C@H]1CC[C@H](N)CC1 Amb22802340 [0,0,0,1,0,1|2,0,0]=4 5072 B11R1.20 CC(=O)N[C@H]1CC[C@H](O)CC1 Amb17938052 [0,0,0,1,0,1|2,0,0]=4 5073 B11R1.20 CC(=O)OC1CCC(C)CC1 Amb28341732 [0,0,0,1,0,1|1,0,0]=3 5074 B11R1.20 CC(=O)OC1CCC(F)CC1 Amb25946966 [0,0,0,1,0,1|2,0,0]=4 5075 B11R1.20 CC(=O)OC1CCC(O)CC1 Amb4004946 [0,0,0,1,0,1|2,0,0]=4 5076 B11R1.20 CC(=O)OC1CCN(C)CC1 Amb24059411 [0,0,0,1,0,1|2,0,0]=4 5077 B11R1.20 CC(=O)O[C@H]1CC[C@H](N)CC1 Amb27205242 [0,0,0,1,0,1|2,0,0]=4 5078 B11R1.20 CC(=O)\C=C1\CCC(C)OC1 Amb30010999 [0,0,0,1,0,1|0,0,1]=3 5079 B11R1.20 CC(=O)\C=C1\CCC(C)SC1 Amb35725412 [0,0,0,1,0,1|0,1,1]=4 5080 B11R1.20 CC(C)NC1CCC(C)OC1 Amb35728645 [0,0,0,1,0,1|1,0,1]=4 5081 B11R1.20 CC1CCC(CC(=O)O)CC1 Amb3939873 [0,0,0,1,0,1|2,0,0]=4 5082 B11R1.20 CC1CCC(CC(=O)O)CO1 Amb29866063 [0,0,0,1,0,1|1,0,0]=3 5083 B11R1.20 CC1CCC(CC(=O)O)CS1 Amb35717578 [0,0,0,1,0,1|1,1,0]=4 5084 B11R1.20 CC1CCC(CC(N)=O)CC1 Amb28076761 [0,0,0,1,0,1|2,0,0]=4 5085 B11R1.20 CC1CCC(NC(=N)N)CO1 Amb35695078 [0,0,0,1,0,1|2,0,0]=4 5086 B11R1.20 CC1CCC(NC(=O)Cl)CC1 Amb35614610 [0,0,0,1,0,1|2,0,0]=4 5087 B11R1.20 CC1CCC(NC(=O)Cl)CO1 Amb35636907 [0,0,0,1,0,1|1,0,0]=3 5088 B11R1.20 CC1CCC(NC(=O)Cl)CS1 Amb35633563 [0,0,0,1,0,1|1,1,0]=4 5089 B11R1.20 CC1CCC(NC(N)=O)CC1 Amb1138068 [0,0,0,1,0,1|2,0,0]=4 5090 B11R1.20 CC1CCC(NC(N)=O)CN1 Amb27662586 [0,0,0,1,0,1|2,0,0]=4 5091 B11R1.20 CC1CCC(NC(N)=O)CO1 Amb30018173 [0,0,0,1,0,1|1,0,0]=3 5092 B11R1.20 CC1CCC(NC(N)=O)CS1 Amb35655536 [0,0,0,1,0,1|1,1,0]=4 5093 B11R1.20 CC1CCC(NC(N)=S)CO1 Amb35713957 [0,0,0,1,0,1|1,1,0]=4 5094 B11R1.20 CC1CCC(NN(C)C)CO1 Amb35728646 [0,0,0,1,0,1|2,0,0]=4 5095 B11R1.20 CC1CCC(NS(C)=O)CN1 Amb35651067 [0,0,0,1,0,1|2,0,0]=4 5096 B11R1.20 CC1CCC(OC(=O)Cl)CC1 Amb26372241 [0,0,0,1,0,1|2,0,0]=4 5097 B11R1.20 CC1CC\C(=C/C(=O)O)CO1 Amb29866054 [0,0,0,1,0,1|1,0,1]=4 5098 B11R1.20 CC1CC\C(=N/S(C)=O)CO1 Amb35726541 [0,0,0,1,0,1|1,0,1]=4 5099 B11R1.20 CC1CNC(CC(=O)O)CO1 Amb27462541 [0,0,0,1,0,1|2,0,0]=4 5100 B11R1.20 CC1CNC(CC(N)=O)CO1 Amb27638735 [0,0,0,1,0,1|2,0,0]=4 5101 B11R1.20 C[C@H]1CC[C@@H](CC(N)=O)CC1 Amb27847499 [0,0,0,1,0,1|2,0,0]=4 5102 B11R1.20 C[C@H]1CC[C@H](CC(=O)O)CC1 Amb8631139 [0,0,0,1,0,1|2,0,0]=4 5103 B11R1.20 C[C@H]1CC[C@H](CC(N)=O)CC1 Amb27945436 [0,0,0,1,0,1|2,0,0]=4 5104 B11R1.20 C[C@H]1CC[C@H](NC(=O)Cl)CC1 Amb35633188 [0,0,0,1,0,1|2,0,0]=4 5105 B11R1.24 CCCCC1=CC(=O)CCC1 Amb17593800 [0,0,0,1,0,1|1,0,1]=4 5106 B11R1.24 CCCCC1CC=CC(=O)N1 Amb27483840 [0,0,0,1,0,1|1,0,1]=4 5107 B11R1.24 CCCCN1CCCC(=O)C1 Amb28322509 [0,0,0,1,0,1|2,0,0]=4 5108 B11R1.24 CCCC[C@H]1C=CCC(=O)N1 Amb27176608 [0,0,0,1,0,1|1,0,1]=4 5109 B11R1.24 CCNCC1CCCC(=O)N1 Amb32721818 [0,0,0,1,0,1|2,0,0]=4 5110 B11R1.24 CCOCC1CCCC(=O)C1 Amb28073558 [0,0,0,1,0,1|2,0,0]=4 5111 B11R1.24 CCSCC1CCCC(=O)C1 Amb35699380 [0,0,0,1,0,1|2,0,0]=4 5112 B11R1.24 CNCCC1CCCC(=O)N1 Amb27466194 [0,0,0,1,0,1|2,0,0]=4 5113 B11R1.24 CSCCC1CNCC(=O)N1 Amb27975683 [0,0,0,1,0,1|2,0,0]=4 5114 B11R1.24 NCCCC1CCCC(=O)C1 Amb27272657 [0,0,0,1,0,1|2,0,0]=4 5115 B11R1.24 NCCCC1CCCC(=O)N1 Amb18200144 [0,0,0,1,0,1|2,0,0]=4 5116 B11R1.24 O=C1CCCC(CCCO)N1 Amb18199970 [0,0,0,1,0,1|2,0,0]=4 5117 B11R1.43 CC(=O)CC1CCC(CN)C1 Amb33132949 [0,0,0,1,0,1|2,0,0]=4 5118 B11R1.43 CC(=O)NC1CCC(CN)C1 Amb26652182 [0,0,0,1,0,1|2,0,0]=4 5119 B11R1.43 CC(=O)NC1CCC(CO)C1 Amb24380802 [0,0,0,1,0,1|2,0,0]=4 5120 B11R1.43 CC(=O)NC1CNC(CF)C1 Amb27226081 [0,0,0,1,0,1|2,0,0]=4 5121 B11R1.43 CC(=O)NC1CSC(CN)C1 Amb18197419 [0,0,0,1,0,1|1,1,0]=4 5122 B11R1.43 CC(=O)N[C@@H]1CC[C@H](CN)C1 Amb33071922 [0,0,0,1,0,1|2,0,0]=4 5123 B11R1.43 CC(=O)N[C@@H]1CC[C@H](CO)C1 Amb32685059 [0,0,0,1,0,1|2,0,0]=4 5124 B11R1.43 CC(=O)N[C@@H]1CN[C@@H](CO)C1 Amb27440050 [0,0,0,1,0,1|2,0,0]=4 5125 B11R1.43 CC(=O)N[C@@H]1CN[C@H](CO)C1 Amb24597037 [0,0,0,1,0,1|2,0,0]=4 5126 B11R1.43 CC(=O)SC1CSC(CO)C1 Amb27169918 [0,0,0,1,0,1|1,1,0]=4 5127 B11R1.43 CCC1CC(CC(=O)O)CO1 Amb35633941 [0,0,0,1,0,1|1,0,0]=3 5128 B11R1.43 CCC1CC(NC(=N)N)CO1 Amb35614735 [0,0,0,1,0,1|2,0,0]=4 5129 B11R1.43 CCC1CC(NC(=O)Cl)CO1 Amb35614731 [0,0,0,1,0,1|1,0,0]=3 5130 B11R1.43 CCC1CC(NC(C)=N)CO1 Amb35614632 [0,0,0,1,0,1|1,0,0]=3 5131 B11R1.43 CCC1CC(NC(C)=O)CN1 Amb27440201 [0,0,0,1,0,1|1,0,0]=3 5132 B11R1.43 CCC1CC(NC(C)=O)CO1 Amb35614712 [0,0,0,1,0,1|0,0,0]=2 5133 B11R1.43 CCC1CC(NC(C)C)CO1 Amb35614685 [0,0,0,1,0,1|1,0,1]=4 5134 B11R1.43 CCC1CC(NC(N)=O)CO1 Amb35614656 [0,0,0,1,0,1|1,0,0]=3 5135 B11R1.43 CCC1CC(NC(N)=S)CO1 Amb35614650 [0,0,0,1,0,1|1,1,0]=4 5136 B11R1.43 CCC1CC(NN(C)C)CO1 Amb35614687 [0,0,0,1,0,1|2,0,0]=4 5137 B11R1.43 CCC1CCN(CC(C)=O)C1 Amb27841830 [0,0,0,1,0,1|2,0,0]=4 5138 B11R1.43 CCC1C\C(=C\C(=O)O)CO1 Amb35633933 [0,0,0,1,0,1|1,0,1]=4 5139 B11R1.43 CCC1C\C(=C\C(C)=O)CO1 Amb35634239 [0,0,0,1,0,1|0,0,1]=3 5140 B11R1.43 CCC1C\C(=N\S(C)=O)CO1 Amb35614697 [0,0,0,1,0,1|1,0,1]=4 5141 B11R1.43 CCN1CCC(NC(C)=O)C1 Amb27645520 [0,0,0,1,0,1|2,0,0]=4 5142 B11R1.43 CNC1CCC(NC(C)=O)C1 Amb27959071 [0,0,0,1,0,1|2,0,0]=4 5143 B11R1.43 NCC1CC(CC(=O)O)CO1 Amb33802879 [0,0,0,1,0,1|2,0,0]=4 5144 B11R1.43 NCC1CC(CC(=O)O)CO1 Amb33802996 [0,0,0,1,0,1|2,0,0]=4 5145 B11R1.43 NCC1CC(CC(N)=O)CO1 Amb33803388 [0,0,0,1,0,1|2,0,0]=4 5146 B11R1.43 NCC1CC(CC(N)=O)CO1 Amb33804101 [0,0,0,1,0,1|2,0,0]=4 5147 B11R1.53 C#CC1CCCCC1C(C)=O Amb25677027 [0,0,0,1,0,1|1,0,1]=4 5148 B11R1.53 C#CC1CCCCN1C(C)=O Amb25891418 [0,0,0,1,0,1|1,0,1]=4 5149 B11R1.53 C#C[C@@H]1CCCCN1C(C)=O Amb26428401 [0,0,0,1,0,1|1,0,1]=4 5150 B11R1.53 C#C[C@H]1CCCCN1C(C)=O Amb19301196 [0,0,0,1,0,1|1,0,1]=4 5151 B11R1.53 C=C(C)C1CCCOC1CO Amb27220119 [0,0,0,1,0,1|2,0,0]=4 5152 B11R1.53 C=CC1CCCCC1C(C)=O Amb26627090 [0,0,0,1,0,1|1,0,1]=4 5153 B11R1.53 C=CC1CCCCN1C(C)=O Amb26880396 [0,0,0,1,0,1|1,0,1]=4 5154 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(C)=O Amb27861488 [0,0,0,1,0,1|1,0,1]=4 5155 B11R1.53 C=C[C@H]1CCCC[C@@H]1C(C)=O Amb27252281 [0,0,0,1,0,1|1,0,1]=4 5156 B11R1.53 C=C[C@H]1CCCC[C@H]1C(C)=O Amb28054461 [0,0,0,1,0,1|1,0,1]=4 5157 B11R1.53 CC(=O)C1CCCCC1C#N Amb25864043 [0,0,0,1,0,1|1,0,1]=4 5158 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [0,0,0,1,0,1|1,0,0]=3 5159 B11R1.53 CC(=O)C1CCCCC1CO Amb28144180 [0,0,0,1,0,1|0,0,0]=2 5160 B11R1.53 CC(=O)N1CCCCC1CO Amb9277476 [0,0,0,1,0,1|0,0,0]=2 5161 B11R1.53 CC(=O)N1CCCC[C@@H]1CO Amb25829477 [0,0,0,1,0,1|0,0,0]=2 5162 B11R1.53 CC(=O)N1CCCC[C@H]1CO Amb25268937 [0,0,0,1,0,1|0,0,0]=2 5163 B11R1.53 CC(=O)N1CCNCC1CN Amb26367817 [0,0,0,1,0,1|2,0,0]=4 5164 B11R1.53 CC(=O)N1CCOCC1CCl Amb27449218 [0,0,0,1,0,1|2,0,0]=4 5165 B11R1.53 CC(=O)N1CCSCC1CCl Amb28192987 [0,0,0,1,0,1|2,0,0]=4 5166 B11R1.53 CC(=O)N1CCSCC1CN Amb27491261 [0,0,0,1,0,1|2,0,0]=4 5167 B11R1.53 CC(=O)[C@@H]1CCCC[C@@H]1CN Amb33132917 [0,0,0,1,0,1|1,0,0]=3 5168 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C#N Amb28324352 [0,0,0,1,0,1|1,0,1]=4 5169 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C=O Amb27789881 [0,0,0,1,0,1|0,0,2]=4 5170 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CBr Amb27252188 [0,0,0,1,0,1|1,0,0]=3 5171 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CCl Amb27634843 [0,0,0,1,0,1|1,0,0]=3 5172 B11R1.53 CC(=O)[C@H]1CCCC[C@H]1C#N Amb27471969 [0,0,0,1,0,1|1,0,1]=4 5173 B11R1.53 CC(C)N1CCCCC1CO Amb18799819 [0,0,0,1,0,1|1,0,1]=4 5174 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,0,0,1,0,1|2,0,0]=4 5175 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [0,0,0,1,0,1|2,0,0]=4 5176 B11R1.53 CCC1CCCCN1C(N)=O Amb8873523 [0,0,0,1,0,1|2,0,0]=4 5177 B11R1.53 CCC1CNCCC1C(C)=O Amb32676965 [0,0,0,1,0,1|2,0,0]=4 5178 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [0,0,0,1,0,1|1,0,0]=3 5179 B11R1.53 CN(C)C1CCCCC1CO Amb27863650 [0,0,0,1,0,1|2,0,0]=4 5180 B11R1.53 CN(C)[C@@H]1CCCC[C@@H]1CO Amb33484005 [0,0,0,1,0,1|2,0,0]=4 5181 B11R1.53 CN(C)[C@@H]1CCCC[C@H]1CO Amb26551911 [0,0,0,1,0,1|2,0,0]=4 5182 B11R1.53 CN(C)[C@H]1CCCC[C@@H]1CO Amb27857912 [0,0,0,1,0,1|2,0,0]=4 5183 B11R1.53 COC1CCCCC1C(C)=O Amb27762537 [0,0,0,1,0,1|2,0,0]=4 5184 B11R1.53 COC1CCCCN1C(C)=O Amb25793837 [0,0,0,1,0,1|2,0,0]=4 5185 B11R1.53 CS(=O)N1CCCCC1CO Amb27226936 [0,0,0,1,0,1|1,0,0]=3 5186 B11R1.53 C[C@@H](O)[C@H]1CCCC[C@H]1CO Amb27420658 [0,0,0,1,0,1|0,0,2]=4 5187 B11R1.53 N=C(N)C1CCCCC1CO Amb27843634 [0,0,0,1,0,1|2,0,0]=4 5188 B11R1.53 NC(=O)C1CCCCC1CO Amb28365379 [0,0,0,1,0,1|1,0,0]=3 5189 B11R1.53 NC(=O)N1CCSCC1CO Amb28146416 [0,0,0,1,0,1|2,0,0]=4 5190 B11R1.53 NC(=O)[C@@H]1CCCC[C@@H]1CO Amb26884904 [0,0,0,1,0,1|1,0,0]=3 5191 B11R1.53 NC(=O)[C@@H]1CCCC[C@H]1CO Amb16233807 [0,0,0,1,0,1|1,0,0]=3 5192 B11R1.53 NC(=O)[C@H]1CCCC[C@H]1CO Amb25362020 [0,0,0,1,0,1|1,0,0]=3 5193 B11R1.53 NCC1CCCCC1C(=O)O Amb18126060 [0,0,0,1,0,1|2,0,0]=4 5194 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb22901093 [0,0,0,1,0,1|2,0,0]=4 5195 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb24602383 [0,0,0,1,0,1|2,0,0]=4 5196 B11R1.53 O=C(O)C1=CCCCC1CO Amb27401800 [0,0,0,1,0,1|1,0,1]=4 5197 B11R1.53 O=C(O)C1CCCCC1CCl Amb28121870 [0,0,0,1,0,1|2,0,0]=4 5198 B11R1.53 O=C(O)C1CCCCC1CF Amb20668097 [0,0,0,1,0,1|2,0,0]=4 5199 B11R1.53 O=C(O)C1CCCCC1CO Amb24484407 [0,0,0,1,0,1|1,0,0]=3 5200 B11R1.53 O=C(O)C1CCNCC1CO Amb28053243 [0,0,0,1,0,1|2,0,0]=4 5201 B11R1.53 O=C(O)C1CNCCC1CO Amb27215492 [0,0,0,1,0,1|2,0,0]=4 5202 B11R1.53 O=C(O)[C@@H]1CCCN[C@H]1CO Amb18199870 [0,0,0,1,0,1|2,0,0]=4 5203 B11R1.53 O=C(O)[C@H]1CCCC[C@H]1CO Amb24615220 [0,0,0,1,0,1|1,0,0]=3 5204 B11R1.53 O=C(O)[C@H]1CCCN[C@@H]1CO Amb27420244 [0,0,0,1,0,1|2,0,0]=4 5205 B11R1.86 C=C(C)CC1CCCCC1N Amb28240598 [0,0,0,1,0,1|2,0,0]=4 5206 B11R1.86 C=C(C)CC1CCCCC1O Amb18799539 [0,0,0,1,0,1|1,0,0]=3 5207 B11R1.86 C=C(C)C[C@@H]1CCCC[C@H]1O Amb28053661 [0,0,0,1,0,1|1,0,0]=3 5208 B11R1.86 C=C(C)C[C@H]1NCCC[C@@H]1O Amb27795637 [0,0,0,1,0,1|2,0,0]=4 5209 B11R1.86 C=C(Cl)CC1CCCCC1O Amb24575552 [0,0,0,1,0,1|1,0,1]=4 5210 B11R1.86 C=C(Cl)C[C@@H]1CCCC[C@H]1O Amb33213298 [0,0,0,1,0,1|1,0,1]=4 5211 B11R1.86 CC(=O)CC1CCCCC1=O Amb17593853 [0,0,0,1,0,1|0,0,2]=4 5212 B11R1.86 CC(=O)CC1CCCCC1Cl Amb28137935 [0,0,0,1,0,1|1,0,0]=3 5213 B11R1.86 CC(=O)CC1CCCCC1F Amb27791180 [0,0,0,1,0,1|1,0,0]=3 5214 B11R1.86 CC(=O)CC1CCCCC1N Amb24582661 [0,0,0,1,0,1|1,0,0]=3 5215 B11R1.86 CC(=O)CC1CCCCN1C Amb5718445 [0,0,0,1,0,1|2,0,0]=4 5216 B11R1.86 CC(=O)CC1CCCOC1O Amb28253856 [0,0,0,1,0,1|1,0,0]=3 5217 B11R1.86 CC(=O)CN1CCCCC1C Amb8427993 [0,0,0,1,0,1|2,0,0]=4 5218 B11R1.86 CC(=O)C[C@@H]1CCCCN1C Amb26450192 [0,0,0,1,0,1|2,0,0]=4 5219 B11R1.86 CC(=O)C[C@@H]1CCCC[C@@H]1N Amb33307982 [0,0,0,1,0,1|1,0,0]=3 5220 B11R1.86 CC(=O)C[C@@H]1CCCC[C@H]1O Amb27212016 [0,0,0,1,0,1|0,0,0]=2 5221 B11R1.86 CC(=O)C[C@@H]1OCCO[C@@H]1O Amb27252179 [0,0,0,1,0,1|2,0,0]=4 5222 B11R1.86 CC(=O)NC1CC=CCC1O Amb27166541 [0,0,0,1,0,1|0,0,2]=4 5223 B11R1.86 CC(=O)NC1CCC=CC1O Amb27879613 [0,0,0,1,0,1|0,0,2]=4 5224 B11R1.86 CC(=O)NC1CCCCC1Cl Amb27875116 [0,0,0,1,0,1|1,0,0]=3 5225 B11R1.86 CC(=O)NC1CCCCC1O Amb18797124 [0,0,0,1,0,1|0,0,0]=2 5226 B11R1.86 CC(=O)NC1CCCCC1S Amb28292774 [0,0,0,1,0,1|0,1,0]=3 5227 B11R1.86 CC(=O)NC1CCCC[C@@H]1Cl Amb24571625 [0,0,0,1,0,1|1,0,0]=3 5228 B11R1.86 CC(=O)NC1CCNCC1C Amb25866016 [0,0,0,1,0,1|2,0,0]=4 5229 B11R1.86 CC(=O)NC1CCNCC1C Amb33328616 [0,0,0,1,0,1|2,0,0]=4 5230 B11R1.86 CC(=O)NC1CCNCC1F Amb32993329 [0,0,0,1,0,1|2,0,0]=4 5231 B11R1.86 CC(=O)NC1CCNCC1O Amb27477973 [0,0,0,1,0,1|1,0,0]=3 5232 B11R1.86 CC(=O)NC1CNCCC1C Amb27591818 [0,0,0,1,0,1|2,0,0]=4 5233 B11R1.86 CC(=O)N[C@@H]1CC=CC[C@H]1O Amb27626982 [0,0,0,1,0,1|0,0,2]=4 5234 B11R1.86 CC(=O)N[C@@H]1CCC=C[C@@H]1O Amb27790639 [0,0,0,1,0,1|0,0,2]=4 5235 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1Cl Amb26450561 [0,0,0,1,0,1|1,0,0]=3 5236 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N Amb27822700 [0,0,0,1,0,1|1,0,0]=3 5237 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C Amb28435840 [0,0,0,1,0,1|1,0,0]=3 5238 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1Cl Amb27797252 [0,0,0,1,0,1|1,0,0]=3 5239 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O Amb28320855 [0,0,0,1,0,1|0,0,0]=2 5240 B11R1.86 CC(=O)OC1CCC=CC1O Amb25150513 [0,0,0,1,0,1|0,0,2]=4 5241 B11R1.86 CC(=O)OC1CCCCC1=O Amb10576141 [0,0,0,1,0,1|0,0,2]=4 5242 B11R1.86 CC(=O)OC1OCCOC1O Amb27665359 [0,0,0,1,0,1|2,0,0]=4 5243 B11R1.86 CC(=O)O[C@@H]1C=CCC[C@H]1O Amb28455075 [0,0,0,1,0,1|0,0,2]=4 5244 B11R1.86 CC(=O)O[C@@H]1CC=CC[C@@H]1O Amb27623936 [0,0,0,1,0,1|0,0,2]=4 5245 B11R1.86 CC(=O)O[C@@H]1CCC=C[C@@H]1O Amb27207723 [0,0,0,1,0,1|0,0,2]=4 5246 B11R1.86 CC(=O)O[C@@H]1CCCC[C@@H]1Cl Amb27454844 [0,0,0,1,0,1|1,0,0]=3 5247 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1C Amb26958236 [0,0,0,1,0,1|1,0,0]=3 5248 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27483080 [0,0,0,1,0,1|1,0,0]=3 5249 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1O Amb17844353 [0,0,0,1,0,1|0,0,0]=2 5250 B11R1.86 CC(=O)O[C@H]1CC=CC[C@H]1O Amb27220481 [0,0,0,1,0,1|0,0,2]=4 5251 B11R1.86 CC(=O)O[C@H]1CCCC[C@@H]1Cl Amb27440472 [0,0,0,1,0,1|1,0,0]=3 5252 B11R1.86 CC(=O)S[C@@H]1CCCC[C@@H]1Cl Amb27845415 [0,0,0,1,0,1|1,0,0]=3 5253 B11R1.86 CC(=O)S[C@@H]1CCCC[C@H]1N Amb30884410 [0,0,0,1,0,1|1,0,0]=3 5254 B11R1.86 CC(C)=CC1CCCCC1O Amb26633689 [0,0,0,1,0,1|1,0,0]=3 5255 B11R1.86 CC(C)=C[C@@H]1CCCC[C@H]1O Amb26436592 [0,0,0,1,0,1|1,0,0]=3 5256 B11R1.86 CC(C)=N[C@@H]1CCCC[C@H]1O Amb28200853 [0,0,0,1,0,1|1,0,0]=3 5257 B11R1.86 CC(C)CC1CCCCC1O Amb10809767 [0,0,0,1,0,1|1,0,1]=4 5258 B11R1.86 CC(C)C[C@@H]1CCCC[C@H]1O Amb33212896 [0,0,0,1,0,1|1,0,1]=4 5259 B11R1.86 CC(C)NC1CCCCC1O Amb18281387 [0,0,0,1,0,1|1,0,1]=4 5260 B11R1.86 CC(C)N[C@@H]1CCCC[C@@H]1O Amb27467887 [0,0,0,1,0,1|1,0,1]=4 5261 B11R1.86 CC(C)N[C@@H]1CCCC[C@H]1O Amb844925 [0,0,0,1,0,1|1,0,1]=4 5262 B11R1.86 CC(C)O[C@@H]1CCCC[C@H]1O Amb28129982 [0,0,0,1,0,1|1,0,1]=4 5263 B11R1.86 CC(C)SC1CCCCC1O Amb18795510 [0,0,0,1,0,1|1,0,1]=4 5264 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [0,0,0,1,0,1|2,0,0]=4 5265 B11R1.86 CC1CCCCC1CC(N)=O Amb27232827 [0,0,0,1,0,1|2,0,0]=4 5266 B11R1.86 CC1CCCCC1NC(=O)Cl Amb35637113 [0,0,0,1,0,1|2,0,0]=4 5267 B11R1.86 CC1CCCCC1NC(N)=O Amb1105317 [0,0,0,1,0,1|2,0,0]=4 5268 B11R1.86 CC1CCCCC1OC(=O)Cl Amb27648622 [0,0,0,1,0,1|2,0,0]=4 5269 B11R1.86 CN(C)CC1CCCCC1O Amb2602397 [0,0,0,1,0,1|2,0,0]=4 5270 B11R1.86 CS(=O)NC1CCCCC1Br Amb27255507 [0,0,0,1,0,1|2,0,0]=4 5271 B11R1.86 CS(=O)NC1CCCCC1Cl Amb27859335 [0,0,0,1,0,1|2,0,0]=4 5272 B11R1.86 CS(=O)N[C@@H]1CCCC[C@H]1O Amb28062286 [0,0,0,1,0,1|1,0,0]=3 5273 B11R1.86 C\C(Cl)=N/[C@@H]1CCCC[C@H]1Cl Amb27791739 [0,0,0,1,0,1|2,0,0]=4 5274 B11R1.86 N=C(N)SC1CCCCC1O Amb27643405 [0,0,0,1,0,1|2,0,0]=4 5275 B11R1.86 NC(=O)CC1CCCCC1O Amb25700984 [0,0,0,1,0,1|1,0,0]=3 5276 B11R1.86 NC(=O)CC1CCNCC1O Amb27186418 [0,0,0,1,0,1|2,0,0]=4 5277 B11R1.86 NC(=O)CC1COCCC1O Amb27658867 [0,0,0,1,0,1|2,0,0]=4 5278 B11R1.86 NC(=O)NC1CCCCC1O Amb18182354 [0,0,0,1,0,1|1,0,0]=3 5279 B11R1.86 NC(=O)N[C@@H]1CCCC[C@@H]1O Amb28384057 [0,0,0,1,0,1|1,0,0]=3 5280 B11R1.86 NC(=O)N[C@@H]1CCCC[C@H]1F Amb27231936 [0,0,0,1,0,1|2,0,0]=4 5281 B11R1.86 NC(=O)N[C@@H]1CCCC[C@H]1O Amb27822934 [0,0,0,1,0,1|1,0,0]=3 5282 B11R1.86 NC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27657603 [0,0,0,1,0,1|2,0,0]=4 5283 B11R1.86 NC(=O)\C=C1/CCCCC1O Amb27813333 [0,0,0,1,0,1|1,0,1]=4 5284 B11R1.86 NC1CCCCC1CC(=O)O Amb24509773 [0,0,0,1,0,1|2,0,0]=4 5285 B11R1.86 NC1CCCCC1CC(=O)O Amb28652992 [0,0,0,1,0,1|2,0,0]=4 5286 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb26528136 [0,0,0,1,0,1|2,0,0]=4 5287 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb32661117 [0,0,0,1,0,1|2,0,0]=4 5288 B11R1.86 N[C@@H]1CCCC[C@H]1CC(=O)O Amb28199039 [0,0,0,1,0,1|2,0,0]=4 5289 B11R1.86 N[C@H]1CCCC[C@H]1CC(=O)O Amb24561031 [0,0,0,1,0,1|2,0,0]=4 5290 B11R1.86 O=C(Cl)OC1CCCCC1Cl Amb27233656 [0,0,0,1,0,1|2,0,0]=4 5291 B11R1.86 O=C(O)CC1CCCCC1F Amb24697602 [0,0,0,1,0,1|2,0,0]=4 5292 B11R1.86 O=C(O)CC1CCCCC1O Amb8009303 [0,0,0,1,0,1|1,0,0]=3 5293 B11R1.86 O=C(O)CC1CCCC[C@H]1O Amb25792260 [0,0,0,1,0,1|1,0,0]=3 5294 B11R1.86 O=C(O)CC1CCOCC1O Amb18199849 [0,0,0,1,0,1|2,0,0]=4 5295 B11R1.86 O=C(O)CC1CCSCC1O Amb18196580 [0,0,0,1,0,1|2,0,0]=4 5296 B11R1.86 O=C(O)CC1COCCC1O Amb18199848 [0,0,0,1,0,1|2,0,0]=4 5297 B11R1.86 O=C(O)CC1CSCCC1O Amb18196579 [0,0,0,1,0,1|2,0,0]=4 5298 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1F Amb25168843 [0,0,0,1,0,1|2,0,0]=4 5299 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Amb28057566 [0,0,0,1,0,1|1,0,0]=3 5300 B11R1.86 O=C(O)C[C@@H]1OCCC[C@H]1O Amb27232764 [0,0,0,1,0,1|2,0,0]=4 5301 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O Amb25274080 [0,0,0,1,0,1|1,0,0]=3 5302 B11R1.86 O=C(O)C[C@H]1CCCC[C@H]1O Amb27419962 [0,0,0,1,0,1|1,0,0]=3 5303 B11R1.86 O=C(O)\C=C1\CCCCC1O Amb27241357 [0,0,0,1,0,1|1,0,1]=4 5304 B11R1.86 OC1CCCCC1C=C(F)F Amb28065122 [0,0,0,1,0,1|2,0,0]=4 5305 B11R1.86 O[C@@H]1CCCC[C@H]1C=C(F)F Amb27775593 [0,0,0,1,0,1|2,0,0]=4 5306 B11R1.183 C=CCC1CC(=O)OC1CO Amb28138503 [0,0,0,1,0,1|0,0,2]=4 5307 B11R1.183 CCCC1CC(=O)CC1CC Amb28343137 [0,0,0,1,0,1|1,0,0]=3 5308 B11R1.183 CCCC1CC(=O)OC1CO Amb27768434 [0,0,0,1,0,1|0,0,0]=2 5309 B11R1.183 CCCC1OC(=O)NC1CO Amb28068824 [0,0,0,1,0,1|1,0,0]=3 5310 B11R1.183 CCC[C@@H]1CC(=O)C[C@H]1CC Amb24604137 [0,0,0,1,0,1|1,0,0]=3 5311 B11R1.183 CCC[C@@H]1OC(=O)N[C@@H]1CO Amb27981987 [0,0,0,1,0,1|1,0,0]=3 5312 B11R1.183 CCC[C@H]1CC(=O)C[C@@H]1CC Amb27632339 [0,0,0,1,0,1|1,0,0]=3 5313 B11R1.183 CCC[C@H]1CC(=O)O[C@@H]1CO Amb27213796 [0,0,0,1,0,1|0,0,0]=2 5314 B11R1.183 COCC1NC(=O)CC1CO Amb27634313 [0,0,0,1,0,1|2,0,0]=4 5315 B11R1.183 CSCC1OC(=O)NC1CO Amb27173731 [0,0,0,1,0,1|2,0,0]=4 5316 B11R1.183 CSC[C@@H]1OC(=O)N[C@H]1CO Amb27222866 [0,0,0,1,0,1|2,0,0]=4 5317 B11R1.183 C\C=C\[C@H]1CC(=O)O[C@H]1CO Amb27197580 [0,0,0,1,0,1|0,0,2]=4 5318 B11R1.183 NCC[C@H]1OC(=O)N[C@@H]1CO Amb27878628 [0,0,0,1,0,1|2,0,0]=4 5319 B11R1.204 CC(=O)N1CCC1CCCN Amb27674411 [0,0,0,1,0,1|2,0,0]=4 5320 B11R1.204 CCCCC1=C(C(C)=O)CC1 Amb28080144 [0,0,0,1,0,1|1,0,1]=4 5321 B11R1.204 CNCCC1CCN1C(C)=O Amb27674412 [0,0,0,1,0,1|2,0,0]=4 5322 B11R1.230 CCCCC1=CC(=O)CC1O Amb28122432 [0,0,0,1,0,1|0,0,1]=3 5323 B11R1.230 CCCCC1=CC(=O)OC1O Amb25356386 [0,0,0,1,0,1|1,0,1]=4 5324 B11R1.230 CCCCC1CC(=O)CC1O Amb27434202 [0,0,0,1,0,1|0,0,0]=2 5325 B11R1.230 CCCCC1C[C@H](O)C[C@@H]1O Amb27484414 [0,0,0,1,0,1|0,0,2]=4 5326 B11R1.230 CCCCC1NC(=O)CC1=O Amb35711627 [0,0,0,1,0,1|0,0,2]=4 5327 B11R1.230 CCCCC1OC(=O)CC1C Amb15692528 [0,0,0,1,0,1|1,0,0]=3 5328 B11R1.230 CCCCC1OC(=O)CC1O Amb27405206 [0,0,0,1,0,1|0,0,0]=2 5329 B11R1.230 CCCC[C@@H]1CC(=O)N[C@@H]1C Amb27203377 [0,0,0,1,0,1|2,0,0]=4 5330 B11R1.230 CCCC[C@@H]1CC(=O)N[C@H]1C Amb27852427 [0,0,0,1,0,1|2,0,0]=4 5331 B11R1.230 CCCC[C@@H]1NC(=N)C[C@H]1C Amb28196678 [0,0,0,1,0,1|2,0,0]=4 5332 B11R1.230 CCCC[C@@H]1OC(=O)C[C@H]1O Amb27472606 [0,0,0,1,0,1|0,0,0]=2 5333 B11R1.230 CCCC[C@H]1NC(=O)O[C@@H]1C Amb27805409 [0,0,0,1,0,1|2,0,0]=4 5334 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1C Amb27234681 [0,0,0,1,0,1|1,0,0]=3 5335 B11R1.230 CCCC[C@H]1OC(=O)C[C@H]1O Amb27969128 [0,0,0,1,0,1|0,0,0]=2 5336 B11R1.230 NC1CC(=O)OC1CCCBr Amb28066067 [0,0,0,1,0,1|2,0,0]=4 5337 B11R1.245 C=CC1CCCCCC(=O)N1 Amb28290513 [0,0,0,1,0,1|1,0,1]=4 5338 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [0,0,0,1,0,1|1,0,0]=3 5339 B11R1.245 COC1CCCCCC(=O)C1 Amb27164648 [0,0,0,1,0,1|2,0,0]=4 5340 B11R1.252 CC(=O)O[C@@H]1O[C@H](CO)[C@H]1O Amb27631953 [0,0,0,1,0,1|2,0,0]=4 5341 B11R1.313 CC(=O)CC1CCC(C)C1=O Amb22342539 [0,0,0,1,0,1|0,0,2]=4 5342 B11R1.313 CC(=O)C[C@H]1CC[C@H](C)C1=O Amb28057442 [0,0,0,1,0,1|0,0,2]=4 5343 B11R1.313 CC(=O)NC1CCC(N)C1O Amb28397341 [0,0,0,1,0,1|1,0,0]=3 5344 B11R1.313 CC(=O)NC1CCC(O)C1O Amb27783365 [0,0,0,1,0,1|1,0,0]=3 5345 B11R1.313 CC(=O)NC1COC(C)C1C Amb29856401 [0,0,0,1,0,1|2,0,0]=4 5346 B11R1.313 CC(=O)N[C@@H]1CC[C@@H](N)[C@@H]1O Amb27637597 [0,0,0,1,0,1|1,0,0]=3 5347 B11R1.313 CC(=O)N[C@H]1CC[C@H](N)[C@H]1O Amb28286482 [0,0,0,1,0,1|1,0,0]=3 5348 B11R1.313 CC(=O)SC1CCC(C)C1Cl Amb27863810 [0,0,0,1,0,1|1,0,0]=3 5349 B11R1.313 CC(=O)S[C@@H]1CC[C@H](C)C1Cl Amb27983648 [0,0,0,1,0,1|1,0,0]=3 5350 B11R1.313 CC1CCC(CC(=O)O)C1C Amb27240379 [0,0,0,1,0,1|2,0,0]=4 5351 B11R1.313 CC1CCC(NC(=O)Cl)C1C Amb35633422 [0,0,0,1,0,1|2,0,0]=4 5352 B11R1.382 O=S1(=O)CCCCC(CO)C1 Amb27775438 [0,0,0,1,0,1|2,0,0]=4 5353 B11R1.398 CC(=O)NC1(CO)CCC1C Amb28367716 [0,0,0,1,0,1|0,0,0]=2 5354 B11R1.398 CC1CCC1(CN)CC(=O)O Amb27224689 [0,0,0,1,0,1|2,0,0]=4 5355 B11R1.471 CC(=O)N1C(C)CCC1CO Amb26601700 [0,0,0,1,0,1|0,0,0]=2 5356 B11R1.471 CC(=O)N1[C@@H](C)CC[C@@H]1CO Amb27978512 [0,0,0,1,0,1|0,0,0]=2 5357 B11R1.471 CC(=O)N1[C@@H](C)CC[C@H]1CO Amb28250207 [0,0,0,1,0,1|0,0,0]=2 5358 B11R1.471 CC(=O)N1[C@H](C)CC[C@@H]1CO Amb27767852 [0,0,0,1,0,1|0,0,0]=2 5359 B11R1.471 CCC1CCC(C)N1C(=O)Cl Amb24412494 [0,0,0,1,0,1|2,0,0]=4 5360 B11R1.471 CCC1CCC(C)N1C(C)=N Amb27865257 [0,0,0,1,0,1|2,0,0]=4 5361 B11R1.471 CCC1CCC(C)N1C(C)=O Amb27806730 [0,0,0,1,0,1|1,0,0]=3 5362 B11R1.742 CC(=N)NC1CCCCCC1 Amb27213610 [0,0,0,1,0,1|2,0,0]=4 5363 B11R1.742 CC(=N)NC1COCCOC1 Amb28068668 [0,0,0,1,0,1|2,0,0]=4 5364 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [0,0,0,1,0,1|1,0,1]=4 5365 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [0,0,0,1,0,1|1,0,0]=3 5366 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,1|2,0,0]=4 5367 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [0,0,0,1,0,1|2,0,0]=4 5368 B11R1.742 CC(=O)CN1CCCCCC1 Amb8427988 [0,0,0,1,0,1|2,0,0]=4 5369 B11R1.742 CC(=O)CN1CCCCCC1 Amb9173328 [0,0,0,1,0,1|2,0,0]=4 5370 B11R1.742 CC(=O)C[C@@H]1C=CCCCC1 Amb27227101 [0,0,0,1,0,1|1,0,1]=4 5371 B11R1.742 CC(=O)NC1CC=CCCC1 Amb28073104 [0,0,0,1,0,1|1,0,1]=4 5372 B11R1.742 CC(=O)NC1CCCSCC1 Amb35691520 [0,0,0,1,0,1|2,0,0]=4 5373 B11R1.742 CC(=O)NC1CNCCOC1 Amb28246185 [0,0,0,1,0,1|1,0,0]=3 5374 B11R1.742 CC(=O)OC1CCCCCC1 Amb26487005 [0,0,0,1,0,1|1,0,0]=3 5375 B11R1.742 CC(N)CC1CCCCOC1 Amb28198973 [0,0,0,1,0,1|1,0,1]=4 5376 B11R1.742 CS(=O)CC1CCCCNC1 Amb35611340 [0,0,0,1,0,1|2,0,0]=4 5377 B11R1.742 CS(=O)NC1CCCCNC1 Amb27774830 [0,0,0,1,0,1|2,0,0]=4 5378 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [0,0,0,1,0,1|2,0,0]=4 5379 B11R1.742 NC(=O)CC1COCCCN1 Amb27438569 [0,0,0,1,0,1|2,0,0]=4 5380 B11R1.742 NC(=O)NC1CCCCCC1 Amb4008281 [0,0,0,1,0,1|2,0,0]=4 5381 B11R1.742 O=C(Cl)NC1CCCCCC1 Amb35637080 [0,0,0,1,0,1|2,0,0]=4 5382 B11R1.742 O=C(Cl)NC1COCCOC1 Amb35633339 [0,0,0,1,0,1|2,0,0]=4 5383 B11R1.742 O=C(Cl)OC1CCCCCC1 Amb28365356 [0,0,0,1,0,1|2,0,0]=4 5384 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,0,0,1,0,1|2,0,0]=4 5385 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [0,0,0,1,0,1|2,0,0]=4 5386 B11R1.742 O=C(O)CC1COCCOC1 Amb27847958 [0,0,0,1,0,1|2,0,0]=4 5387 B11R1.750 CC1CC1C(CN)CC(=O)O Amb33145044 [0,0,0,1,0,1|2,0,0]=4 5388 B11R1.750 CC\C(=C/C(C)=O)C1CC1C Amb27760638 [0,0,0,1,0,1|1,0,1]=4 5389 B11R1.751 CC(C)CC(CO)C1CCC1 Amb27671367 [0,0,0,1,0,1|1,0,1]=4 5390 B11R1.751 CCC(CC(=O)O)C1CCC1 Amb24767070 [0,0,0,1,0,1|2,0,0]=4 5391 B11R1.751 CCC(NC(=O)Cl)C1CCC1 Amb35633294 [0,0,0,1,0,1|2,0,0]=4 5392 B11R1.751 CCC(NC(N)=O)C1CCC1 Amb27803156 [0,0,0,1,0,1|2,0,0]=4 5393 B11R1.751 CCC(OC(=O)Cl)C1CCC1 Amb33297240 [0,0,0,1,0,1|2,0,0]=4 5394 B11R1.751 CC\C(=C/C(C)=O)C1CCC1 Amb28461040 [0,0,0,1,0,1|1,0,1]=4 5395 B11R1.751 CS(=O)CC(CN)C1CCC1 Amb28079602 [0,0,0,1,0,1|2,0,0]=4 5396 B11R1.751 NCC(CC(=O)O)C1CCC1 Amb25382118 [0,0,0,1,0,1|2,0,0]=4 5397 B11R1.751 NCC(CC(=O)O)C1CCC1 Amb32671336 [0,0,0,1,0,1|2,0,0]=4 5398 B11R1.913 CCCCC1(C#N)CC(=O)C1 Amb33427780 [0,0,0,1,0,1|1,0,1]=4 5399 B11R1.913 CCCSC1(CN)CC(=O)C1 Amb27987057 [0,0,0,1,0,1|2,0,0]=4 5400 B11R1.918 CCCCC1(CC(=O)O)CC1 Amb33428428 [0,0,0,1,0,1|2,0,0]=4 5401 B11R1.952 C=C1CC(O)CCC(CO)C1 Amb27456602 [0,0,0,1,0,1|2,0,0]=4 5402 B11R1.980 CC(=O)N1C(CO)CC1CO Amb26340895 [0,0,0,1,0,1|1,0,0]=3 5403 B11R1.1032 CC(=O)NC(CO)CC1CC1 Amb27270357 [0,0,0,1,0,1|0,0,0]=2 5404 B11R1.1032 NC(=O)NC(CO)CC1CC1 Amb27271881 [0,0,0,1,0,1|1,0,0]=3 5405 B11R1.1032 NCC(CC(=O)O)CC1CC1 Amb32954882 [0,0,0,1,0,1|2,0,0]=4 5406 B11R1.1062 C=C(C)CC1(CBr)CCCC1 Amb32689623 [0,0,0,1,0,1|2,0,0]=4 5407 B11R1.1062 C=C(C)CC1(CCl)CCCC1 Amb32689615 [0,0,0,1,0,1|2,0,0]=4 5408 B11R1.1062 CC(=O)CC1(C=O)CCCC1 Amb28208364 [0,0,0,1,0,1|0,0,2]=4 5409 B11R1.1062 CC(=O)NC1(C#N)CCCC1 Amb4038917 [0,0,0,1,0,1|1,0,1]=4 5410 B11R1.1062 CC(=O)NC1(CN)CCCC1 Amb2606124 [0,0,0,1,0,1|1,0,0]=3 5411 B11R1.1062 CC(=O)OC1(C#N)CCCC1 Amb4011622 [0,0,0,1,0,1|1,0,1]=4 5412 B11R1.1062 CC(C)NC1(CO)CCCC1 Amb18290174 [0,0,0,1,0,1|1,0,1]=4 5413 B11R1.1062 CCC1(CC(=O)O)CCCC1 Amb27795146 [0,0,0,1,0,1|2,0,0]=4 5414 B11R1.1062 CCC1(NC(=O)Cl)CCCC1 Amb35633537 [0,0,0,1,0,1|2,0,0]=4 5415 B11R1.1062 CCC1(NC(C)=N)CCCC1 Amb27190514 [0,0,0,1,0,1|2,0,0]=4 5416 B11R1.1062 CCC1(NC(N)=O)CCCC1 Amb27437771 [0,0,0,1,0,1|2,0,0]=4 5417 B11R1.1062 CCC1(OC(=O)Cl)CCCC1 Amb33297278 [0,0,0,1,0,1|2,0,0]=4 5418 B11R1.1062 CN(C)CC1(CO)CCCC1 Amb17334422 [0,0,0,1,0,1|2,0,0]=4 5419 B11R1.1062 CS(=O)CC1(CN)CCCC1 Amb30014492 [0,0,0,1,0,1|2,0,0]=4 5420 B11R1.1062 CS(=O)NC1(CN)CCCC1 Amb27613466 [0,0,0,1,0,1|2,0,0]=4 5421 B11R1.1062 CS(=O)NC1(CO)CCCC1 Amb27226937 [0,0,0,1,0,1|1,0,0]=3 5422 B11R1.1062 CS(=O)NC1(CO)CCOC1 Amb27669438 [0,0,0,1,0,1|2,0,0]=4 5423 B11R1.1062 N=C(N)NC1(CO)CCCC1 Amb18183193 [0,0,0,1,0,1|2,0,0]=4 5424 B11R1.1062 NC(=O)NC1(CO)CCOC1 Amb28146427 [0,0,0,1,0,1|2,0,0]=4 5425 B11R1.1062 NCC1(CC(=O)O)CCCC1 Amb18830607 [0,0,0,1,0,1|2,0,0]=4 5426 B11R1.1062 NCC1(CC(=O)O)CCCC1 Amb33547662 [0,0,0,1,0,1|2,0,0]=4 5427 B11R1.1062 NCC1(NC(N)=O)CCCC1 Amb18251518 [0,0,0,1,0,1|2,0,0]=4 5428 B11R1.1062 O=C(O)CC1(CO)CCCC1 Amb33457475 [0,0,0,1,0,1|1,0,0]=3 5429 B11R1.1062 O=C([O-])CC1(CO)CCCC1 Amb33457271 [0,0,0,1,0,1|1,0,0]=3 5430 B11R1.1136 CCCCC1(CO)CC1(C)C Amb33428093 [0,0,0,1,0,1|1,0,1]=4 5431 B11R1.50 C=CC1CC(C(C)=O)C(C)O1 Amb24646574 [0,1,0,1,0,0|0,0,2]=4 5432 B11R1.50 C=C[C@H]1C[C@@H](C(C)=O)[C@@H](C)O1 Amb27432654 [0,1,0,1,0,0|0,0,2]=4 5433 B11R1.50 CC(=O)C1CC(CCl)OC1=O Amb17594497 [0,1,0,1,0,0|1,0,1]=4 5434 B11R1.50 CC(=O)C1C[C@@H](CCl)O[C@H]1C Amb27776816 [0,1,0,1,0,0|1,0,0]=3 5435 B11R1.50 CC(=O)[C@@H]1C[C@@H](CO)O[C@H]1C Amb25179733 [0,1,0,1,0,0|1,0,0]=3 5436 B11R1.50 CCC1CC(C(=O)O)C(C)O1 Amb33295520 [0,1,0,1,0,0|1,0,0]=3 5437 B11R1.50 CCC1CC(C(C)=O)C(=O)O1 Amb23455751 [0,1,0,1,0,0|0,0,1]=3 5438 B11R1.50 CCC1CC(C)N(C(C)=O)C1 Amb25876511 [0,1,0,1,0,0|2,0,0]=4 5439 B11R1.50 CC[C@@H]1C[C@@H](C(C)=O)C(=O)O1 Amb24546414 [0,1,0,1,0,0|0,0,1]=3 5440 B11R1.50 CC[C@@H]1C[C@@H](C(C)=O)[C@H](C)O1 Amb28052252 [0,1,0,1,0,0|0,0,0]=2 5441 B11R1.50 CC[C@@H]1C[C@@H](C)N(C(C)=O)C1 Amb25708673 [0,1,0,1,0,0|2,0,0]=4 5442 B11R1.50 CC[C@@H]1C[C@H](C(=O)O)[C@H](N)C1 Amb28246143 [0,1,0,1,0,0|2,0,0]=4 5443 B11R1.50 CC[C@H]1C[C@@H](C(C)=O)C(=O)O1 Amb27974112 [0,1,0,1,0,0|0,0,1]=3 5444 B11R1.50 CC[C@H]1C[C@@H](C)N(C(C)=O)C1 Amb24594985 [0,1,0,1,0,0|2,0,0]=4 5445 B11R1.50 NC(=O)C1CC(CO)CC1O Amb27876227 [0,1,0,1,0,0|2,0,0]=4 5446 B11R1.50 NC(=O)[C@@H]1C[C@H](CO)C[C@@H]1O Amb28318168 [0,1,0,1,0,0|2,0,0]=4 5447 B11R1.143 C=C(C)C1CCCCCC1O Amb25788203 [0,1,0,1,0,0|1,0,0]=3 5448 B11R1.143 C=C(C)[C@@H]1CCCCC[C@H]1O Amb32944787 [0,1,0,1,0,0|1,0,0]=3 5449 B11R1.143 C=C1CCCCCC1C(C)C Amb35681187 [0,1,0,1,0,0|2,0,0]=4 5450 B11R1.143 CC(=O)C1CCCCC=C1C Amb27261169 [0,1,0,1,0,0|1,0,1]=4 5451 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,1,0,1,0,0|0,0,2]=4 5452 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [0,1,0,1,0,0|1,0,0]=3 5453 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [0,1,0,1,0,0|1,0,0]=3 5454 B11R1.143 CC(=O)C1CCCCCC1O Amb32945460 [0,1,0,1,0,0|0,0,0]=2 5455 B11R1.143 CC(=O)C1CCCCCN1C Amb27963187 [0,1,0,1,0,0|2,0,0]=4 5456 B11R1.143 CC(=O)C1CCCCNC1=O Amb28041381 [0,1,0,1,0,0|0,0,2]=4 5457 B11R1.143 CC(=O)C1CCCCOC1=O Amb24635386 [0,1,0,1,0,0|0,0,1]=3 5458 B11R1.143 CC(=O)N1CCOCCC1C Amb28349810 [0,1,0,1,0,0|2,0,0]=4 5459 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [0,1,0,1,0,0|1,0,0]=3 5460 B11R1.143 CC(=O)[C@@H]1CCCCC[C@H]1O Amb32945317 [0,1,0,1,0,0|0,0,0]=2 5461 B11R1.143 CC(C)=C1CCCCCC1O Amb27761629 [0,1,0,1,0,0|1,0,1]=4 5462 B11R1.143 CC(C)C1CCCCCC1=O Amb18181912 [0,1,0,1,0,0|1,0,0]=3 5463 B11R1.143 CC(C)C1CCCCCC1O Amb18797066 [0,1,0,1,0,0|1,0,1]=4 5464 B11R1.143 CC(C)C1CCCCNC1=O Amb27449743 [0,1,0,1,0,0|2,0,0]=4 5465 B11R1.143 CC(C)[C@@H]1CCCCC[C@H]1O Amb24619205 [0,1,0,1,0,0|1,0,1]=4 5466 B11R1.143 CC(N)C1CCCCCC1O Amb35593177 [0,1,0,1,0,0|1,0,1]=4 5467 B11R1.143 CC(O)C1=C(Cl)CCCCC1 Amb27662319 [0,1,0,1,0,0|1,0,1]=4 5468 B11R1.143 CC(O)C1CCCCCC1C Amb35672756 [0,1,0,1,0,0|1,0,1]=4 5469 B11R1.143 CC(O)C1CCCCCC1N Amb35587050 [0,1,0,1,0,0|1,0,1]=4 5470 B11R1.143 CC1CCNCCC1C(=O)O Amb27445777 [0,1,0,1,0,0|2,0,0]=4 5471 B11R1.143 CC1CCOCCC1C(=O)O Amb27861013 [0,1,0,1,0,0|2,0,0]=4 5472 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [0,1,0,1,0,0|2,0,0]=4 5473 B11R1.143 CN(C)C1CCCCCC1=O Amb18179607 [0,1,0,1,0,0|2,0,0]=4 5474 B11R1.143 CN(C)[C@@H]1CCCCC[C@H]1O Amb16230289 [0,1,0,1,0,0|2,0,0]=4 5475 B11R1.143 CN(C)[C@H]1CCCCC[C@@H]1O Amb27427826 [0,1,0,1,0,0|2,0,0]=4 5476 B11R1.143 CN1CCCOCC1C(=O)O Amb27842358 [0,1,0,1,0,0|2,0,0]=4 5477 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [0,1,0,1,0,0|2,0,0]=4 5478 B11R1.143 C[C@H](O)C1=CCCCCC1=O Amb27227235 [0,1,0,1,0,0|0,0,2]=4 5479 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [0,1,0,1,0,0|2,0,0]=4 5480 B11R1.143 NC(=O)C1CCCCCC1N Amb20668797 [0,1,0,1,0,0|2,0,0]=4 5481 B11R1.143 NC(=O)C1CCCCCC1N Amb22059737 [0,1,0,1,0,0|2,0,0]=4 5482 B11R1.143 NC(=O)C1CCCCCC1O Amb25760752 [0,1,0,1,0,0|1,0,0]=3 5483 B11R1.143 NC(=O)C1CCNCCC1F Amb27636642 [0,1,0,1,0,0|2,0,0]=4 5484 B11R1.143 NC(=O)C1CCNCCC1O Amb27843740 [0,1,0,1,0,0|1,0,0]=3 5485 B11R1.143 NC(=O)C1CNCCCC1O Amb27814437 [0,1,0,1,0,0|1,0,0]=3 5486 B11R1.143 NC(=O)[C@@H]1CCCCC[C@H]1O Amb28137536 [0,1,0,1,0,0|1,0,0]=3 5487 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [0,1,0,1,0,0|2,0,0]=4 5488 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [0,1,0,1,0,0|2,0,0]=4 5489 B11R1.143 NC1CCNCCC1C(=O)O Amb26917458 [0,1,0,1,0,0|2,0,0]=4 5490 B11R1.143 NC1CCOCCC1C(=O)O Amb28051653 [0,1,0,1,0,0|2,0,0]=4 5491 B11R1.143 NC1CCSCCC1C(=O)O Amb28051654 [0,1,0,1,0,0|2,0,0]=4 5492 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [0,1,0,1,0,0|2,0,0]=4 5493 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [0,1,0,1,0,0|2,0,0]=4 5494 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [0,1,0,1,0,0|2,0,0]=4 5495 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [0,1,0,1,0,0|2,0,0]=4 5496 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [0,1,0,1,0,0|2,0,0]=4 5497 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [0,1,0,1,0,0|2,0,0]=4 5498 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [0,1,0,1,0,0|1,0,0]=3 5499 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [0,1,0,1,0,0|1,1,0]=4 5500 B11R1.143 O=C(O)C1CCCCNC1=O Amb33803563 [0,1,0,1,0,0|1,0,1]=4 5501 B11R1.143 O=C(O)C1CCOCCC1O Amb27613245 [0,1,0,1,0,0|1,0,0]=3 5502 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [0,1,0,1,0,0|1,0,0]=3 5503 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [0,1,0,1,0,0|1,0,0]=3 5504 B11R1.143 O=C1CCCCCC1[N+](=O)[O-] Amb17673816 [0,1,0,1,0,0|1,0,1]=4 5505 B11R1.143 O=C1CCCCCN1C(O)=S Amb27447243 [0,1,0,1,0,0|1,0,1]=4 5506 B11R1.143 O=[N+]([O-])C1CCCCCC1O Amb18199867 [0,1,0,1,0,0|2,0,0]=4 5507 B11R1.150 CC(C)C(C(=O)O)C1CC1C Amb33145040 [0,1,0,1,0,0|2,0,0]=4 5508 B11R1.166 C=C(C)C1CCC(C)CC1=O Amb17593802 [0,1,0,1,0,0|1,0,1]=4 5509 B11R1.166 C=C(C)C1CCC(C)CC1O Amb538612 [0,1,0,1,0,0|1,0,0]=3 5510 B11R1.166 C=C(C)C1CC[C@@H](C)CC1O Amb27265806 [0,1,0,1,0,0|1,0,0]=3 5511 B11R1.166 C=C(C)C1CC[C@H](C)CC1O Amb27484611 [0,1,0,1,0,0|1,0,0]=3 5512 B11R1.166 C=C(C)[C@@H]1CCC(=O)C[C@H]1O Amb28202205 [0,1,0,1,0,0|1,0,1]=4 5513 B11R1.166 C=C(C)[C@@H]1CCC(C)=C[C@H]1O Amb27448156 [0,1,0,1,0,0|1,0,1]=4 5514 B11R1.166 C=C(C)[C@@H]1CCC(C)CC1O Amb27211288 [0,1,0,1,0,0|1,0,0]=3 5515 B11R1.166 C=C(C)[C@@H]1CC[C@@H](C)C=C1O Amb28061003 [0,1,0,1,0,0|1,0,1]=4 5516 B11R1.166 C=C(C)[C@@H]1CC[C@@H](C)CC1=O Amb26041214 [0,1,0,1,0,0|1,0,1]=4 5517 B11R1.166 C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1O Amb8496743 [0,1,0,1,0,0|1,0,0]=3 5518 B11R1.166 C=C(C)[C@H]1CCC(=O)C[C@@H]1O Amb27428321 [0,1,0,1,0,0|1,0,1]=4 5519 B11R1.166 C=C(C)[C@H]1CCC(C)=C[C@@H]1O Amb28069432 [0,1,0,1,0,0|1,0,1]=4 5520 B11R1.166 C=C(C)[C@H]1CC[C@@H](C)CC1=O Amb28053971 [0,1,0,1,0,0|1,0,1]=4 5521 B11R1.166 C=C(C)[C@H]1CC[C@@H](C)C[C@@H]1O Amb27652982 [0,1,0,1,0,0|1,0,0]=3 5522 B11R1.166 C=C(C)[C@H]1CC[C@@H](C)C[C@H]1O Amb27646613 [0,1,0,1,0,0|1,0,0]=3 5523 B11R1.166 C=C(C)[C@H]1CC[C@H](C)C[C@H]1O Amb27422287 [0,1,0,1,0,0|1,0,0]=3 5524 B11R1.166 C=C(C)[C@H]1CN[C@@H](C)C[C@@H]1O Amb27984654 [0,1,0,1,0,0|2,0,0]=4 5525 B11R1.166 C=C(C)[C@H]1COC(C)C[C@H]1O Amb28350254 [0,1,0,1,0,0|1,0,0]=3 5526 B11R1.166 CC(=O)C1CC=C(C)CC1O Amb27802705 [0,1,0,1,0,0|0,0,2]=4 5527 B11R1.166 CC(=O)C1CCC(C)=CC1C Amb25100211 [0,1,0,1,0,0|1,0,1]=4 5528 B11R1.166 CC(=O)C1CCC(C)CC1C Amb28423633 [0,1,0,1,0,0|1,0,0]=3 5529 B11R1.166 CC(=O)C1CCC(C)OC1=O Amb28351551 [0,1,0,1,0,0|0,0,1]=3 5530 B11R1.166 CC(=O)C1COC(C)CC1O Amb27441260 [0,1,0,1,0,0|0,0,0]=2 5531 B11R1.166 CC(=O)N1CCC(C)CC1C Amb26984981 [0,1,0,1,0,0|2,0,0]=4 5532 B11R1.166 CC(=O)N1CCC(N)CC1C Amb27870916 [0,1,0,1,0,0|2,0,0]=4 5533 B11R1.166 CC(=O)N1CCC(O)CC1C Amb28064953 [0,1,0,1,0,0|2,0,0]=4 5534 B11R1.166 CC(=O)N1CC[C@@H](C)C[C@H]1C Amb24741211 [0,1,0,1,0,0|2,0,0]=4 5535 B11R1.166 CC(=O)[C@@H]1CC=C(C)C[C@H]1C Amb28052227 [0,1,0,1,0,0|1,0,1]=4 5536 B11R1.166 CC(=O)[C@@H]1CC=C(C)C[C@H]1Cl Amb28436857 [0,1,0,1,0,0|1,0,1]=4 5537 B11R1.166 CC(=O)[C@@H]1CCC(=O)C[C@@H]1C Amb24571662 [0,1,0,1,0,0|1,0,1]=4 5538 B11R1.166 CC(=O)[C@@H]1CCC(C)=C[C@@H]1C Amb27632382 [0,1,0,1,0,0|1,0,1]=4 5539 B11R1.166 CC(=O)[C@@H]1CC[C@@H](C)C[C@@H]1O Amb27427669 [0,1,0,1,0,0|0,0,0]=2 5540 B11R1.166 CC(=O)[C@@H]1CC[C@H](O)C[C@H]1C Amb27220610 [0,1,0,1,0,0|1,0,0]=3 5541 B11R1.166 CC(=O)[C@H]1CC=C(C)C[C@@H]1O Amb28285903 [0,1,0,1,0,0|0,0,2]=4 5542 B11R1.166 CC(=O)[C@H]1CCC(=O)C[C@H]1C Amb26032690 [0,1,0,1,0,0|1,0,1]=4 5543 B11R1.166 CC(=O)[C@H]1CCC(C)=C[C@H]1C Amb27768049 [0,1,0,1,0,0|1,0,1]=4 5544 B11R1.166 CC(=O)[C@H]1CC[C@H](C)CC1O Amb27786970 [0,1,0,1,0,0|0,0,0]=2 5545 B11R1.166 CC(C)=C1CCC(C)CC1O Amb9704357 [0,1,0,1,0,0|1,0,1]=4 5546 B11R1.166 CC(C)=C1CC[C@H](C)CC1O Amb27598569 [0,1,0,1,0,0|1,0,1]=4 5547 B11R1.166 CC(C)C1CC[C@@H](C)CC1=O Amb28461172 [0,1,0,1,0,0|1,0,0]=3 5548 B11R1.166 CC(C)C1CC[C@@H](C)CC1O Amb26629252 [0,1,0,1,0,0|1,0,1]=4 5549 B11R1.166 CC(C)C1CC[C@@H](C)C[C@H]1O Amb26640257 [0,1,0,1,0,0|1,0,1]=4 5550 B11R1.166 CC(C)C1CC[C@H](C)CC1=O Amb28285026 [0,1,0,1,0,0|1,0,0]=3 5551 B11R1.166 CC(C)C1CC[C@H](C)C[C@H]1O Amb28319899 [0,1,0,1,0,0|1,0,1]=4 5552 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)CC1=O Amb533136 [0,1,0,1,0,0|1,0,0]=3 5553 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)CC1O Amb27463885 [0,1,0,1,0,0|1,0,1]=4 5554 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1O Amb4605936 [0,1,0,1,0,0|1,0,1]=4 5555 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O Amb532954 [0,1,0,1,0,0|1,0,1]=4 5556 B11R1.166 CC(C)[C@@H]1CC[C@H](C)CC1=O Amb27254302 [0,1,0,1,0,0|1,0,0]=3 5557 B11R1.166 CC(C)[C@@H]1CC[C@H](C)C[C@H]1O Amb18511854 [0,1,0,1,0,0|1,0,1]=4 5558 B11R1.166 CC(C)[C@H]1CC[C@@H](C)CC1=O Amb2404928 [0,1,0,1,0,0|1,0,0]=3 5559 B11R1.166 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1O Amb4605937 [0,1,0,1,0,0|1,0,1]=4 5560 B11R1.166 CC(C)[C@H]1CC[C@@H](C)C[C@H]1O Amb557857 [0,1,0,1,0,0|1,0,1]=4 5561 B11R1.166 CC(C)[C@H]1CC[C@H](C)CC1=O Amb22232056 [0,1,0,1,0,0|1,0,0]=3 5562 B11R1.166 CC(C)[C@H]1CC[C@H](C)CC1O Amb27448744 [0,1,0,1,0,0|1,0,1]=4 5563 B11R1.166 CC(C)[C@H]1CC[C@H](C)C[C@@H]1O Amb6600314 [0,1,0,1,0,0|1,0,1]=4 5564 B11R1.166 CC1=CC(O)C(C(=O)O)CC1 Amb28285405 [0,1,0,1,0,0|1,0,1]=4 5565 B11R1.166 CC1CC(C)C(C(=O)O)CN1 Amb33330510 [0,1,0,1,0,0|2,0,0]=4 5566 B11R1.166 CC1CC(C)C(C(=O)O)CN1 Amb33330511 [0,1,0,1,0,0|2,0,0]=4 5567 B11R1.166 CC1CC(Cl)CCC1C(=O)Cl Amb26507571 [0,1,0,1,0,0|2,0,0]=4 5568 B11R1.166 CC1CC(O)C(C(=O)O)CN1 Amb18830395 [0,1,0,1,0,0|2,0,0]=4 5569 B11R1.166 CC1CCC(C(=O)O)C(=O)N1 Amb24694827 [0,1,0,1,0,0|1,0,1]=4 5570 B11R1.166 CC1CCC(C(=O)O)C(=O)O1 Amb27475565 [0,1,0,1,0,0|1,0,1]=4 5571 B11R1.166 CC1CCC(C(=O)O)C(C)N1 Amb25138873 [0,1,0,1,0,0|2,0,0]=4 5572 B11R1.166 CC1CCC(C(=O)O)C(C)N1 Amb28594206 [0,1,0,1,0,0|2,0,0]=4 5573 B11R1.166 CC1CCC(C(C)C)C(=N)C1 Amb26549131 [0,1,0,1,0,0|2,0,0]=4 5574 B11R1.166 CC1CCC(C(C)C)C(=O)C1 Amb9702855 [0,1,0,1,0,0|1,0,0]=3 5575 B11R1.166 CC1CCC(C(C)C)C(O)C1 Amb2450917 [0,1,0,1,0,0|1,0,1]=4 5576 B11R1.166 CC1CCC(C(C)C)[C@@H](O)C1 Amb27478721 [0,1,0,1,0,0|1,0,1]=4 5577 B11R1.166 CC1CCC(C(C)O)N(C)C1 Amb27766574 [0,1,0,1,0,0|2,0,0]=4 5578 B11R1.166 CC1CCC(C(N)=O)C(C)C1 Amb27876093 [0,1,0,1,0,0|2,0,0]=4 5579 B11R1.166 CC1CCC(C(N)=O)C(C)N1 Amb24470159 [0,1,0,1,0,0|2,0,0]=4 5580 B11R1.166 CC1CCC(C(N)=O)C(C)N1 Amb28921227 [0,1,0,1,0,0|2,0,0]=4 5581 B11R1.166 CC1CC[C@@H](C(C)C)C(=O)C1 Amb28253649 [0,1,0,1,0,0|1,0,0]=3 5582 B11R1.166 CC1CC[C@@H](C(C)C)[C@@H](O)C1 Amb28127470 [0,1,0,1,0,0|1,0,1]=4 5583 B11R1.166 CC1CC[C@@H](C(C)C)[C@H](O)C1 Amb27441092 [0,1,0,1,0,0|1,0,1]=4 5584 B11R1.166 CC1CC[C@H](C(C)C)[C@@H](O)C1 Amb28367400 [0,1,0,1,0,0|1,0,1]=4 5585 B11R1.166 CC1CNC(C(=O)O)C(C)O1 Amb25238030 [0,1,0,1,0,0|2,0,0]=4 5586 B11R1.166 CC1CNC(C(=O)O)C(C)O1 Amb28652973 [0,1,0,1,0,0|2,0,0]=4 5587 B11R1.166 C[C@@H]1CC[C@H](C(=O)O)[C@H](O)C1 Amb27472461 [0,1,0,1,0,0|1,0,0]=3 5588 B11R1.166 C[C@@H]1C[C@@H](Cl)CC[C@@H]1C(=O)Cl Amb27251490 [0,1,0,1,0,0|2,0,0]=4 5589 B11R1.166 C[C@@H]1N[C@H](C)CC[C@@H]1C(=O)O Amb28345999 [0,1,0,1,0,0|2,0,0]=4 5590 B11R1.166 C[C@@H]1O[C@H](C)CC[C@@H]1C(N)=O Amb27478102 [0,1,0,1,0,0|1,0,0]=3 5591 B11R1.166 C[C@@H]1O[C@H](C)CC[C@H]1C(N)=O Amb27848108 [0,1,0,1,0,0|1,0,0]=3 5592 B11R1.166 C[C@H]1CCC(C(=O)O)[C@H](C)O1 Amb27801338 [0,1,0,1,0,0|1,0,0]=3 5593 B11R1.166 C[C@H]1CC[C@@H](C(=O)O)[C@@H](C)N1 Amb27655911 [0,1,0,1,0,0|2,0,0]=4 5594 B11R1.166 C[C@H]1CC[C@H](C(=O)O)[C@H](O)C1 Amb26602933 [0,1,0,1,0,0|1,0,0]=3 5595 B11R1.166 C[C@H]1C[C@@H](Cl)CC[C@@H]1C(=O)Cl Amb28054808 [0,1,0,1,0,0|2,0,0]=4 5596 B11R1.166 NC(=O)[C@@H]1NC[C@@H](O)C[C@@H]1O Amb27878661 [0,1,0,1,0,0|2,0,0]=4 5597 B11R1.166 N[C@@H]1C[C@@H](O)CC[C@@H]1C(=O)O Amb24546400 [0,1,0,1,0,0|2,0,0]=4 5598 B11R1.166 N[C@@H]1C[C@@H](O)CC[C@H]1C(=O)O Amb27630523 [0,1,0,1,0,0|2,0,0]=4 5599 B11R1.166 N[C@H]1C[C@@H](O)CC[C@@H]1C(=O)O Amb27195777 [0,1,0,1,0,0|2,0,0]=4 5600 B11R1.166 N[C@H]1C[C@@H](O)CC[C@H]1C(=O)O Amb28457447 [0,1,0,1,0,0|2,0,0]=4 5601 B11R1.177 C=C(C)C1CCCCC1(C)O Amb32945197 [0,1,0,1,0,0|1,0,0]=3 5602 B11R1.177 C=C(C)[C@@H]1CCCC[C@@]1(C)O Amb33213448 [0,1,0,1,0,0|1,0,0]=3 5603 B11R1.177 CC(=O)C1CCCCC1(C)C Amb25129587 [0,1,0,1,0,0|1,0,0]=3 5604 B11R1.177 CC(=O)C1CCCCC1(C)O Amb27750269 [0,1,0,1,0,0|0,0,0]=2 5605 B11R1.177 CC(=O)C1CNCCC1(C)O Amb27823120 [0,1,0,1,0,0|1,0,0]=3 5606 B11R1.177 CC(=O)C1CNCCC1(F)F Amb33132577 [0,1,0,1,0,0|2,0,0]=4 5607 B11R1.177 CC(=O)N1CCCNC1(C)O Amb25893040 [0,1,0,1,0,0|2,0,0]=4 5608 B11R1.177 CC(=O)[C@@H]1CCCC[C@@]1(C)O Amb33213884 [0,1,0,1,0,0|0,0,0]=2 5609 B11R1.177 CC(=O)[C@@H]1CSCC[C@@]1(C)O Amb28253617 [0,1,0,1,0,0|1,0,0]=3 5610 B11R1.177 CC(C)C1CCCCC1(C)O Amb24538224 [0,1,0,1,0,0|1,0,1]=4 5611 B11R1.177 CC(C)[C@@H]1CCCC[C@@]1(C)O Amb32950901 [0,1,0,1,0,0|1,0,1]=4 5612 B11R1.177 CC(C)[C@@H]1CCCC[C@]1(C)O Amb27848495 [0,1,0,1,0,0|1,0,1]=4 5613 B11R1.177 CC(N)C1CCCCC1(C)O Amb27777412 [0,1,0,1,0,0|1,0,1]=4 5614 B11R1.177 CC(N)[C@@H]1CCCC[C@@]1(C)O Amb35665926 [0,1,0,1,0,0|1,0,1]=4 5615 B11R1.177 CC(O)C1CCCCC1(C)C Amb27974863 [0,1,0,1,0,0|1,0,1]=4 5616 B11R1.177 CC(O)[C@@H]1CCCC[C@@]1(C)O Amb27632875 [0,1,0,1,0,0|0,0,2]=4 5617 B11R1.177 CC1(C)CCCCC1C(=O)Cl Amb26464078 [0,1,0,1,0,0|2,0,0]=4 5618 B11R1.177 CC1(C)CCCCC1C(=O)O Amb28458483 [0,1,0,1,0,0|2,0,0]=4 5619 B11R1.177 CC1(N)CCCCC1C(=O)O Amb25803877 [0,1,0,1,0,0|2,0,0]=4 5620 B11R1.177 CC1(N)CCCCC1C(=O)O Amb28652995 [0,1,0,1,0,0|2,0,0]=4 5621 B11R1.177 CC1(O)CCCCC1C(N)=S Amb35665948 [0,1,0,1,0,0|1,1,0]=4 5622 B11R1.177 CN(C)C1CCCCC1(C)O Amb35667444 [0,1,0,1,0,0|2,0,0]=4 5623 B11R1.177 CN(C)[C@@H]1CCCC[C@@]1(C)O Amb35667617 [0,1,0,1,0,0|2,0,0]=4 5624 B11R1.177 C[C@@H](O)[C@@H]1CCCC[C@@]1(C)O Amb27218640 [0,1,0,1,0,0|0,0,2]=4 5625 B11R1.177 C[C@@H](O)[C@H]1CCCC[C@@]1(C)N Amb28368144 [0,1,0,1,0,0|1,0,1]=4 5626 B11R1.177 C[C@@]1(N)CCCC[C@@H]1C(=O)O Amb1993789 [0,1,0,1,0,0|2,0,0]=4 5627 B11R1.177 C[C@@]1(N)CCCC[C@@H]1C(=O)O Amb1993896 [0,1,0,1,0,0|2,0,0]=4 5628 B11R1.177 C[C@@]1(O)CCCC[C@H]1C(=O)O Amb35664180 [0,1,0,1,0,0|1,0,0]=3 5629 B11R1.177 C[C@@]1(O)CCCC[C@H]1C(N)=S Amb35665947 [0,1,0,1,0,0|1,1,0]=4 5630 B11R1.177 C[C@H](O)[C@@H]1CCCC[C@@]1(C)O Amb27790206 [0,1,0,1,0,0|0,0,2]=4 5631 B11R1.177 C[C@]1(N)CCCC[C@H]1C(=O)O Amb26414538 [0,1,0,1,0,0|2,0,0]=4 5632 B11R1.177 NC(=O)C1CCCCC1(F)F Amb25229929 [0,1,0,1,0,0|2,0,0]=4 5633 B11R1.177 O=C(Cl)C1CCCCC1(F)F Amb28347917 [0,1,0,1,0,0|2,0,0]=4 5634 B11R1.177 O=C(O)C1CCCCC1(F)F Amb23597905 [0,1,0,1,0,0|2,0,0]=4 5635 B11R1.259 CCC1CC1(C(=O)O)C(=O)O Amb22741072 [0,1,0,1,0,0|1,0,1]=4 5636 B11R1.315 CC(=O)C1CCC(C)C1(C)C Amb25718377 [0,1,0,1,0,0|1,0,0]=3 5637 B11R1.315 CC1CCC(C(=O)O)C1(C)O Amb28368998 [0,1,0,1,0,0|1,0,0]=3 5638 B11R1.315 C[C@H]1CC[C@H](C(=O)O)C1(C)C Amb26455590 [0,1,0,1,0,0|2,0,0]=4 5639 B11R1.322 CC(=O)C1CC(CO)C1(C)C Amb28280165 [0,1,0,1,0,0|2,0,0]=4 5640 B11R1.322 CC(=O)[C@@H]1C[C@@H](CO)C1(C)C Amb26644151 [0,1,0,1,0,0|2,0,0]=4 5641 B11R1.322 CC(=O)[C@@H]1C[C@H](CO)C1(C)C Amb24557745 [0,1,0,1,0,0|2,0,0]=4 5642 B11R1.322 CC(=O)[C@H]1C[C@@H](CO)C1(C)C Amb25174916 [0,1,0,1,0,0|2,0,0]=4 5643 B11R1.322 CCC1CC(C(=O)O)C1(C)C Amb27241801 [0,1,0,1,0,0|2,0,0]=4 5644 B11R1.322 CC[C@@H]1C[C@H](C(C)=O)C1(C)C Amb28457426 [0,1,0,1,0,0|1,0,0]=3 5645 B11R1.322 CC[C@H]1C[C@@H](C(C)=O)C1(C)C Amb28052218 [0,1,0,1,0,0|1,0,0]=3 5646 B11R1.465 C#CCCC1C(=O)COC1C Amb29864306 [0,1,0,1,0,0|0,0,2]=4 5647 B11R1.465 C=C1COC(O)C1CCCC Amb27593956 [0,1,0,1,0,0|1,0,0]=3 5648 B11R1.465 C=CCCC1C(=O)COC1C Amb29864310 [0,1,0,1,0,0|0,0,2]=4 5649 B11R1.465 CC#CCC1C(=O)COC1C Amb29864307 [0,1,0,1,0,0|0,0,2]=4 5650 B11R1.465 CC1OCC(=O)C1CCCF Amb29856750 [0,1,0,1,0,0|1,0,0]=3 5651 B11R1.465 CC1OCC(=O)C1CCCO Amb29864317 [0,1,0,1,0,0|1,0,0]=3 5652 B11R1.465 CCCCC1C(=O)COC1C Amb29864314 [0,1,0,1,0,0|0,0,0]=2 5653 B11R1.465 CCCCC1C(Br)COC1C Amb30015721 [0,1,0,1,0,0|1,0,1]=4 5654 B11R1.465 CCCCC1C(Cl)COC1C Amb35689815 [0,1,0,1,0,0|1,0,1]=4 5655 B11R1.465 CCCCC1C(N)COC1C Amb29863469 [0,1,0,1,0,0|1,0,1]=4 5656 B11R1.465 CCCCC1C(O)COC1C Amb35697901 [0,1,0,1,0,0|0,0,2]=4 5657 B11R1.465 CCCCN1C(=O)CCC1C Amb22330634 [0,1,0,1,0,0|2,0,0]=4 5658 B11R1.465 CCCCN1C(=O)CNC1C Amb24446415 [0,1,0,1,0,0|2,0,0]=4 5659 B11R1.465 CCCC[C@@H]1C(=O)OC[C@@H]1O Amb27632041 [0,1,0,1,0,0|0,0,0]=2 5660 B11R1.465 COCCC1C(=O)COC1C Amb29864316 [0,1,0,1,0,0|1,0,0]=3 5661 B11R1.465 CSCCC1C(=O)COC1C Amb29857033 [0,1,0,1,0,0|1,0,0]=3 5662 B11R1.465 C\C=C\CC1C(=O)COC1C Amb29864311 [0,1,0,1,0,0|0,0,2]=4 5663 B11R1.475 CC(O)[C@H]1C(=O)N[C@H]1CCO Amb27793033 [0,1,0,1,0,0|2,0,0]=4 5664 B11R1.475 CCOC1CC(=O)C1C(C)C Amb28144108 [0,1,0,1,0,0|2,0,0]=4 5665 B11R1.475 CCO[C@H]1CC(=O)[C@H]1C(C)C Amb27432588 [0,1,0,1,0,0|2,0,0]=4 5666 B11R1.475 C[C@@H](O)[C@@H]1C(=O)N[C@H]1CCO Amb27423141 [0,1,0,1,0,0|2,0,0]=4 5667 B11R1.599 CCCC1C(C(=O)O)C1(C)C Amb27592096 [0,1,0,1,0,0|2,0,0]=4 5668 B11R1.599 CCC[C@@H]1[C@@H](C(=O)O)C1(C)C Amb33374810 [0,1,0,1,0,0|2,0,0]=4 5669 B11R1.669 CC(=O)C1(C(C)=O)CCC1C Amb25347411 [0,1,0,1,0,0|0,0,2]=4 5670 B11R1.721 CC(C)C(C(=O)O)C1CCC1 Amb23590189 [0,1,0,1,0,0|2,0,0]=4 5671 B11R1.721 CC(C)C(C(O)O)C1CCC1 Amb27193595 [0,1,0,1,0,0|1,0,1]=4 5672 B11R1.721 O=C(O)C(C(=O)O)C1CCC1 Amb23452563 [0,1,0,1,0,0|1,0,1]=4 5673 B11R1.1381 CC(=O)C(CC1CC1)C(C)C Amb27670935 [0,1,0,1,0,0|1,0,0]=3 5674 B11R1.1381 CC(=O)N(CC1CC1)C(C)C Amb27818374 [0,1,0,1,0,0|2,0,0]=4 5675 B11R1.1381 CC(C)C(CC1CC1)C(=O)O Amb27986530 [0,1,0,1,0,0|2,0,0]=4 5676 B11R1.1381 CC(C)C(CC1CC1)C(C)O Amb28080688 [0,1,0,1,0,0|1,0,1]=4 5677 B11R1.1381 O=C(O)C(CC1CC1)C(=O)O Amb25379825 [0,1,0,1,0,0|1,0,1]=4 5678 B11R1.1385 C=C(C)C1(C(=O)O)CCCC1 Amb26372578 [0,1,0,1,0,0|1,0,1]=4 5679 B11R1.1385 CC(=O)C1(C(C)C)CCNC1 Amb24405570 [0,1,0,1,0,0|2,0,0]=4 5680 B11R1.1385 CC(=O)C1(C(N)=O)CCCC1 Amb26929641 [0,1,0,1,0,0|0,0,2]=4 5681 B11R1.1385 CC(C)C1(C(=O)O)CCCC1 Amb27477810 [0,1,0,1,0,0|2,0,0]=4 5682 B11R1.1385 CC(C)C1(C(N)=O)CCCC1 Amb27476044 [0,1,0,1,0,0|2,0,0]=4 5683 B11R1.1385 CC(N)C1(C(=O)O)CCCC1 Amb27839956 [0,1,0,1,0,0|2,0,0]=4 5684 B11R1.1385 NC(=O)C1(C(=O)O)CCCC1 Amb21927516 [0,1,0,1,0,0|1,0,1]=4 5685 B11R1.1385 O=C(O)C1(B(O)O)CCCC1 Amb27407132 [0,1,0,1,0,0|2,0,0]=4 5686 B11R1.1385 O=C(O)C1(C(=O)O)CCCC1 Amb16230758 [0,1,0,1,0,0|1,0,1]=4 5687 B11R1.1385 O=C(O)C1(C(F)F)CCCC1 Amb23541811 [0,1,0,1,0,0|2,0,0]=4 5688 B11R1.21 C=C(C)C1CCC(C)C(=O)C1 Amb3940292 [0,1,0,1,0,0|1,0,1]=4 5689 B11R1.21 C=C(C)C1CC[C@H](C)C(O)C1 Amb27823765 [0,1,0,1,0,0|1,0,0]=3 5690 B11R1.21 C=C(C)C1CC[C@H](C)[C@@H](O)C1 Amb27978419 [0,1,0,1,0,0|1,0,0]=3 5691 B11R1.21 C=C(C)[C@@H]1CC[C@@H](C)C(=O)C1 Amb26925649 [0,1,0,1,0,0|1,0,1]=4 5692 B11R1.21 C=C(C)[C@@H]1CC[C@@H](C)C(O)C1 Amb27255286 [0,1,0,1,0,0|1,0,0]=3 5693 B11R1.21 C=C(C)[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb22352956 [0,1,0,1,0,0|1,0,0]=3 5694 B11R1.21 C=C(C)[C@@H]1CC[C@H](C)[C@@H](O)C1 Amb28076969 [0,1,0,1,0,0|1,0,0]=3 5695 B11R1.21 C=C(C)[C@H]1CCC(C)C(=O)C1 Amb27164605 [0,1,0,1,0,0|1,0,1]=4 5696 B11R1.21 C=C(C)[C@H]1CCC(C)C(O)C1 Amb27853889 [0,1,0,1,0,0|1,0,0]=3 5697 B11R1.21 C=C(C)[C@H]1CC[C@@H](C)[C@H](O)C1 Amb27198128 [0,1,0,1,0,0|1,0,0]=3 5698 B11R1.21 C=C(C)[C@H]1CC[C@H](C)C(=O)C1 Amb6600487 [0,1,0,1,0,0|1,0,1]=4 5699 B11R1.21 C=C(C)[C@H]1CC[C@H](C)[C@@H](O)C1 Amb22232072 [0,1,0,1,0,0|1,0,0]=3 5700 B11R1.21 C=C(C)[C@H]1CC[C@H](C)[C@H](O)C1 Amb24674382 [0,1,0,1,0,0|1,0,0]=3 5701 B11R1.21 C=C1CCC(C(C)=O)CC1O Amb27176394 [0,1,0,1,0,0|0,0,2]=4 5702 B11R1.21 C=C1CC[C@@H](C(C)=O)C[C@@H]1O Amb26875593 [0,1,0,1,0,0|0,0,2]=4 5703 B11R1.21 C=C1CC[C@@H](C(C)=O)C[C@H]1O Amb27768041 [0,1,0,1,0,0|0,0,2]=4 5704 B11R1.21 CC(=O)C1CC=C(C)C(O)C1 Amb27237661 [0,1,0,1,0,0|0,0,2]=4 5705 B11R1.21 CC(=O)C1CCC(C)=C(C)C1 Amb25920982 [0,1,0,1,0,0|1,0,1]=4 5706 B11R1.21 CC(=O)C1CCC(C)C(O)C1 Amb27859372 [0,1,0,1,0,0|0,0,0]=2 5707 B11R1.21 CC(=O)C1CCC(O)C(O)C1 Amb26937963 [0,1,0,1,0,0|1,0,0]=3 5708 B11R1.21 CC(=O)N1CCC(C)C(N)C1 Amb26457222 [0,1,0,1,0,0|2,0,0]=4 5709 B11R1.21 CC(=O)N1CCC(O)C(O)C1 Amb27762971 [0,1,0,1,0,0|2,0,0]=4 5710 B11R1.21 CC(=O)N1CC[C@@H](C)[C@@H](N)C1 Amb35622790 [0,1,0,1,0,0|2,0,0]=4 5711 B11R1.21 CC(=O)[C@@H]1CC[C@@H](C)C(O)C1 Amb28144088 [0,1,0,1,0,0|0,0,0]=2 5712 B11R1.21 CC(=O)[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb28132327 [0,1,0,1,0,0|0,0,0]=2 5713 B11R1.21 CC(=O)[C@@H]1CC[C@H](C)[C@@H](C)C1 Amb27972973 [0,1,0,1,0,0|1,0,0]=3 5714 B11R1.21 CC(=O)[C@H]1CC=C(C)[C@@H](O)C1 Amb27433138 [0,1,0,1,0,0|0,0,2]=4 5715 B11R1.21 CC(=O)[C@H]1CC=C(C)[C@H](O)C1 Amb27212798 [0,1,0,1,0,0|0,0,2]=4 5716 B11R1.21 CC(=O)[C@H]1CC[C@H](C)C(=O)C1 Amb27447292 [0,1,0,1,0,0|0,0,1]=3 5717 B11R1.21 CC(C)=C1CC[C@@H](C)[C@H](O)C1 Amb27978401 [0,1,0,1,0,0|1,0,1]=4 5718 B11R1.21 CC(C)C1CCC(C)C(O)C1 Amb17777978 [0,1,0,1,0,0|1,0,1]=4 5719 B11R1.21 CC(C)[C@@H]1CC[C@@H](C)C(O)C1 Amb27853789 [0,1,0,1,0,0|1,0,1]=4 5720 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@@H](O)C1 Amb27422586 [0,1,0,1,0,0|1,0,1]=4 5721 B11R1.21 CC(C)[C@@H]1CC[C@H](C)[C@H](O)C1 Amb25935256 [0,1,0,1,0,0|1,0,1]=4 5722 B11R1.21 CC(C)[C@H]1CC[C@@H](C)[C@H](O)C1 Amb26562309 [0,1,0,1,0,0|1,0,1]=4 5723 B11R1.21 CC(C)[C@H]1CC[C@H](C)[C@@H](O)C1 Amb26654505 [0,1,0,1,0,0|1,0,1]=4 5724 B11R1.21 CC1CCC(C(=O)Cl)CC1Cl Amb28285389 [0,1,0,1,0,0|2,0,0]=4 5725 B11R1.21 CC1CCC(C(=O)O)CC1C Amb26037213 [0,1,0,1,0,0|2,0,0]=4 5726 B11R1.21 CC1CCC(C(=O)O)CC1N Amb25065260 [0,1,0,1,0,0|2,0,0]=4 5727 B11R1.21 CC1CCC(C(=O)O)NC1C Amb27862874 [0,1,0,1,0,0|2,0,0]=4 5728 B11R1.21 CC1CCC(C(=O)O)NC1C Amb28594270 [0,1,0,1,0,0|2,0,0]=4 5729 B11R1.21 CC1CCC(C(N)=O)CC1C Amb26420059 [0,1,0,1,0,0|2,0,0]=4 5730 B11R1.21 CC1CCC(C(N)=O)CN1C Amb27594294 [0,1,0,1,0,0|2,0,0]=4 5731 B11R1.21 CC1CCC(C(N)=O)NC1C Amb27875309 [0,1,0,1,0,0|2,0,0]=4 5732 B11R1.21 CC1NC(C(=O)O)COC1C Amb28248835 [0,1,0,1,0,0|2,0,0]=4 5733 B11R1.21 CC1NC(C(=O)O)COC1C Amb32663609 [0,1,0,1,0,0|2,0,0]=4 5734 B11R1.21 NC(=O)[C@@H]1CC[C@@H](N)[C@H](O)C1 Amb24631873 [0,1,0,1,0,0|2,0,0]=4 5735 B11R1.21 NC(=O)[C@H]1CC[C@H](N)[C@@H](O)C1 Amb28062962 [0,1,0,1,0,0|2,0,0]=4 5736 B11R1.21 O=C(O)[C@@H]1CC[C@@H](O)[C@H](O)C1 Amb28320743 [0,1,0,1,0,0|2,0,0]=4 5737 B11R1.21 O=C(O)[C@@H]1CC[C@H](O)[C@@H](O)C1 Amb28245268 [0,1,0,1,0,0|2,0,0]=4 5738 B11R1.167 CC(=O)C1CC(=O)CCC1C Amb27199692 [0,1,0,1,0,0|1,0,1]=4 5739 B11R1.167 CC(=O)C1CC(C)CCC1=O Amb18796760 [0,1,0,1,0,0|0,0,2]=4 5740 B11R1.167 CC(=O)C1CC(C)CCC1=S Amb27823420 [0,1,0,1,0,0|0,1,1]=4 5741 B11R1.167 CC(=O)C1CN(C)CCC1C Amb26041036 [0,1,0,1,0,0|2,0,0]=4 5742 B11R1.167 CC(=O)N1CC(Br)CCC1C Amb27655943 [0,1,0,1,0,0|2,0,0]=4 5743 B11R1.167 CC(=O)N1CC(C)CCC1C Amb25857858 [0,1,0,1,0,0|2,0,0]=4 5744 B11R1.167 CC(=O)N1CC(O)CCC1C Amb26955634 [0,1,0,1,0,0|2,0,0]=4 5745 B11R1.167 CC(=O)N1C[C@H](C)CC[C@H]1C Amb24441069 [0,1,0,1,0,0|2,0,0]=4 5746 B11R1.167 CC(=O)N1C[C@H](O)CC[C@@H]1C Amb27651875 [0,1,0,1,0,0|2,0,0]=4 5747 B11R1.167 CC(=O)[C@@H]1CC(=O)CC[C@H]1C Amb27768027 [0,1,0,1,0,0|1,0,1]=4 5748 B11R1.167 CC(C)C1CC(O)CCC1O Amb27757327 [0,1,0,1,0,0|1,0,1]=4 5749 B11R1.167 CC(C)[C@@H]1C[C@@H](C)CC[C@H]1O Amb27451647 [0,1,0,1,0,0|1,0,1]=4 5750 B11R1.167 CC(C)[C@@H]1C[C@H](O)CC[C@@H]1O Amb26589226 [0,1,0,1,0,0|1,0,1]=4 5751 B11R1.167 CC(C)[C@H]1C[C@H](C)CC[C@H]1O Amb27981772 [0,1,0,1,0,0|1,0,1]=4 5752 B11R1.167 CC1CCC(C)C(C(=O)O)C1 Amb27870887 [0,1,0,1,0,0|2,0,0]=4 5753 B11R1.167 CC1CCC(C)C(C(N)=O)C1 Amb26866314 [0,1,0,1,0,0|2,0,0]=4 5754 B11R1.167 CC1CCC(Cl)CC1C(=O)Cl Amb25796255 [0,1,0,1,0,0|2,0,0]=4 5755 B11R1.167 CC1CCC(Cl)CC1C(=O)O Amb25260877 [0,1,0,1,0,0|2,0,0]=4 5756 B11R1.167 CC1CCC(F)CC1C(=O)O Amb28050842 [0,1,0,1,0,0|2,0,0]=4 5757 B11R1.167 CC1CCC(N)C(C(=O)O)C1 Amb18200001 [0,1,0,1,0,0|2,0,0]=4 5758 B11R1.167 CC1CCC(N)C(C(N)=O)C1 Amb27603847 [0,1,0,1,0,0|2,0,0]=4 5759 B11R1.167 CC1CCC(N)CC1C(=O)O Amb26073941 [0,1,0,1,0,0|2,0,0]=4 5760 B11R1.167 CC1CCC(O)C(N(C)C)C1 Amb18183207 [0,1,0,1,0,0|2,0,0]=4 5761 B11R1.167 CC1CCC(O)CC1C(=O)O Amb24392245 [0,1,0,1,0,0|2,0,0]=4 5762 B11R1.167 CC1CC[C@H](O)C[C@H]1C(=O)O Amb28195098 [0,1,0,1,0,0|2,0,0]=4 5763 B11R1.167 CN1CCC(O)C(C(=O)O)C1 Amb18830394 [0,1,0,1,0,0|2,0,0]=4 5764 B11R1.167 CN1CC[C@@H](O)[C@@H](C(=O)O)C1 Amb22757828 [0,1,0,1,0,0|2,0,0]=4 5765 B11R1.167 CN1CC[C@@H](O)[C@H](C(=O)O)C1 Amb15701227 [0,1,0,1,0,0|2,0,0]=4 5766 B11R1.167 CN1CC[C@@H](O)[C@H](C(=O)O)C1 Amb22757827 [0,1,0,1,0,0|2,0,0]=4 5767 B11R1.167 CN1CC[C@H](O)[C@H](C(=O)O)C1 Amb27421984 [0,1,0,1,0,0|2,0,0]=4 5768 B11R1.167 C[C@H]1CC[C@@H](C)[C@@H](C(=O)O)C1 Amb26927968 [0,1,0,1,0,0|2,0,0]=4 5769 B11R1.167 C[C@H]1CC[C@@H](Cl)C[C@@H]1C(=O)Cl Amb27434402 [0,1,0,1,0,0|2,0,0]=4 5770 B11R1.167 C[C@H]1CC[C@H](Cl)C[C@@H]1C(=O)Cl Amb28054821 [0,1,0,1,0,0|2,0,0]=4 5771 B11R1.167 NC1CCC(O)CC1C(=O)O Amb25139597 [0,1,0,1,0,0|2,0,0]=4 5772 B11R1.167 N[C@@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb27231807 [0,1,0,1,0,0|2,0,0]=4 5773 B11R1.167 N[C@@H]1CC[C@H](O)C[C@@H]1C(=O)O Amb27444612 [0,1,0,1,0,0|2,0,0]=4 5774 B11R1.167 N[C@@H]1CC[C@H](O)C[C@H]1C(=O)O Amb27878771 [0,1,0,1,0,0|2,0,0]=4 5775 B11R1.167 N[C@H]1CC[C@@H](O)C[C@H]1C(=O)O Amb28193740 [0,1,0,1,0,0|2,0,0]=4 5776 B11R1.167 O=C(O)C1CC(O)CCC1O Amb25809422 [0,1,0,1,0,0|1,0,0]=3 5777 B11R1.228 C=C(CC)CC1CCCC1=O Amb28123243 [0,1,0,1,0,0|1,0,1]=4 5778 B11R1.228 C=C(CC)CC1COCC1=O Amb35639034 [0,1,0,1,0,0|0,0,1]=3 5779 B11R1.228 CC(CO)CC1CCCC1=O Amb27868157 [0,1,0,1,0,0|2,0,0]=4 5780 B11R1.228 CC(CO)CC1CSCC1=O Amb27389601 [0,1,0,1,0,0|1,1,0]=4 5781 B11R1.228 CCC(C)CC1COCC1=O Amb35639039 [0,1,0,1,0,0|0,0,0]=2 5782 B11R1.228 CCC(C)CC1COCC1Br Amb35736903 [0,1,0,1,0,0|1,0,1]=4 5783 B11R1.228 CCC(C)CC1COCC1Cl Amb35736807 [0,1,0,1,0,0|1,0,1]=4 5784 B11R1.228 CCC(C)CC1COCC1N Amb29877509 [0,1,0,1,0,0|1,0,1]=4 5785 B11R1.228 CCC(C)CC1COCC1O Amb32950412 [0,1,0,1,0,0|0,0,2]=4 5786 B11R1.228 CCC(C)CC1CSCC1=O Amb27666399 [0,1,0,1,0,0|0,1,0]=3 5787 B11R1.228 CCC(C)CN1CNCC1=O Amb28206612 [0,1,0,1,0,0|2,0,0]=4 5788 B11R1.228 CCC(C)C[C@@H]1COC[C@H]1O Amb32945058 [0,1,0,1,0,0|0,0,2]=4 5789 B11R1.228 CCC(C)NC1CONC1=O Amb28128956 [0,1,0,1,0,0|2,0,0]=4 5790 B11R1.228 CCC(O)CC1CCNC1=O Amb24395731 [0,1,0,1,0,0|2,0,0]=4 5791 B11R1.228 COC(C)CC1CCCC1=O Amb28136533 [0,1,0,1,0,0|2,0,0]=4 5792 B11R1.228 O=C1CCCC1CC(O)CO Amb28128306 [0,1,0,1,0,0|2,0,0]=4 5793 B11R1.228 O=C1CNCC1CC(O)CF Amb33495328 [0,1,0,1,0,0|2,0,0]=4 5794 B11R1.266 CC(=O)C1CCCC(CN)C1 Amb33132402 [0,1,0,1,0,0|2,0,0]=4 5795 B11R1.266 CC(=O)C1COCC(CO)O1 Amb25918212 [0,1,0,1,0,0|2,0,0]=4 5796 B11R1.266 CC(=O)N1CCOC(CCl)C1 Amb26371342 [0,1,0,1,0,0|2,0,0]=4 5797 B11R1.266 CC(=O)N1CCOC(CN)C1 Amb17622161 [0,1,0,1,0,0|2,0,0]=4 5798 B11R1.266 CC(=O)N1CCOC(CN)C1 Amb21959606 [0,1,0,1,0,0|2,0,0]=4 5799 B11R1.266 CC(=O)N1CCOC(CN)C1 Amb5741419 [0,1,0,1,0,0|2,0,0]=4 5800 B11R1.266 CC(=O)N1CCOC(CO)C1 Amb27406406 [0,1,0,1,0,0|2,0,0]=4 5801 B11R1.266 CC(=O)N1CCO[C@@H](CN)C1 Amb27404523 [0,1,0,1,0,0|2,0,0]=4 5802 B11R1.266 CCC1C=CCC(C(=O)O)C1 Amb27845448 [0,1,0,1,0,0|2,0,0]=4 5803 B11R1.266 CCC1CC(C(=O)O)CCN1 Amb18199986 [0,1,0,1,0,0|2,0,0]=4 5804 B11R1.266 CCC1CC(C(=O)O)CCO1 Amb25679263 [0,1,0,1,0,0|1,0,0]=3 5805 B11R1.266 CCC1CC(C(C)N)CCO1 Amb25873202 [0,1,0,1,0,0|1,0,1]=4 5806 B11R1.266 CCC1CC(C(C)O)CCO1 Amb28411623 [0,1,0,1,0,0|0,0,2]=4 5807 B11R1.266 CCC1CC(C(N)=O)CCO1 Amb28398882 [0,1,0,1,0,0|1,0,0]=3 5808 B11R1.266 CCC1CC([C@@H](C)N)CCO1 Amb33747721 [0,1,0,1,0,0|1,0,1]=4 5809 B11R1.266 CCC1CC([C@H](C)N)CCO1 Amb33745266 [0,1,0,1,0,0|1,0,1]=4 5810 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb18830613 [0,1,0,1,0,0|2,0,0]=4 5811 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb33338905 [0,1,0,1,0,0|2,0,0]=4 5812 B11R1.266 CCC1CN(C(=O)Cl)CCO1 Amb24671142 [0,1,0,1,0,0|2,0,0]=4 5813 B11R1.266 CCC1CN(C(C)=O)CCO1 Amb27651098 [0,1,0,1,0,0|1,0,0]=3 5814 B11R1.266 CCC1CNCC(C(=O)O)C1 Amb33275578 [0,1,0,1,0,0|2,0,0]=4 5815 B11R1.266 CCN1CC(C(C)=O)CC=N1 Amb28144221 [0,1,0,1,0,0|2,0,0]=4 5816 B11R1.266 CCN1CCOC(C(C)=O)C1 Amb27592628 [0,1,0,1,0,0|2,0,0]=4 5817 B11R1.266 CC[C@@H]1CCN[C@H](C(=O)O)C1 Amb27421998 [0,1,0,1,0,0|2,0,0]=4 5818 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb25937982 [0,1,0,1,0,0|2,0,0]=4 5819 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb33338984 [0,1,0,1,0,0|2,0,0]=4 5820 B11R1.266 CNC1CCCC(C(C)=O)C1 Amb25802837 [0,1,0,1,0,0|2,0,0]=4 5821 B11R1.266 COC1CCCC(C(C)=O)C1 Amb28139124 [0,1,0,1,0,0|2,0,0]=4 5822 B11R1.277 CCN1CC(N)C(C)CC1=O Amb28453693 [0,1,0,1,0,0|2,0,0]=4 5823 B11R1.280 CCC1CCC(=O)C(C=O)C1 Amb18181872 [0,1,0,1,0,0|0,0,2]=4 5824 B11R1.280 CCC1CN(CC)C(=O)CN1 Amb18126020 [0,1,0,1,0,0|2,0,0]=4 5825 B11R1.280 CCC1CNC(=O)C(CC)N1 Amb27617371 [0,1,0,1,0,0|2,0,0]=4 5826 B11R1.280 CCN1CNC(=O)N(CO)C1 Amb27828066 [0,1,0,1,0,0|2,0,0]=4 5827 B11R1.280 COC1CCC(=O)C(CO)O1 Amb28381202 [0,1,0,1,0,0|2,0,0]=4 5828 B11R1.280 O=C1NCC(CO)OC1CO Amb27876293 [0,1,0,1,0,0|2,0,0]=4 5829 B11R1.370 C[C@H]1[C@H](O)C[C@@H](CO)C1(C)C Amb27792972 [0,1,0,1,0,0|1,0,1]=4 5830 B11R1.416 CC(C)[C@@]1(CO)CC[C@@H](C)C1 Amb27853829 [0,1,0,1,0,0|1,0,1]=4 5831 B11R1.416 CC(C)[C@]1(CO)CC[C@@H](C)C1 Amb28455128 [0,1,0,1,0,0|1,0,1]=4 5832 B11R1.416 CC1CCC(CN)(C(=O)O)C1 Amb24687912 [0,1,0,1,0,0|2,0,0]=4 5833 B11R1.416 CC1CCC(CO)(N(C)C)C1 Amb27840241 [0,1,0,1,0,0|2,0,0]=4 5834 B11R1.416 CCC1(C(=O)O)CCC(C)C1 Amb27795614 [0,1,0,1,0,0|2,0,0]=4 5835 B11R1.416 CCC1(C(=O)O)CCC(N)C1 Amb23454123 [0,1,0,1,0,0|2,0,0]=4 5836 B11R1.416 CCC1(C(=O)O)CCC(O)C1 Amb23454240 [0,1,0,1,0,0|2,0,0]=4 5837 B11R1.416 CCC1(C(N)=O)CCC(C)O1 Amb27483011 [0,1,0,1,0,0|2,0,0]=4 5838 B11R1.416 O=C(O)C1(CO)CC(O)CN1 Amb35656412 [0,1,0,1,0,0|2,0,0]=4 5839 B11R1.416 O=C(O)C1(CO)CC(O)CO1 Amb27876459 [0,1,0,1,0,0|2,0,0]=4 5840 B11R1.416 O=C(O)[C@]1(CO)C[C@H](O)CO1 Amb27472047 [0,1,0,1,0,0|2,0,0]=4 5841 B11R1.417 CCC1(C)NC(C(N)=O)CO1 Amb27462635 [0,1,0,1,0,0|2,0,0]=4 5842 B11R1.417 CCC1(O)CCN(C(C)=O)C1 Amb27665070 [0,1,0,1,0,0|2,0,0]=4 5843 B11R1.427 COC(=O)C1CC(=O)C1CO Amb28240362 [0,1,0,1,0,0|1,0,1]=4 5844 B11R1.497 C=C(C)[C@@H]1CCCCC(=O)C1 Amb27823658 [0,1,0,1,0,0|1,0,1]=4 5845 B11R1.497 CC(=O)C1CCCCC(=O)N1 Amb27873410 [0,1,0,1,0,0|0,0,2]=4 5846 B11R1.497 CC(=O)C1CCCCN(C)C1 Amb27638717 [0,1,0,1,0,0|1,0,0]=3 5847 B11R1.497 CC(=O)N1CCCCC(N)C1 Amb27159512 [0,1,0,1,0,0|2,0,0]=4 5848 B11R1.497 CC(=O)N1CCNCC(O)C1 Amb22261486 [0,1,0,1,0,0|2,0,0]=4 5849 B11R1.497 CC(=O)N1CCNCC(O)C1 Amb22587605 [0,1,0,1,0,0|2,0,0]=4 5850 B11R1.497 CC(=O)N1CCOCC(O)C1 Amb27653690 [0,1,0,1,0,0|2,0,0]=4 5851 B11R1.497 CN(C)C1CCCCC(O)C1 Amb26074260 [0,1,0,1,0,0|2,0,0]=4 5852 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb32668486 [0,1,0,1,0,0|2,0,0]=4 5853 B11R1.497 CN1CCCCC(C(=O)O)C1 Amb8010549 [0,1,0,1,0,0|2,0,0]=4 5854 B11R1.497 CN1CCOCC(C(=O)O)C1 Amb27802817 [0,1,0,1,0,0|2,0,0]=4 5855 B11R1.497 O=C1CCCCC(C(=O)O)C1 Amb10603800 [0,1,0,1,0,0|1,0,1]=4 5856 B11R1.497 O=C1CCOCC(C(=O)O)C1 Amb27414004 [0,1,0,1,0,0|1,0,1]=4 5857 B11R1.672 C=C(C)[C@H]1C[C@H](O)[C@@H](C)[C@@H]1C Amb27980560 [0,1,0,1,0,0|2,0,0]=4 5858 B11R1.672 CC(=O)C1OC(O)C(O)C1O Amb27198578 [0,1,0,1,0,0|2,0,0]=4 5859 B11R1.672 CC(=O)[C@@H]1C[C@H](O)[C@@H](C)[C@@H]1C Amb28253721 [0,1,0,1,0,0|1,0,0]=3 5860 B11R1.672 CC(=O)[C@H]1OC(O)[C@@H](O)[C@@H]1O Amb24598967 [0,1,0,1,0,0|2,0,0]=4 5861 B11R1.672 CC1CC(C(=O)O)C(C)C1C Amb27607747 [0,1,0,1,0,0|2,0,0]=4 5862 B11R1.672 CC1C[C@@H](C(=O)O)C(C)C1C Amb27590210 [0,1,0,1,0,0|2,0,0]=4 5863 B11R1.672 NC1C(Br)CC(C(=O)O)C1O Amb28365510 [0,1,0,1,0,0|2,0,0]=4 5864 B11R1.672 N[C@@H]1C[C@H](C(=O)O)[C@@H](O)[C@H]1O Amb27984686 [0,1,0,1,0,0|2,0,0]=4 5865 B11R1.672 N[C@@H]1[C@@H](Br)C[C@H](C(=O)O)[C@H]1O Amb27451655 [0,1,0,1,0,0|2,0,0]=4 5866 B11R1.870 CCC(C)C1CCC1C(=O)O Amb28185049 [0,1,0,1,0,0|2,0,0]=4 5867 B11R1.870 CCC(O)C1CCN1C(C)=O Amb27670230 [0,1,0,1,0,0|2,0,0]=4 5868 B11R1.956 CCN1CC(N)CCCC1=O Amb27427574 [0,1,0,1,0,0|2,0,0]=4 5869 B11R1.1016 CC(C)C(CO)NC1CCC1 Amb27271375 [0,1,0,1,0,0|1,0,1]=4 5870 B11R1.1016 CC(N)C(CO)OC1CCC1 Amb27492164 [0,1,0,1,0,0|1,0,1]=4 5871 B11R1.1016 CCC(CC1CCC1)C(=O)O Amb27986521 [0,1,0,1,0,0|2,0,0]=4 5872 B11R1.1016 CCC(CC1CCC1)C(C)=O Amb27986517 [0,1,0,1,0,0|1,0,0]=3 5873 B11R1.1016 CCC(NC1CCC1)C(N)=O Amb18315484 [0,1,0,1,0,0|2,0,0]=4 5874 B11R1.1016 CCC(OC1CCC1)C(N)=O Amb18177520 [0,1,0,1,0,0|2,0,0]=4 5875 B11R1.1016 NCC(OC1CCC1)C(=O)O Amb28387354 [0,1,0,1,0,0|2,0,0]=4 5876 B11R1.1033 CC1CC1CC(CN)C(=O)O Amb32650410 [0,1,0,1,0,0|2,0,0]=4 5877 B11R1.1033 CCC(NC1CC1C)C(N)=O Amb18787640 [0,1,0,1,0,0|2,0,0]=4 5878 B11R1.1083 CCC1CC(CN)(C(=O)O)C1 Amb28206524 [0,1,0,1,0,0|2,0,0]=4 5879 B11R1.1493 C=C(CC)CC1(C(C)=O)CC1 Amb27492161 [0,1,0,1,0,0|1,0,1]=4 5880 B11R1.1493 CC(=O)C1(CC(C)CO)CC1 Amb27492147 [0,1,0,1,0,0|2,0,0]=4 5881 B11R1.1493 CC(=O)C1(CC(O)CO)CC1 Amb27492158 [0,1,0,1,0,0|2,0,0]=4 5882 B11R1.1493 CCC(C)CC1(C(=O)O)CC1 Amb26076717 [0,1,0,1,0,0|2,0,0]=4 5883 B11R1.1493 CCC(C)CC1(C(C)=O)CC1 Amb27492146 [0,1,0,1,0,0|1,0,0]=3 5884 B11R1.1493 CCC(O)CC1(C(=O)O)CC1 Amb27986523 [0,1,0,1,0,0|2,0,0]=4 5885 B11R1.1493 COC(C)CC1(C(C)=O)CC1 Amb27492153 [0,1,0,1,0,0|2,0,0]=4 5886 B11R1.48 CC(=O)C1C[C@@H](C)[C@H](CO)C1 Amb27432691 [0,1,0,1,0,0|2,0,0]=4 5887 B11R1.48 CC(=O)C1C[C@H](C)[C@@H](CO)C1 Amb27471957 [0,1,0,1,0,0|2,0,0]=4 5888 B11R1.48 CC(=O)N1CC(O)C(CBr)C1 Amb26891573 [0,1,0,1,0,0|2,0,0]=4 5889 B11R1.48 CC(=O)N1CC(O)C(CCl)C1 Amb26574484 [0,1,0,1,0,0|2,0,0]=4 5890 B11R1.48 CC(=O)N1CC(O)C(CI)C1 Amb26560539 [0,1,0,1,0,0|2,0,0]=4 5891 B11R1.48 CC(=O)N1CC(O)C(CN)C1 Amb27791093 [0,1,0,1,0,0|2,0,0]=4 5892 B11R1.48 CC(=O)N1CC(O)C(CO)C1 Amb25202241 [0,1,0,1,0,0|2,0,0]=4 5893 B11R1.48 CC(=O)N1CC(O)C(CS)C1 Amb25202200 [0,1,0,1,0,0|2,0,0]=4 5894 B11R1.48 CC(C)C1CC(CO)C(=O)N1 Amb27666041 [0,1,0,1,0,0|1,0,0]=3 5895 B11R1.48 CCC1CC(C(C)=O)OC1=O Amb28121700 [0,1,0,1,0,0|0,0,2]=4 5896 B11R1.48 CCC1CC(C(C)C)OC1=O Amb28120954 [0,1,0,1,0,0|2,0,0]=4 5897 B11R1.48 CCC1CC(C(C)O)OC1=O Amb4043950 [0,1,0,1,0,0|2,0,0]=4 5898 B11R1.48 CCC1CN(C(C)=O)CC1O Amb27176925 [0,1,0,1,0,0|1,0,0]=3 5899 B11R1.48 CCC1CN(S(C)=O)CC1O Amb27795803 [0,1,0,1,0,0|2,0,0]=4 5900 B11R1.48 CCC1OC(C(C)O)CC1=O Amb28126653 [0,1,0,1,0,0|2,0,0]=4 5901 B11R1.48 CO[C@@H]1CN(C(C)=O)C[C@H]1O Amb27637782 [0,1,0,1,0,0|2,0,0]=4 5902 B11R1.48 NC(=O)C1CC(O)C(CO)C1 Amb28325884 [0,1,0,1,0,0|2,0,0]=4 5903 B11R1.48 NC(=O)[C@@H]1C[C@H](O)[C@H](CO)C1 Amb27660977 [0,1,0,1,0,0|2,0,0]=4 5904 B11R1.48 NC[C@H]1CC(C(=O)O)C[C@H]1O Amb27879994 [0,1,0,1,0,0|2,0,0]=4 5905 B11R1.62 CCC1C(=O)NC1CC(C)O Amb27810889 [0,1,0,1,0,0|2,0,0]=4 5906 B11R1.62 CC[C@@H]1C(=O)N[C@H]1C[C@H](C)O Amb27969235 [0,1,0,1,0,0|2,0,0]=4 5907 B11R1.71 CC(C)C[C@@H]1[C@@H](CO)C1(C)C Amb27629401 [0,1,0,1,0,0|1,0,1]=4 5908 B11R1.90 C=C(C)CCC1CCCC1=O Amb28351409 [0,1,0,1,0,0|1,0,1]=4 5909 B11R1.90 C=C(C)CCC1COCC1=O Amb35639035 [0,1,0,1,0,0|0,0,1]=3 5910 B11R1.90 CC(C)CCC1CCCC1=O Amb18177373 [0,1,0,1,0,0|1,0,0]=3 5911 B11R1.90 CC(C)CCC1COCC1=O Amb35639036 [0,1,0,1,0,0|0,0,0]=2 5912 B11R1.90 CC(C)CCC1COCC1Br Amb35736904 [0,1,0,1,0,0|1,0,1]=4 5913 B11R1.90 CC(C)CCC1COCC1Cl Amb35736808 [0,1,0,1,0,0|1,0,1]=4 5914 B11R1.90 CC(C)CCC1COCC1N Amb29877510 [0,1,0,1,0,0|1,0,1]=4 5915 B11R1.90 CC(C)CCC1COCC1O Amb33213239 [0,1,0,1,0,0|0,0,2]=4 5916 B11R1.90 CC(C)CCC1NCCC1=O Amb27462561 [0,1,0,1,0,0|2,0,0]=4 5917 B11R1.90 CC(C)CCN1CNCC1=O Amb27412812 [0,1,0,1,0,0|2,0,0]=4 5918 B11R1.90 CC(C)CC[C@@H]1COC[C@H]1O Amb32944334 [0,1,0,1,0,0|0,0,2]=4 5919 B11R1.90 CC(C)CNC1CONC1=O Amb28128957 [0,1,0,1,0,0|2,0,0]=4 5920 B11R1.90 CC(C)OCC1COCC1=O Amb35639040 [0,1,0,1,0,0|1,0,0]=3 5921 B11R1.90 CC(N)CCN1CCCC1=O Amb19373669 [0,1,0,1,0,0|2,0,0]=4 5922 B11R1.90 CC(O)CCC1CCCC1=O Amb28410791 [0,1,0,1,0,0|1,0,0]=3 5923 B11R1.90 CC(O)CCC1CCNC1=O Amb27241365 [0,1,0,1,0,0|2,0,0]=4 5924 B11R1.90 CC(O)CCN1CCCC1=O Amb18183160 [0,1,0,1,0,0|2,0,0]=4 5925 B11R1.90 CS(=O)CCC1CSCC1=O Amb27874515 [0,1,0,1,0,0|1,1,0]=4 5926 B11R1.175 C=C(C)C1CCC(C(C)=O)C1 Amb28201073 [0,1,0,1,0,0|1,0,1]=4 5927 B11R1.175 C=C(C)C1CCC(C(C)O)C1 Amb28077747 [0,1,0,1,0,0|2,0,0]=4 5928 B11R1.175 CC(=O)C1C=CC(C(C)O)C1 Amb24671309 [0,1,0,1,0,0|1,0,1]=4 5929 B11R1.175 CC(=O)C1CN=C(C(C)C)C1 Amb24475976 [0,1,0,1,0,0|1,0,1]=4 5930 B11R1.175 CC(=O)C1COC(C(C)C)C1 Amb35584971 [0,1,0,1,0,0|0,0,0]=2 5931 B11R1.175 CC(=O)N1CCC(C(C)N)C1 Amb27174333 [0,1,0,1,0,0|2,0,0]=4 5932 B11R1.175 CC(=O)[C@@H]1CC[C@H]([C@H](C)O)O1 Amb27427861 [0,1,0,1,0,0|2,0,0]=4 5933 B11R1.175 CC(=O)[C@@H]1C[C@@H](C(=O)O)CO1 Amb27424004 [0,1,0,1,0,0|1,0,1]=4 5934 B11R1.175 CC(=O)[C@H]1C[C@@H](C(=O)O)CO1 Amb27221215 [0,1,0,1,0,0|1,0,1]=4 5935 B11R1.175 CC(C)C1CC(C(=O)O)CO1 Amb35584735 [0,1,0,1,0,0|1,0,0]=3 5936 B11R1.175 CC(C)C1CC(C(C)Br)CO1 Amb35584864 [0,1,0,1,0,0|1,0,1]=4 5937 B11R1.175 CC(C)C1CC(C(C)Cl)CO1 Amb35584863 [0,1,0,1,0,0|1,0,1]=4 5938 B11R1.175 CC(C)C1CC(C(C)N)CO1 Amb35604291 [0,1,0,1,0,0|1,0,1]=4 5939 B11R1.175 CC(C)C1CC(C(C)O)CO1 Amb35604284 [0,1,0,1,0,0|0,0,2]=4 5940 B11R1.175 CC(C)C1CC(C(N)=O)CN1 Amb27967661 [0,1,0,1,0,0|2,0,0]=4 5941 B11R1.175 CC(C)C1CC(N(C)N)CO1 Amb35604009 [0,1,0,1,0,0|2,0,0]=4 5942 B11R1.175 CC(C)C1CCC(C(=O)O)C1 Amb27791822 [0,1,0,1,0,0|2,0,0]=4 5943 B11R1.175 CC(O)C1CC(N(C)C)CO1 Amb28043692 [0,1,0,1,0,0|2,0,0]=4 5944 B11R1.355 CN1CC(C(CO)C(=O)O)C1 Amb27670020 [0,1,0,1,0,0|2,0,0]=4 5945 B11R1.390 C=C1CC(C)(C)CC[C@H]1CO Amb27878432 [0,1,0,1,0,0|1,0,0]=3 5946 B11R1.390 CC1(C)CCC(CO)C(=O)O1 Amb28455582 [0,1,0,1,0,0|1,0,0]=3 5947 B11R1.390 CC1=C(CO)CCC(C)(C)C1 Amb27665208 [0,1,0,1,0,0|1,0,1]=4 5948 B11R1.390 CC1=C(CO)CCC(C)(O)C1 Amb28460716 [0,1,0,1,0,0|1,0,1]=4 5949 B11R1.390 CCC1CCC(C)(O)CC1=O Amb27432696 [0,1,0,1,0,0|1,0,0]=3 5950 B11R1.391 CCN1CCC(C)NCC1=O Amb25801107 [0,1,0,1,0,0|2,0,0]=4 5951 B11R1.418 CC(C)C1CC1(CN)C(=O)O Amb25893290 [0,1,0,1,0,0|2,0,0]=4 5952 B11R1.515 C=C(C)C1CCC(C)(C)C1O Amb27164155 [0,1,0,1,0,0|1,0,0]=3 5953 B11R1.515 C=C(C)C1CCC(C)(O)C1C Amb24523114 [0,1,0,1,0,0|2,0,0]=4 5954 B11R1.515 C=C(C)[C@@H]1CCC(C)(C)[C@H]1O Amb27981967 [0,1,0,1,0,0|1,0,0]=3 5955 B11R1.515 CC(=O)C1CCC(C)(C)C1=O Amb26404359 [0,1,0,1,0,0|0,0,2]=4 5956 B11R1.515 CC(=O)C1CCC(C)(C)C1C Amb27188833 [0,1,0,1,0,0|1,0,0]=3 5957 B11R1.515 CC1C(C(=O)O)CCC1(C)N Amb27871509 [0,1,0,1,0,0|2,0,0]=4 5958 B11R1.515 CC1C(C(N)=O)CCC1(C)C Amb28119870 [0,1,0,1,0,0|2,0,0]=4 5959 B11R1.515 C[C@H]1[C@H](C(=O)O)CC[C@]1(C)N Amb28052115 [0,1,0,1,0,0|2,0,0]=4 5960 B11R1.518 CC(C)CC1C(C)C1C(=O)O Amb27393056 [0,1,0,1,0,0|2,0,0]=4 5961 B11R1.518 CC(C)C[C@H]1[C@@H](C)[C@H]1C(=O)O Amb28060580 [0,1,0,1,0,0|2,0,0]=4 5962 B11R1.565 C=C(C)C1CCNC(C)CC1 Amb27176544 [0,1,0,1,0,0|2,0,0]=4 5963 B11R1.565 CC(=O)C1CCCC(C)CC1 Amb27459498 [0,1,0,1,0,0|1,0,0]=3 5964 B11R1.565 CC(=O)N1CCCC(C)CC1 Amb28320152 [0,1,0,1,0,0|2,0,0]=4 5965 B11R1.565 CC(=O)N1CCCC(O)CC1 Amb13783682 [0,1,0,1,0,0|2,0,0]=4 5966 B11R1.565 CC(=O)N1CCSC(C)CC1 Amb27834829 [0,1,0,1,0,0|1,1,0]=4 5967 B11R1.565 CC(=O)[C@H]1CCC[C@H](C)CC1 Amb28054029 [0,1,0,1,0,0|1,0,0]=3 5968 B11R1.565 CC1CCCC(C(=O)O)CC1 Amb24487583 [0,1,0,1,0,0|2,0,0]=4 5969 B11R1.565 CC1CCN(C(=O)Cl)CCO1 Amb32864057 [0,1,0,1,0,0|2,0,0]=4 5970 B11R1.565 CC1CCNC(C(=O)O)CC1 Amb27441897 [0,1,0,1,0,0|2,0,0]=4 5971 B11R1.565 CC1CCNC(C(N)=O)CC1 Amb27962650 [0,1,0,1,0,0|2,0,0]=4 5972 B11R1.565 CC1CNCC(C(C)C)CO1 Amb28244881 [0,1,0,1,0,0|1,0,1]=4 5973 B11R1.565 CN1CCCC(C(=O)O)CC1 Amb18199975 [0,1,0,1,0,0|2,0,0]=4 5974 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743493 [0,1,0,1,0,0|2,0,0]=4 5975 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743673 [0,1,0,1,0,0|2,0,0]=4 5976 B11R1.708 CC(C)CC1CCC1C(=O)O Amb27451597 [0,1,0,1,0,0|2,0,0]=4 5977 B11R1.727 C=C(C)C1CCC(C)(O)CC1 Amb17593867 [0,1,0,1,0,0|2,0,0]=4 5978 B11R1.727 CC(=O)C1=NOC(C)(C)CC1 Amb24570734 [0,1,0,1,0,0|1,0,1]=4 5979 B11R1.727 CC(=O)C1CCC(C)(C)CC1 Amb27395468 [0,1,0,1,0,0|1,0,0]=3 5980 B11R1.727 CC(=O)C1CCC(F)(F)CC1 Amb23412174 [0,1,0,1,0,0|2,0,0]=4 5981 B11R1.727 CC(=O)C1CCC(N)(O)CC1 Amb16233808 [0,1,0,1,0,0|2,0,0]=4 5982 B11R1.727 CC(=O)C1COC(C)(C)OC1 Amb24449985 [0,1,0,1,0,0|1,0,0]=3 5983 B11R1.727 CC(=O)N1CCC(C)(N)CC1 Amb26010476 [0,1,0,1,0,0|2,0,0]=4 5984 B11R1.727 CC(=O)N1CCC(C)(N)CC1 Amb32413049 [0,1,0,1,0,0|2,0,0]=4 5985 B11R1.727 CC(=O)N1CCC(C)(O)CC1 Amb27228763 [0,1,0,1,0,0|2,0,0]=4 5986 B11R1.727 CC(=O)[C@H]1C=C[C@@](C)(O)CC1 Amb27252280 [0,1,0,1,0,0|1,0,1]=4 5987 B11R1.727 CC(=O)[C@H]1C=C[C@](C)(O)CC1 Amb27880670 [0,1,0,1,0,0|1,0,1]=4 5988 B11R1.727 CC(=O)[C@H]1CC[C@](C)(O)CC1 Amb27750068 [0,1,0,1,0,0|1,0,0]=3 5989 B11R1.727 CC1(C)CCC(C(=O)O)CC1 Amb33546102 [0,1,0,1,0,0|2,0,0]=4 5990 B11R1.727 CC1(C)CCC(C(=O)O)CO1 Amb24312659 [0,1,0,1,0,0|1,0,0]=3 5991 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb10608911 [0,1,0,1,0,0|2,0,0]=4 5992 B11R1.727 CC1(C)CNC(C(=O)O)CO1 Amb19889803 [0,1,0,1,0,0|2,0,0]=4 5993 B11R1.727 CC1(C)CNC(C(N)=O)CO1 Amb27238571 [0,1,0,1,0,0|2,0,0]=4 5994 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb25207391 [0,1,0,1,0,0|2,0,0]=4 5995 B11R1.727 CC1(C)CN[C@@H](C(=O)O)CO1 Amb31291605 [0,1,0,1,0,0|2,0,0]=4 5996 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb19889802 [0,1,0,1,0,0|2,0,0]=4 5997 B11R1.727 CC1(C)CN[C@H](C(=O)O)CO1 Amb25111013 [0,1,0,1,0,0|2,0,0]=4 5998 B11R1.727 CC1(C)CN[C@H](C(N)=O)CO1 Amb27267831 [0,1,0,1,0,0|2,0,0]=4 5999 B11R1.727 CC1(C)COC(C(=O)O)CO1 Amb24558775 [0,1,0,1,0,0|2,0,0]=4 6000 B11R1.727 CC1(C)OCC(C(=O)O)CO1 Amb21858943 [0,1,0,1,0,0|2,0,0]=4 6001 B11R1.727 CC1(C)OCC(C(=O)[O-])CO1 Amb24179218 [0,1,0,1,0,0|2,0,0]=4 6002 B11R1.727 CC1(Cl)CCC(C(=O)Cl)CC1 Amb26038517 [0,1,0,1,0,0|2,0,0]=4 6003 B11R1.727 CC1(F)CCC(C(=O)O)CC1 Amb27659312 [0,1,0,1,0,0|2,0,0]=4 6004 B11R1.727 CC1(N)CCC(C(=O)O)CC1 Amb9782657 [0,1,0,1,0,0|2,0,0]=4 6005 B11R1.727 CC1(O)CCC(C(=O)O)CC1 Amb27803990 [0,1,0,1,0,0|2,0,0]=4 6006 B11R1.727 CS(=O)C1CCC(C)(C)CC1 Amb28131814 [0,1,0,1,0,0|2,0,0]=4 6007 B11R1.727 C[C@]1(O)CC[C@H](C(=O)O)CC1 Amb27478059 [0,1,0,1,0,0|2,0,0]=4 6008 B11R1.1391 C=C(C)CCC1(C(C)=O)CC1 Amb27492152 [0,1,0,1,0,0|1,0,1]=4 6009 B11R1.1391 CC(=O)C1(CCC(C)C)CC1 Amb27492148 [0,1,0,1,0,0|1,0,0]=3 6010 B11R1.1391 CC(=O)C1(CCC(C)O)CC1 Amb27492154 [0,1,0,1,0,0|1,0,0]=3 6011 B11R1.1391 CC(=O)C1(CCN(C)C)CC1 Amb33271946 [0,1,0,1,0,0|2,0,0]=4 6012 B11R1.1391 CC(=O)C1(COC(C)C)CC1 Amb33274089 [0,1,0,1,0,0|2,0,0]=4 6013 B11R1.1391 CC(=O)OCC1(C(C)=O)CO1 Amb24766976 [0,1,0,1,0,0|1,0,1]=4 6014 B11R1.1391 CC(C)CCC1(C(=O)O)CC1 Amb27269326 [0,1,0,1,0,0|2,0,0]=4 6015 B11R1.1391 CC(O)CCC1(C(=O)O)CC1 Amb28387126 [0,1,0,1,0,0|2,0,0]=4 6016 B11R1.17 CCCCC1CCCCC1=O Amb3940594 [0,1,0,1,0,0|1,0,0]=3 6017 B11R1.17 CCCCC1COCCC1Br Amb27235549 [0,1,0,1,0,0|1,0,1]=4 6018 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [0,1,0,1,0,0|2,0,0]=4 6019 B11R1.17 CCCCN1CCNCC1=O Amb10607569 [0,1,0,1,0,0|2,0,0]=4 6020 B11R1.17 CCOCC1CCCCC1=O Amb27399156 [0,1,0,1,0,0|2,0,0]=4 6021 B11R1.17 CNCCN1CCOCC1=O Amb18255030 [0,1,0,1,0,0|2,0,0]=4 6022 B11R1.17 COCCC1CCCNC1=O Amb28313285 [0,1,0,1,0,0|2,0,0]=4 6023 B11R1.17 COCCC1COCCC1=O Amb27628599 [0,1,0,1,0,0|1,0,0]=3 6024 B11R1.17 COCC[C@H]1CCCCC1=O Amb27974073 [0,1,0,1,0,0|2,0,0]=4 6025 B11R1.17 COCOC1COCCC1=O Amb32674192 [0,1,0,1,0,0|2,0,0]=4 6026 B11R1.17 CSCCC1CCCNC1=O Amb27949745 [0,1,0,1,0,0|2,0,0]=4 6027 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [0,1,0,1,0,0|2,0,0]=4 6028 B11R1.17 NCCCC1CCCNC1=O Amb27863499 [0,1,0,1,0,0|2,0,0]=4 6029 B11R1.17 NCCCN1CCOCC1=O Amb18917091 [0,1,0,1,0,0|2,0,0]=4 6030 B11R1.17 NCCSC1COCCC1=O Amb27781923 [0,1,0,1,0,0|2,0,0]=4 6031 B11R1.17 O=C1CCCCC1CCCO Amb27481191 [0,1,0,1,0,0|2,0,0]=4 6032 B11R1.17 O=C1CCOCC1CCCF Amb27640843 [0,1,0,1,0,0|1,0,0]=3 6033 B11R1.17 O=C1CCOCC1CCCO Amb28284744 [0,1,0,1,0,0|1,0,0]=3 6034 B11R1.17 O=C1COCCN1CCCBr Amb26050407 [0,1,0,1,0,0|2,0,0]=4 6035 B11R1.17 O=C1COCCN1CCCO Amb26485003 [0,1,0,1,0,0|2,0,0]=4 6036 B11R1.17 O=C1NCCCC1CCCO Amb25978142 [0,1,0,1,0,0|2,0,0]=4 6037 B11R1.17 O=C1OCCCC1CCCI Amb27261546 [0,1,0,1,0,0|2,0,0]=4 6038 B11R1.18 CCCCC1CCC\C1=N/N Amb27457271 [0,1,0,1,0,0|2,0,0]=4 6039 B11R1.22 C#CC(=O)C1CCC(C)NC1 Amb24681263 [0,1,0,1,0,0|1,0,1]=4 6040 B11R1.22 C=C(C=O)C1CCC(C)CC1 Amb28246511 [0,1,0,1,0,0|1,0,1]=4 6041 B11R1.22 C=C(CBr)C1CCC(C)CC1 Amb33435203 [0,1,0,1,0,0|2,0,0]=4 6042 B11R1.22 C=C(CCl)C1CCC(C)CC1 Amb33057931 [0,1,0,1,0,0|2,0,0]=4 6043 B11R1.22 C=C(CN)C1CCC(C)CC1 Amb32732075 [0,1,0,1,0,0|2,0,0]=4 6044 B11R1.22 C=C(CO)C1CCC(C)CC1 Amb25084327 [0,1,0,1,0,0|2,0,0]=4 6045 B11R1.22 C=C(CO)[C@H]1CC[C@H](C)CC1 Amb27427078 [0,1,0,1,0,0|2,0,0]=4 6046 B11R1.22 C=CC(=O)C1CCC(C)CC1 Amb25111865 [0,1,0,1,0,0|1,0,1]=4 6047 B11R1.22 C=CC(=O)C1CCC(C)NC1 Amb24680349 [0,1,0,1,0,0|1,0,1]=4 6048 B11R1.22 CC1=CCC(C(=O)CCl)CC1 Amb27165699 [0,1,0,1,0,0|1,0,1]=4 6049 B11R1.22 CC1CCC(C(=O)CBr)CC1 Amb27239800 [0,1,0,1,0,0|1,0,0]=3 6050 B11R1.22 CC1CCC(C(=O)CCl)CC1 Amb24533071 [0,1,0,1,0,0|1,0,0]=3 6051 B11R1.22 CC1CCC(C(=O)CN)CC1 Amb26336732 [0,1,0,1,0,0|1,0,0]=3 6052 B11R1.22 CC1CCC(C(=O)NN)CC1 Amb27399941 [0,1,0,1,0,0|2,0,0]=4 6053 B11R1.22 CC1CCC(C(=O)NN)CN1 Amb27236093 [0,1,0,1,0,0|2,0,0]=4 6054 B11R1.22 CC1CCC(C(C)C=O)CC1 Amb24364147 [0,1,0,1,0,0|1,0,1]=4 6055 B11R1.22 CC1CCC(N(C)C#N)CO1 Amb35695335 [0,1,0,1,0,0|2,0,0]=4 6056 B11R1.22 CC1CCC(N(C)C=O)CO1 Amb35698783 [0,1,0,1,0,0|1,0,0]=3 6057 B11R1.22 CC1CCC(N(C)C=O)CS1 Amb29872391 [0,1,0,1,0,0|1,1,0]=4 6058 B11R1.22 CC1CCN(C(=O)CBr)CC1 Amb17331371 [0,1,0,1,0,0|2,0,0]=4 6059 B11R1.22 CC1CCN(C(=O)CCl)CC1 Amb1640356 [0,1,0,1,0,0|2,0,0]=4 6060 B11R1.22 CC1CCN(C(=O)CF)CC1 Amb27768006 [0,1,0,1,0,0|2,0,0]=4 6061 B11R1.22 CC1CCN(C(=O)CN)CC1 Amb5783033 [0,1,0,1,0,0|2,0,0]=4 6062 B11R1.22 CC1CCN(C(=O)CO)CC1 Amb1110385 [0,1,0,1,0,0|2,0,0]=4 6063 B11R1.22 CC1CCN(C(=O)CS)CC1 Amb22270058 [0,1,0,1,0,0|2,0,0]=4 6064 B11R1.22 CCC(=O)C1CCC(C)NC1 Amb27220819 [0,1,0,1,0,0|1,0,0]=3 6065 B11R1.22 CCC(=O)C1CCC(C)OC1 Amb35732772 [0,1,0,1,0,0|0,0,0]=2 6066 B11R1.22 CCC(=O)C1CCC(N)CC1 Amb24334849 [0,1,0,1,0,0|2,0,0]=4 6067 B11R1.22 CCC(=O)C1CCC(O)CC1 Amb28199939 [0,1,0,1,0,0|2,0,0]=4 6068 B11R1.22 CCC(=O)[C@H]1CC[C@@H](N)CC1 Amb33132954 [0,1,0,1,0,0|2,0,0]=4 6069 B11R1.22 CCC(=O)[C@H]1CC[C@@H](O)CC1 Amb28201182 [0,1,0,1,0,0|2,0,0]=4 6070 B11R1.22 CCC(=O)[C@H]1CC[C@H](N)CC1 Amb33307615 [0,1,0,1,0,0|2,0,0]=4 6071 B11R1.22 CCC(=O)[C@H]1CC[C@H](O)CC1 Amb27599418 [0,1,0,1,0,0|2,0,0]=4 6072 B11R1.22 CCC(Br)C1CCC(C)OC1 Amb35679312 [0,1,0,1,0,0|1,0,1]=4 6073 B11R1.22 CCC(Cl)C1CCC(C)OC1 Amb35679310 [0,1,0,1,0,0|1,0,1]=4 6074 B11R1.22 CCC(N)C1CCC(C)OC1 Amb35686967 [0,1,0,1,0,0|1,0,1]=4 6075 B11R1.22 CCC(O)C1CCC(C)OC1 Amb35678927 [0,1,0,1,0,0|0,0,2]=4 6076 B11R1.22 CN1CCC(C(=O)CBr)CC1 Amb26032843 [0,1,0,1,0,0|2,0,0]=4 6077 B11R1.22 CN1CCC(C(=O)CCl)CC1 Amb33223630 [0,1,0,1,0,0|2,0,0]=4 6078 B11R1.22 CN1CCC(C(=O)CN)CC1 Amb33271010 [0,1,0,1,0,0|2,0,0]=4 6079 B11R1.22 CN1CCC(C(=O)CN)CC1 Amb35789648 [0,1,0,1,0,0|2,0,0]=4 6080 B11R1.22 CNC(=O)C1CCC(C)CN1 Amb33495760 [0,1,0,1,0,0|2,0,0]=4 6081 B11R1.22 CNC(=O)C1CCC(N)CC1 Amb13951340 [0,1,0,1,0,0|2,0,0]=4 6082 B11R1.22 CNC(=O)C1CCC(N)CC1 Amb6252712 [0,1,0,1,0,0|2,0,0]=4 6083 B11R1.22 CNC(=O)C1CCC(O)CC1 Amb25142086 [0,1,0,1,0,0|2,0,0]=4 6084 B11R1.22 CNC(=O)[C@H]1CC[C@@H](N)CC1 Amb24074392 [0,1,0,1,0,0|2,0,0]=4 6085 B11R1.22 CNC(=O)[C@H]1CC[C@@H](N)CC1 Amb32410613 [0,1,0,1,0,0|2,0,0]=4 6086 B11R1.22 CNC(=O)[C@H]1CC[C@@H](O)CC1 Amb27759268 [0,1,0,1,0,0|2,0,0]=4 6087 B11R1.22 CNC(=O)[C@H]1CC[C@H](N)CC1 Amb25076964 [0,1,0,1,0,0|2,0,0]=4 6088 B11R1.22 CNC(C)C1CCC(C)OC1 Amb35686969 [0,1,0,1,0,0|1,0,1]=4 6089 B11R1.22 COC(=O)C1CC=C(C)CC1 Amb22493627 [0,1,0,1,0,0|1,0,1]=4 6090 B11R1.22 COC(=O)C1CCC(Br)CC1 Amb25377448 [0,1,0,1,0,0|2,0,0]=4 6091 B11R1.22 COC(=O)C1CCC(C)CC1 Amb24738407 [0,1,0,1,0,0|1,0,0]=3 6092 B11R1.22 COC(=O)C1CCC(C)CN1 Amb33189228 [0,1,0,1,0,0|2,0,0]=4 6093 B11R1.22 COC(=O)C1CCC(C)NC1 Amb21961304 [0,1,0,1,0,0|1,0,0]=3 6094 B11R1.22 COC(=O)C1CCC(C)NC1 Amb30586515 [0,1,0,1,0,0|1,0,0]=3 6095 B11R1.22 COC(=O)C1CCC(Cl)CC1 Amb28076575 [0,1,0,1,0,0|2,0,0]=4 6096 B11R1.22 COC(=O)C1CCC(N)CC1 Amb18548678 [0,1,0,1,0,0|2,0,0]=4 6097 B11R1.22 COC(=O)C1CCC(N)CC1 Amb3432259 [0,1,0,1,0,0|2,0,0]=4 6098 B11R1.22 COC(=O)C1CCC(O)CC1 Amb2695239 [0,1,0,1,0,0|2,0,0]=4 6099 B11R1.22 COC(=O)C1CCC(S)CC1 Amb32788101 [0,1,0,1,0,0|2,0,0]=4 6100 B11R1.22 COC(=O)C1CCN(C)CC1 Amb13951155 [0,1,0,1,0,0|2,0,0]=4 6101 B11R1.22 COC(=O)C1CNC(C)CN1 Amb24533023 [0,1,0,1,0,0|2,0,0]=4 6102 B11R1.22 COC(=O)N1CCC(C)CC1 Amb17862056 [0,1,0,1,0,0|2,0,0]=4 6103 B11R1.22 COC(=O)[C@@H]1CC=C(C)CC1 Amb26337856 [0,1,0,1,0,0|1,0,1]=4 6104 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Amb22886452 [0,1,0,1,0,0|1,0,0]=3 6105 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Amb24655066 [0,1,0,1,0,0|1,0,0]=3 6106 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)CN1 Amb33804469 [0,1,0,1,0,0|2,0,0]=4 6107 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 Amb27956215 [0,1,0,1,0,0|1,0,0]=3 6108 B11R1.22 COC(=O)[C@@H]1CO[C@@H](C)CN1 Amb33749504 [0,1,0,1,0,0|1,0,0]=3 6109 B11R1.22 COC(=O)[C@H]1CC=C(C)CC1 Amb25684213 [0,1,0,1,0,0|1,0,1]=4 6110 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb23439745 [0,1,0,1,0,0|1,0,0]=3 6111 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb28992565 [0,1,0,1,0,0|1,0,0]=3 6112 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb32405028 [0,1,0,1,0,0|1,0,0]=3 6113 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Amb32406036 [0,1,0,1,0,0|1,0,0]=3 6114 B11R1.22 COC(=O)[C@H]1CC[C@@H](F)CC1 Amb34913698 [0,1,0,1,0,0|2,0,0]=4 6115 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 Amb16183877 [0,1,0,1,0,0|2,0,0]=4 6116 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 Amb22755441 [0,1,0,1,0,0|2,0,0]=4 6117 B11R1.22 COC(=O)[C@H]1CC[C@@H](O)CC1 Amb23439292 [0,1,0,1,0,0|2,0,0]=4 6118 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 Amb26528013 [0,1,0,1,0,0|1,0,0]=3 6119 B11R1.22 COC(=O)[C@H]1CC[C@H](F)CC1 Amb34163014 [0,1,0,1,0,0|2,0,0]=4 6120 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 Amb16183878 [0,1,0,1,0,0|2,0,0]=4 6121 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 Amb32411780 [0,1,0,1,0,0|2,0,0]=4 6122 B11R1.22 COC(=O)[C@H]1CC[C@H](O)CC1 Amb22756640 [0,1,0,1,0,0|2,0,0]=4 6123 B11R1.22 C[C@H]1CC[C@H](C(=O)CBr)CC1 Amb27839669 [0,1,0,1,0,0|1,0,0]=3 6124 B11R1.22 C[C@H]1CC[C@H](C(=O)CCl)CC1 Amb27481893 [0,1,0,1,0,0|1,0,0]=3 6125 B11R1.22 O=C(CCl)C1CCC(O)CC1 Amb26034623 [0,1,0,1,0,0|2,0,0]=4 6126 B11R1.22 O=C(CCl)[C@H]1CC[C@H](O)CC1 Amb28239785 [0,1,0,1,0,0|2,0,0]=4 6127 B11R1.26 C=C1CCCCCCC1CO Amb27765896 [0,1,0,1,0,0|1,0,0]=3 6128 B11R1.26 CC1=C(CO)CCCCCC1 Amb28127966 [0,1,0,1,0,0|1,0,1]=4 6129 B11R1.26 CCC1CCCCCCC1=O Amb28284886 [0,1,0,1,0,0|1,0,0]=3 6130 B11R1.26 N#CC1CCCCCCC1=O Amb27954163 [0,1,0,1,0,0|1,0,1]=4 6131 B11R1.26 NC1CCCCCCC1CO Amb27798202 [0,1,0,1,0,0|1,0,1]=4 6132 B11R1.26 NCN1CCCCCCC1=O Amb28436920 [0,1,0,1,0,0|2,0,0]=4 6133 B11R1.26 O=C1CCCCCCN1CCl Amb8844104 [0,1,0,1,0,0|2,0,0]=4 6134 B11R1.26 O=C1CCCCCCN1CO Amb8844103 [0,1,0,1,0,0|1,0,0]=3 6135 B11R1.26 O=C1CCCCCC\C1=C/O Amb22520392 [0,1,0,1,0,0|0,0,2]=4 6136 B11R1.26 O=C1CCCCCC\C1=C\O Amb24662269 [0,1,0,1,0,0|0,0,2]=4 6137 B11R1.26 O=CC1CCCCCCC1=O Amb27863967 [0,1,0,1,0,0|0,0,2]=4 6138 B11R1.26 OCC1CCCCCCC1O Amb26612870 [0,1,0,1,0,0|0,0,2]=4 6139 B11R1.26 OC[C@H]1CCCCCC[C@@H]1O Amb28292208 [0,1,0,1,0,0|0,0,2]=4 6140 B11R1.37 CC1CCC(CO)C(CO)C1 Amb4009142 [0,1,0,1,0,0|0,0,2]=4 6141 B11R1.37 CCC1CCC(C)C\C1=N/N Amb27840253 [0,1,0,1,0,0|2,0,0]=4 6142 B11R1.37 C[C@@H]1CC[C@@H](CO)[C@@H](CO)C1 Amb27211284 [0,1,0,1,0,0|0,0,2]=4 6143 B11R1.44 C#CC(=O)C1COC(CN)C1 Amb33132394 [0,1,0,1,0,0|1,0,1]=4 6144 B11R1.44 C#CC(=O)[C@@H]1CO[C@H](CN)C1 Amb33132410 [0,1,0,1,0,0|1,0,1]=4 6145 B11R1.44 C=CC(=O)C1CCC(CC)C1 Amb27874708 [0,1,0,1,0,0|1,0,1]=4 6146 B11R1.44 C=CC(=O)C1COC(CN)C1 Amb33132395 [0,1,0,1,0,0|1,0,1]=4 6147 B11R1.44 C=CC(=O)[C@@H]1CO[C@H](CN)C1 Amb33132411 [0,1,0,1,0,0|1,0,1]=4 6148 B11R1.44 CCC(=O)C1COC(CC)C1 Amb29870606 [0,1,0,1,0,0|0,0,0]=2 6149 B11R1.44 CCC(=O)C1COC(CN)C1 Amb33132396 [0,1,0,1,0,0|1,0,0]=3 6150 B11R1.44 CCC(=O)[C@@H]1CO[C@H](CN)C1 Amb33132414 [0,1,0,1,0,0|1,0,0]=3 6151 B11R1.44 CCC1=NC(C(=O)OC)CO1 Amb24642858 [0,1,0,1,0,0|1,0,1]=4 6152 B11R1.44 CCC1CC(C(=O)OC)CN1 Amb27613224 [0,1,0,1,0,0|1,0,0]=3 6153 B11R1.44 CCC1CC(C(Br)CC)CO1 Amb29883071 [0,1,0,1,0,0|1,0,1]=4 6154 B11R1.44 CCC1CC(C(C)NC)CO1 Amb35626538 [0,1,0,1,0,0|1,0,1]=4 6155 B11R1.44 CCC1CC(C(Cl)CC)CO1 Amb29883070 [0,1,0,1,0,0|1,0,1]=4 6156 B11R1.44 CCC1CC(C(N)CC)CO1 Amb35626537 [0,1,0,1,0,0|1,0,1]=4 6157 B11R1.44 CCC1CC(C(O)CC)CO1 Amb35637591 [0,1,0,1,0,0|0,0,2]=4 6158 B11R1.44 CCC1CC(N(C)C#N)CO1 Amb35626641 [0,1,0,1,0,0|2,0,0]=4 6159 B11R1.44 CCC1CC(N(C)C=O)CO1 Amb35614752 [0,1,0,1,0,0|1,0,0]=3 6160 B11R1.44 CCC1CCC(C(=N)OC)C1 Amb27229749 [0,1,0,1,0,0|2,0,0]=4 6161 B11R1.44 CCC1CCC(C(=O)OC)N1 Amb23454511 [0,1,0,1,0,0|2,0,0]=4 6162 B11R1.44 CCC1CCN(C(=O)CN)C1 Amb26492972 [0,1,0,1,0,0|2,0,0]=4 6163 B11R1.44 CCC1CCN(C(=O)CS)C1 Amb27834023 [0,1,0,1,0,0|2,0,0]=4 6164 B11R1.44 CCC1CNC(C(=O)OC)C1 Amb33804560 [0,1,0,1,0,0|2,0,0]=4 6165 B11R1.44 CCC1NC(C(=O)OC)CS1 Amb22261542 [0,1,0,1,0,0|1,1,0]=4 6166 B11R1.44 CC[C@@H]1C[C@H](C(=O)NN)CO1 Amb27769035 [0,1,0,1,0,0|1,0,0]=3 6167 B11R1.44 COC(=O)C1CCC(CN)C1 Amb26987439 [0,1,0,1,0,0|2,0,0]=4 6168 B11R1.44 COC(=O)C1CCC(CN)C1 Amb34157870 [0,1,0,1,0,0|2,0,0]=4 6169 B11R1.44 COC(=O)C1CCC(CO)C1 Amb26448823 [0,1,0,1,0,0|2,0,0]=4 6170 B11R1.44 COC(=O)C1CNC(CO)C1 Amb27237553 [0,1,0,1,0,0|2,0,0]=4 6171 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)C1 Amb6299837 [0,1,0,1,0,0|2,0,0]=4 6172 B11R1.44 COC(=O)[C@@H]1CO[C@H](CN)C1 Amb32685045 [0,1,0,1,0,0|1,0,0]=3 6173 B11R1.44 COC(=O)[C@H]1CC[C@@H](CO)C1 Amb26970565 [0,1,0,1,0,0|2,0,0]=4 6174 B11R1.51 CCC1CCCCCC1C=O Amb35725693 [0,1,0,1,0,0|1,0,1]=4 6175 B11R1.51 CCC1CCCCCC1CO Amb35672750 [0,1,0,1,0,0|1,0,1]=4 6176 B11R1.51 CCC1CCCCC\C1=N/N Amb35734046 [0,1,0,1,0,0|2,0,0]=4 6177 B11R1.51 CCC1CCCCC\C1=N/O Amb35681163 [0,1,0,1,0,0|1,0,1]=4 6178 B11R1.51 CCN1CCCCCC1CO Amb10817345 [0,1,0,1,0,0|2,0,0]=4 6179 B11R1.51 O=CN1CCCCCC1CO Amb26932888 [0,1,0,1,0,0|1,0,0]=3 6180 B11R1.51 OCC1CCCCCC1CCl Amb27875207 [0,1,0,1,0,0|1,0,1]=4 6181 B11R1.51 OC[C@H]1CCCCC[C@H]1CO Amb22356584 [0,1,0,1,0,0|0,0,2]=4 6182 B11R1.51 O\N=C1/CCCCCC1NO Amb27266041 [0,1,0,1,0,0|1,0,1]=4 6183 B11R1.54 CC1(CO)CCCCC1CO Amb27220141 [0,1,0,1,0,0|0,0,2]=4 6184 B11R1.54 CCC1(O)CCCCC1CO Amb27826509 [0,1,0,1,0,0|0,0,2]=4 6185 B11R1.54 CC[C@]1(N)CCCC[C@H]1CO Amb27789995 [0,1,0,1,0,0|1,0,1]=4 6186 B11R1.54 CN[C@@]1(C)CCCC[C@H]1CO Amb1993800 [0,1,0,1,0,0|1,0,1]=4 6187 B11R1.54 C[C@@]1(CO)CCCC[C@@H]1CO Amb28207112 [0,1,0,1,0,0|0,0,2]=4 6188 B11R1.54 C[C@]1(CO)CCCC[C@H]1CO Amb27981752 [0,1,0,1,0,0|0,0,2]=4 6189 B11R1.54 NCC1(N)CCCCC1CO Amb27876229 [0,1,0,1,0,0|1,0,1]=4 6190 B11R1.123 CC1=CCC(CCO)C1CO Amb27605385 [0,1,0,1,0,0|2,0,0]=4 6191 B11R1.123 CCC[C@@H]1CCC(=O)N1CO Amb27631986 [0,1,0,1,0,0|1,0,0]=3 6192 B11R1.212 CCCCC1CCC(=O)C1C Amb27982197 [0,1,0,1,0,0|1,0,1]=4 6193 B11R1.212 CCCCC1NCN(C)C1=O Amb27204935 [0,1,0,1,0,0|2,0,0]=4 6194 B11R1.212 CCCCN1CNC(C)C1=O Amb25328165 [0,1,0,1,0,0|2,0,0]=4 6195 B11R1.212 CCCC[C@@H]1CCC(=O)[C@H]1C Amb27432697 [0,1,0,1,0,0|1,0,1]=4 6196 B11R1.212 CCCSC1CCN(C)C1=O Amb27834745 [0,1,0,1,0,0|2,0,0]=4 6197 B11R1.212 CCNCC1CCN(C)C1=O Amb35686037 [0,1,0,1,0,0|2,0,0]=4 6198 B11R1.212 CN1CCC(CCCN)C1=O Amb25244721 [0,1,0,1,0,0|2,0,0]=4 6199 B11R1.222 C#CC(=O)C1CCCCC1N Amb25865675 [0,1,0,1,0,0|1,0,1]=4 6200 B11R1.222 C#CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307706 [0,1,0,1,0,0|1,0,1]=4 6201 B11R1.222 C=C=C(C)C1CCCCC1N Amb27617509 [0,1,0,1,0,0|2,0,0]=4 6202 B11R1.222 C=C=C(C)C1CCCCC1O Amb28350213 [0,1,0,1,0,0|1,0,0]=3 6203 B11R1.222 C=C=C(C)[C@H]1CCCC[C@@H]1O Amb27970891 [0,1,0,1,0,0|1,0,0]=3 6204 B11R1.222 C=CC(=O)C1CCCCC1N Amb24426696 [0,1,0,1,0,0|1,0,1]=4 6205 B11R1.222 C=CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307707 [0,1,0,1,0,0|1,0,1]=4 6206 B11R1.222 C=CC(C)[C@H]1CCCC[C@@H]1O Amb27422662 [0,1,0,1,0,0|1,0,1]=4 6207 B11R1.222 CC(C#N)C1CCCCC1O Amb27768493 [0,1,0,1,0,0|1,0,1]=4 6208 B11R1.222 CC1CCCCC1C(=O)CCl Amb27176582 [0,1,0,1,0,0|1,0,0]=3 6209 B11R1.222 CC1CCCCC1C(=O)CN Amb33307506 [0,1,0,1,0,0|1,0,0]=3 6210 B11R1.222 CC1CCCCC1C(=O)CN Amb35789183 [0,1,0,1,0,0|1,0,0]=3 6211 B11R1.222 CC1CCCCN1C(=O)CBr Amb17333412 [0,1,0,1,0,0|2,0,0]=4 6212 B11R1.222 CC1CCCCN1C(=O)CCl Amb9785066 [0,1,0,1,0,0|2,0,0]=4 6213 B11R1.222 CC1CCCCN1C(=O)CN Amb6278374 [0,1,0,1,0,0|2,0,0]=4 6214 B11R1.222 CC1CCCCN1C(=O)CS Amb28340520 [0,1,0,1,0,0|2,0,0]=4 6215 B11R1.222 CC1COCCC1C(=O)CCl Amb27480585 [0,1,0,1,0,0|2,0,0]=4 6216 B11R1.222 CCC(=O)C1CCCCC1=O Amb9786088 [0,1,0,1,0,0|0,0,2]=4 6217 B11R1.222 CCC(=O)C1CCCCC1Cl Amb27974245 [0,1,0,1,0,0|1,0,0]=3 6218 B11R1.222 CCC(=O)C1CCCCC1N Amb24700003 [0,1,0,1,0,0|1,0,0]=3 6219 B11R1.222 CCC(=O)C1CCCCN1C Amb27658755 [0,1,0,1,0,0|2,0,0]=4 6220 B11R1.222 CCC(=O)C1CCCNC1C Amb25173275 [0,1,0,1,0,0|2,0,0]=4 6221 B11R1.222 CCC(=O)C1CCNCC1C Amb27466852 [0,1,0,1,0,0|2,0,0]=4 6222 B11R1.222 CCC(=O)C1CCOCC1C Amb27863024 [0,1,0,1,0,0|2,0,0]=4 6223 B11R1.222 CCC(=O)C1CNCCC1C Amb33131341 [0,1,0,1,0,0|2,0,0]=4 6224 B11R1.222 CCC(=O)[C@@H]1CCCC[C@@H]1N Amb33307708 [0,1,0,1,0,0|1,0,0]=3 6225 B11R1.222 CCC(=O)[C@H]1CCCN[C@H]1C Amb33307653 [0,1,0,1,0,0|2,0,0]=4 6226 B11R1.222 CCC(=O)[C@H]1CSCC[C@H]1O Amb27844045 [0,1,0,1,0,0|1,0,0]=3 6227 B11R1.222 CCC(C)C1CCCCC1O Amb24353784 [0,1,0,1,0,0|1,0,1]=4 6228 B11R1.222 CCC(C)[C@@H]1CCCC[C@H]1O Amb32945397 [0,1,0,1,0,0|1,0,1]=4 6229 B11R1.222 CCC(N)C1CCCCC1O Amb9776222 [0,1,0,1,0,0|1,0,1]=4 6230 B11R1.222 CCN(C)C1CCCCC1O Amb18179757 [0,1,0,1,0,0|2,0,0]=4 6231 B11R1.222 CCS(=O)C1CCCCC1N Amb20622741 [0,1,0,1,0,0|2,0,0]=4 6232 B11R1.222 CN(C=O)C1CCCCC1O Amb28062611 [0,1,0,1,0,0|1,0,0]=3 6233 B11R1.222 CN1CCCCC1C(=O)CN Amb33323488 [0,1,0,1,0,0|2,0,0]=4 6234 B11R1.222 CNC(=N)C1CCCCC1C Amb28144911 [0,1,0,1,0,0|2,0,0]=4 6235 B11R1.222 CNC(=O)C1CCCCC1N Amb18948300 [0,1,0,1,0,0|1,0,0]=3 6236 B11R1.222 CNC(=O)C1CCCCC1O Amb24484896 [0,1,0,1,0,0|0,0,0]=2 6237 B11R1.222 CNC(=O)C1CCCCN1C Amb28365680 [0,1,0,1,0,0|2,0,0]=4 6238 B11R1.222 CNC(=O)C1CCCNC1C Amb23586122 [0,1,0,1,0,0|2,0,0]=4 6239 B11R1.222 CNC(=O)C1CCCOC1C Amb27665170 [0,1,0,1,0,0|2,0,0]=4 6240 B11R1.222 CNC(=O)C1CCNCC1C Amb27242941 [0,1,0,1,0,0|2,0,0]=4 6241 B11R1.222 CNC(=O)C1CCOCC1C Amb27754185 [0,1,0,1,0,0|2,0,0]=4 6242 B11R1.222 CNC(=O)C1NCCCC1C Amb18947038 [0,1,0,1,0,0|2,0,0]=4 6243 B11R1.222 CNN(C)[C@H]1CCCC[C@@H]1O Amb27447282 [0,1,0,1,0,0|2,0,0]=4 6244 B11R1.222 COC(=N)C1CCCCC1C Amb28286087 [0,1,0,1,0,0|2,0,0]=4 6245 B11R1.222 COC(=O)C1=CCCC[C@H]1O Amb27595339 [0,1,0,1,0,0|0,0,2]=4 6246 B11R1.222 COC(=O)C1CC=CCC1O Amb28138556 [0,1,0,1,0,0|0,0,2]=4 6247 B11R1.222 COC(=O)C1CCCCC1=O Amb8394279 [0,1,0,1,0,0|0,0,2]=4 6248 B11R1.222 COC(=O)C1CCCCC1Br Amb24509456 [0,1,0,1,0,0|1,0,0]=3 6249 B11R1.222 COC(=O)C1CCCCC1Cl Amb27658948 [0,1,0,1,0,0|1,0,0]=3 6250 B11R1.222 COC(=O)C1CCCCC1N Amb32652851 [0,1,0,1,0,0|1,0,0]=3 6251 B11R1.222 COC(=O)C1CCCCC1N Amb5720245 [0,1,0,1,0,0|1,0,0]=3 6252 B11R1.222 COC(=O)C1CCCCC1O Amb4013515 [0,1,0,1,0,0|0,0,0]=2 6253 B11R1.222 COC(=O)C1CCCCN1C Amb29837946 [0,1,0,1,0,0|2,0,0]=4 6254 B11R1.222 COC(=O)C1CCCCN1Cl Amb27665331 [0,1,0,1,0,0|2,0,0]=4 6255 B11R1.222 COC(=O)C1CCCC[C@@H]1N Amb27758069 [0,1,0,1,0,0|1,0,0]=3 6256 B11R1.222 COC(=O)C1CCCNC1C Amb22728307 [0,1,0,1,0,0|2,0,0]=4 6257 B11R1.222 COC(=O)C1CCNCC1C Amb25892523 [0,1,0,1,0,0|2,0,0]=4 6258 B11R1.222 COC(=O)C1CCNCC1C Amb28652922 [0,1,0,1,0,0|2,0,0]=4 6259 B11R1.222 COC(=O)C1CCNCC1F Amb30869452 [0,1,0,1,0,0|2,0,0]=4 6260 B11R1.222 COC(=O)C1CCSCC1N Amb27847288 [0,1,0,1,0,0|2,0,0]=4 6261 B11R1.222 COC(=O)C1CNCCC1C Amb22586069 [0,1,0,1,0,0|2,0,0]=4 6262 B11R1.222 COC(=O)C1CNCCC1C Amb23438866 [0,1,0,1,0,0|2,0,0]=4 6263 B11R1.222 COC(=O)C1CNCCC1F Amb26320196 [0,1,0,1,0,0|2,0,0]=4 6264 B11R1.222 COC(=O)C1CNCCC1N Amb22586080 [0,1,0,1,0,0|2,0,0]=4 6265 B11R1.222 COC(=O)C1CNCCC1O Amb22235519 [0,1,0,1,0,0|1,0,0]=3 6266 B11R1.222 COC(=O)C1COCCC1N Amb25118703 [0,1,0,1,0,0|2,0,0]=4 6267 B11R1.222 COC(=O)C1CSCCC1O Amb26051325 [0,1,0,1,0,0|1,0,0]=3 6268 B11R1.222 COC(=O)C1NCCCC1C Amb23590118 [0,1,0,1,0,0|2,0,0]=4 6269 B11R1.222 COC(=O)C1NCCCC1O Amb26873383 [0,1,0,1,0,0|1,0,0]=3 6270 B11R1.222 COC(=O)C1NCCCC1O Amb33495150 [0,1,0,1,0,0|1,0,0]=3 6271 B11R1.222 COC(=O)C1OCCCC1N Amb27224259 [0,1,0,1,0,0|2,0,0]=4 6272 B11R1.222 COC(=O)N1CCCCC1O Amb27201370 [0,1,0,1,0,0|1,0,0]=3 6273 B11R1.222 COC(=O)[C@@H]1CC=CC[C@H]1O Amb27631891 [0,1,0,1,0,0|0,0,2]=4 6274 B11R1.222 COC(=O)[C@@H]1CCC=C[C@@H]1O Amb28071028 [0,1,0,1,0,0|0,0,2]=4 6275 B11R1.222 COC(=O)[C@@H]1CCCCC1=O Amb26336345 [0,1,0,1,0,0|0,0,2]=4 6276 B11R1.222 COC(=O)[C@@H]1CCCCN1C Amb27832197 [0,1,0,1,0,0|2,0,0]=4 6277 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1Cl Amb28057557 [0,1,0,1,0,0|1,0,0]=3 6278 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N Amb25945407 [0,1,0,1,0,0|1,0,0]=3 6279 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N Amb32652863 [0,1,0,1,0,0|1,0,0]=3 6280 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O Amb25955060 [0,1,0,1,0,0|0,0,0]=2 6281 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N Amb22747096 [0,1,0,1,0,0|1,0,0]=3 6282 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N Amb30868037 [0,1,0,1,0,0|1,0,0]=3 6283 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1O Amb28053335 [0,1,0,1,0,0|0,0,0]=2 6284 B11R1.222 COC(=O)[C@@H]1CCCN[C@@H]1C Amb26388831 [0,1,0,1,0,0|2,0,0]=4 6285 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C Amb30647377 [0,1,0,1,0,0|2,0,0]=4 6286 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1F Amb28056090 [0,1,0,1,0,0|2,0,0]=4 6287 B11R1.222 COC(=O)[C@@H]1CCNC[C@H]1C Amb28056084 [0,1,0,1,0,0|2,0,0]=4 6288 B11R1.222 COC(=O)[C@@H]1CCNC[C@H]1C Amb34915334 [0,1,0,1,0,0|2,0,0]=4 6289 B11R1.222 COC(=O)[C@@H]1CCNC[C@H]1F Amb24667882 [0,1,0,1,0,0|2,0,0]=4 6290 B11R1.222 COC(=O)[C@@H]1CCNC[C@H]1F Amb35752873 [0,1,0,1,0,0|2,0,0]=4 6291 B11R1.222 COC(=O)[C@@H]1CNCC[C@@H]1C Amb26405848 [0,1,0,1,0,0|2,0,0]=4 6292 B11R1.222 COC(=O)[C@@H]1COCC[C@@H]1N Amb22745000 [0,1,0,1,0,0|2,0,0]=4 6293 B11R1.222 COC(=O)[C@@H]1NCCC[C@@H]1C Amb24716098 [0,1,0,1,0,0|2,0,0]=4 6294 B11R1.222 COC(=O)[C@@H]1NCCC[C@@H]1O Amb25257925 [0,1,0,1,0,0|1,0,0]=3 6295 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N Amb27422013 [0,1,0,1,0,0|1,0,0]=3 6296 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N Amb33806189 [0,1,0,1,0,0|1,0,0]=3 6297 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1O Amb27448432 [0,1,0,1,0,0|0,0,0]=2 6298 B11R1.222 COC(=O)[C@H]1CCCN[C@@H]1C Amb27617825 [0,1,0,1,0,0|2,0,0]=4 6299 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C Amb22230837 [0,1,0,1,0,0|2,0,0]=4 6300 B11R1.222 COC(=O)[C@H]1CCNC[C@H]1C Amb23401393 [0,1,0,1,0,0|2,0,0]=4 6301 B11R1.222 COC(=O)[C@H]1CCNC[C@H]1C Amb28196685 [0,1,0,1,0,0|2,0,0]=4 6302 B11R1.222 COC(=O)[C@H]1CCOC[C@H]1N Amb27488825 [0,1,0,1,0,0|2,0,0]=4 6303 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1C Amb27444595 [0,1,0,1,0,0|2,0,0]=4 6304 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C Amb31028946 [0,1,0,1,0,0|2,0,0]=4 6305 B11R1.222 COC(=O)[C@H]1COCC[C@H]1N Amb20241477 [0,1,0,1,0,0|2,0,0]=4 6306 B11R1.222 COC(=O)[C@H]1CSCC[C@H]1O Amb27775874 [0,1,0,1,0,0|1,0,0]=3 6307 B11R1.222 COC(=O)[C@H]1NCCC[C@@H]1C Amb27623073 [0,1,0,1,0,0|2,0,0]=4 6308 B11R1.222 COC(=O)[C@H]1NCCC[C@@H]1N Amb27201243 [0,1,0,1,0,0|2,0,0]=4 6309 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1N Amb28054814 [0,1,0,1,0,0|2,0,0]=4 6310 B11R1.222 CSC(=O)C1CCCCC1O Amb27457687 [0,1,0,1,0,0|0,0,0]=2 6311 B11R1.222 C[C@@H]1CCCC[C@H]1C(=O)CCl Amb24572885 [0,1,0,1,0,0|1,0,0]=3 6312 B11R1.222 C\C(=N/O)C1CCCCC1C Amb27442773 [0,1,0,1,0,0|1,0,1]=4 6313 B11R1.222 C\C(C=O)=C1/CCCCC1C Amb27169477 [0,1,0,1,0,0|1,0,1]=4 6314 B11R1.222 C\C(CO)=C1\CCCCC1O Amb28136778 [0,1,0,1,0,0|0,0,2]=4 6315 B11R1.222 C\C(CO)=C1\CCCC[C@@H]1O Amb28079063 [0,1,0,1,0,0|0,0,2]=4 6316 B11R1.222 NC1CCCCC1C(=O)NO Amb28133936 [0,1,0,1,0,0|2,0,0]=4 6317 B11R1.222 NNC(=O)C1CCCCC1O Amb25704754 [0,1,0,1,0,0|1,0,0]=3 6318 B11R1.222 NNC(=O)[C@@H]1CCCC[C@@H]1O Amb24648640 [0,1,0,1,0,0|1,0,0]=3 6319 B11R1.222 NNC(=O)[C@@H]1CCCC[C@H]1O Amb25772433 [0,1,0,1,0,0|1,0,0]=3 6320 B11R1.222 NNC(=O)[C@H]1CCCC[C@@H]1O Amb28324241 [0,1,0,1,0,0|1,0,0]=3 6321 B11R1.222 O=C(NO)[C@H]1CCCC[C@H]1O Amb25919592 [0,1,0,1,0,0|1,0,0]=3 6322 B11R1.222 OCC(O)C1CCCCC1O Amb27950877 [0,1,0,1,0,0|0,0,2]=4 6323 B11R1.222 OCC(O)[C@H]1CCCC[C@@H]1O Amb27853553 [0,1,0,1,0,0|0,0,2]=4 6324 B11R1.222 OC[C@@H](O)[C@H]1CCCC[C@@H]1O Amb27972546 [0,1,0,1,0,0|0,0,2]=4 6325 B11R1.249 CNC(=O)[C@@H]1N[C@H](CO)[C@H]1O Amb27856120 [0,1,0,1,0,0|2,0,0]=4 6326 B11R1.249 COC(=O)[C@H]1O[C@H](CO)[C@@H]1O Amb27640207 [0,1,0,1,0,0|2,0,0]=4 6327 B11R1.278 CC1CCC(CO)C(C)C1C Amb32415633 [0,1,0,1,0,0|1,0,1]=4 6328 B11R1.278 CC1CC\C(=C/O)C(=O)C1C Amb28052508 [0,1,0,1,0,0|0,0,2]=4 6329 B11R1.278 CCC1NCC(C)N(C)C1=O Amb28384497 [0,1,0,1,0,0|2,0,0]=4 6330 B11R1.278 CC[C@H]1NC[C@H](C)N(C)C1=O Amb27778452 [0,1,0,1,0,0|2,0,0]=4 6331 B11R1.340 CCCC1CC(CO)C1CO Amb27989503 [0,1,0,1,0,0|0,0,2]=4 6332 B11R1.365 CCCCC1=C(C)C(=O)C1Cl Amb27617305 [0,1,0,1,0,0|1,0,1]=4 6333 B11R1.381 CC1CCCCC(C=O)C1=O Amb26343817 [0,1,0,1,0,0|0,0,2]=4 6334 B11R1.381 CCC1CCCCC(=O)N1C Amb2779826 [0,1,0,1,0,0|2,0,0]=4 6335 B11R1.381 CCC1CCCCC(C)C1=O Amb28074813 [0,1,0,1,0,0|1,0,0]=3 6336 B11R1.381 CCC1CCCCN(C)C1=O Amb25231277 [0,1,0,1,0,0|1,0,0]=3 6337 B11R1.381 CCC1CNCCN(C)C1=O Amb27644574 [0,1,0,1,0,0|2,0,0]=4 6338 B11R1.381 CCN1CCCCC(N)C1=O Amb22492734 [0,1,0,1,0,0|2,0,0]=4 6339 B11R1.381 CCN1CCCC[C@H](N)C1=O Amb19883962 [0,1,0,1,0,0|2,0,0]=4 6340 B11R1.381 CCN1CCCC[C@H](N)C1=O Amb2684404 [0,1,0,1,0,0|2,0,0]=4 6341 B11R1.381 CN1C(=O)CCOCC1CO Amb27842345 [0,1,0,1,0,0|2,0,0]=4 6342 B11R1.381 CN1CCCCC(C=O)C1=O Amb31297988 [0,1,0,1,0,0|0,0,2]=4 6343 B11R1.381 CN1CCCCC(CO)C1=O Amb32667714 [0,1,0,1,0,0|0,0,0]=2 6344 B11R1.381 CNC1CCCCN(C)C1=O Amb28410154 [0,1,0,1,0,0|2,0,0]=4 6345 B11R1.381 CNC1CCCCN(C)C1=O Amb32660456 [0,1,0,1,0,0|2,0,0]=4 6346 B11R1.381 O=C1C(CO)=CCCCC1O Amb28253797 [0,1,0,1,0,0|0,0,2]=4 6347 B11R1.394 C[C@H]1CC[C@H](CO)[C@]1(C)CO Amb28455085 [0,1,0,1,0,0|0,0,2]=4 6348 B11R1.841 CCCCC1C(=O)NC1CC Amb27673663 [0,1,0,1,0,0|2,0,0]=4 6349 B11R1.852 C#CC(=O)C1CNCCOC1 Amb33132257 [0,1,0,1,0,0|1,0,1]=4 6350 B11R1.852 C=C(CBr)C1CCCCCC1 Amb33432966 [0,1,0,1,0,0|2,0,0]=4 6351 B11R1.852 C=C(CCl)C1CCCCCC1 Amb33222618 [0,1,0,1,0,0|2,0,0]=4 6352 B11R1.852 C=C(CN)C1CCCCCC1 Amb33267272 [0,1,0,1,0,0|2,0,0]=4 6353 B11R1.852 C=CC(=O)C1CCCCCC1 Amb27814911 [0,1,0,1,0,0|1,0,1]=4 6354 B11R1.852 C=CC(=O)C1CNCCOC1 Amb33132259 [0,1,0,1,0,0|1,0,1]=4 6355 B11R1.852 CC(C=O)C1CCCCCC1 Amb26572856 [0,1,0,1,0,0|1,0,1]=4 6356 B11R1.852 CCC(=O)C1CCCCCC1 Amb27455372 [0,1,0,1,0,0|1,0,0]=3 6357 B11R1.852 CCC(=O)C1CCCCCN1 Amb27173385 [0,1,0,1,0,0|2,0,0]=4 6358 B11R1.852 CCC(=O)C1CCCCCO1 Amb27843627 [0,1,0,1,0,0|2,0,0]=4 6359 B11R1.852 CCC(=O)C1CCCSCC1 Amb30031065 [0,1,0,1,0,0|2,0,0]=4 6360 B11R1.852 CCC(=O)C1CNCCOC1 Amb33132261 [0,1,0,1,0,0|1,0,0]=3 6361 B11R1.852 CCC(=O)C1COCCOC1 Amb27840307 [0,1,0,1,0,0|1,0,0]=3 6362 B11R1.852 CCC(=O)N1CCCCCC1 Amb5797491 [0,1,0,1,0,0|2,0,0]=4 6363 B11R1.852 CNC(=O)C1CCCSCC1 Amb30031371 [0,1,0,1,0,0|2,0,0]=4 6364 B11R1.852 CNC(=O)C1CNCCOC1 Amb20062257 [0,1,0,1,0,0|1,0,0]=3 6365 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|1,0,0]=3 6366 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|2,0,0]=4 6367 B11R1.852 COC(=O)C1CCCCCN1 Amb33548478 [0,1,0,1,0,0|2,0,0]=4 6368 B11R1.852 COC(=O)C1CCCCNC1 Amb21963336 [0,1,0,1,0,0|1,0,0]=3 6369 B11R1.852 COC(=O)C1CCCCNC1 Amb22490910 [0,1,0,1,0,0|1,0,0]=3 6370 B11R1.852 COC(=O)C1CCCNCC1 Amb22170283 [0,1,0,1,0,0|2,0,0]=4 6371 B11R1.852 COC(=O)C1CCCNCC1 Amb22230921 [0,1,0,1,0,0|2,0,0]=4 6372 B11R1.852 COC(=O)C1CCCSCC1 Amb30030973 [0,1,0,1,0,0|2,0,0]=4 6373 B11R1.852 COC(=O)C1CNCCCN1 Amb22406405 [0,1,0,1,0,0|2,0,0]=4 6374 B11R1.852 COC(=O)C1CNCCOC1 Amb27782567 [0,1,0,1,0,0|1,0,0]=3 6375 B11R1.852 COC(=O)C1CNCCOC1 Amb32434762 [0,1,0,1,0,0|1,0,0]=3 6376 B11R1.852 COC(=O)C1CNCCSC1 Amb25988488 [0,1,0,1,0,0|1,1,0]=4 6377 B11R1.852 COC(=O)N1CCCCCC1 Amb17789384 [0,1,0,1,0,0|2,0,0]=4 6378 B11R1.852 COC(=O)[C@@H]1COCCCN1 Amb27210558 [0,1,0,1,0,0|1,0,0]=3 6379 B11R1.852 COC(=O)[C@H]1COCCCN1 Amb27214865 [0,1,0,1,0,0|1,0,0]=3 6380 B11R1.852 C\C(=N/N)C1CCCCCC1 Amb27485431 [0,1,0,1,0,0|2,0,0]=4 6381 B11R1.852 NCC(=O)C1CCCCCC1 Amb24402617 [0,1,0,1,0,0|1,0,0]=3 6382 B11R1.852 NCC(=O)N1CCCCCC1 Amb6260451 [0,1,0,1,0,0|2,0,0]=4 6383 B11R1.852 NNC(=O)C1CCCCCC1 Amb18797041 [0,1,0,1,0,0|2,0,0]=4 6384 B11R1.852 O=C(CBr)C1CCCCCC1 Amb22001874 [0,1,0,1,0,0|1,0,0]=3 6385 B11R1.852 O=C(CBr)N1CCCCCC1 Amb17327121 [0,1,0,1,0,0|2,0,0]=4 6386 B11R1.852 O=C(CCl)C1CCCCCC1 Amb25991272 [0,1,0,1,0,0|1,0,0]=3 6387 B11R1.852 O=C(CCl)N1CCCCCC1 Amb1150075 [0,1,0,1,0,0|2,0,0]=4 6388 B11R1.852 O=C(CF)N1CCCCCC1 Amb26045665 [0,1,0,1,0,0|2,0,0]=4 6389 B11R1.852 O=C(CI)N1CCCCCC1 Amb27836314 [0,1,0,1,0,0|2,0,0]=4 6390 B11R1.852 O=C(CO)C1CCCCCN1 Amb28053242 [0,1,0,1,0,0|2,0,0]=4 6391 B11R1.852 O=C(CO)N1CCCCCC1 Amb1111379 [0,1,0,1,0,0|2,0,0]=4 6392 B11R1.852 O=C(NO)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|2,0,0]=4 6393 B11R1.860 C#CC(=O)C(CN)C1CCC1 Amb33132193 [0,1,0,1,0,0|1,0,1]=4 6394 B11R1.860 C=CC(=O)C(CN)C1CCC1 Amb33132194 [0,1,0,1,0,0|1,0,1]=4 6395 B11R1.860 CCC(=O)C(C#N)C1CCC1 Amb27972945 [0,1,0,1,0,0|1,0,1]=4 6396 B11R1.860 CCC(=O)C(CN)C1CCC1 Amb33132195 [0,1,0,1,0,0|1,0,0]=3 6397 B11R1.860 CCC(=O)N(CC)C1CCC1 Amb27270174 [0,1,0,1,0,0|2,0,0]=4 6398 B11R1.860 CCC(C(=O)OC)N1CCC1 Amb27270618 [0,1,0,1,0,0|2,0,0]=4 6399 B11R1.860 CCC(C1CCC1)N(C)C=O Amb27672738 [0,1,0,1,0,0|2,0,0]=4 6400 B11R1.860 CCN(C(=O)CCl)C1CCC1 Amb27270175 [0,1,0,1,0,0|2,0,0]=4 6401 B11R1.860 CCN(C(=O)NC)C1CCC1 Amb28066920 [0,1,0,1,0,0|2,0,0]=4 6402 B11R1.860 CCN(C(=O)OC)C1CCC1 Amb27270176 [0,1,0,1,0,0|2,0,0]=4 6403 B11R1.860 CNC(=O)C(CN)C1CCC1 Amb30039494 [0,1,0,1,0,0|1,0,0]=3 6404 B11R1.860 CNC(=O)C(OC)C1CCC1 Amb30029863 [0,1,0,1,0,0|2,0,0]=4 6405 B11R1.860 CNC(C(=O)OC)C1CCC1 Amb34913725 [0,1,0,1,0,0|2,0,0]=4 6406 B11R1.860 COC(=O)C(C#N)C1CCC1 Amb25150621 [0,1,0,1,0,0|1,0,1]=4 6407 B11R1.860 COC(=O)C(CN)C1CCC1 Amb27989392 [0,1,0,1,0,0|1,0,0]=3 6408 B11R1.860 COC(=O)C(CN)C1CNC1 Amb25385296 [0,1,0,1,0,0|2,0,0]=4 6409 B11R1.860 COC(=O)C(CN)C1COC1 Amb25385300 [0,1,0,1,0,0|2,0,0]=4 6410 B11R1.860 COC(=O)C(CO)C1CCC1 Amb33472052 [0,1,0,1,0,0|0,0,0]=2 6411 B11R1.860 COC(=O)C(CO)C1CNC1 Amb27989298 [0,1,0,1,0,0|1,0,0]=3 6412 B11R1.860 COC(=O)C(CO)C1COC1 Amb33472084 [0,1,0,1,0,0|1,0,0]=3 6413 B11R1.860 NCC(C(=O)NN)C1CCC1 Amb30039495 [0,1,0,1,0,0|2,0,0]=4 6414 B11R1.860 NCC(C(=O)NO)C1CCC1 Amb30039496 [0,1,0,1,0,0|2,0,0]=4 6415 B11R1.862 C#CC(=O)C(CN)CC1CC1 Amb33308004 [0,1,0,1,0,0|1,0,1]=4 6416 B11R1.862 C=CC(=O)C(CN)CC1CC1 Amb33308005 [0,1,0,1,0,0|1,0,1]=4 6417 B11R1.862 CCC(=O)C(CN)CC1CC1 Amb33308006 [0,1,0,1,0,0|1,0,0]=3 6418 B11R1.862 CCC(NC1CC1)C(=O)OC Amb18791808 [0,1,0,1,0,0|2,0,0]=4 6419 B11R1.862 CCN(CC1CC1)C(=O)NC Amb28387582 [0,1,0,1,0,0|2,0,0]=4 6420 B11R1.862 COC(=O)C(CC1CC1)ON Amb32660230 [0,1,0,1,0,0|2,0,0]=4 6421 B11R1.862 COC(=O)C(CN)CC1CC1 Amb18182202 [0,1,0,1,0,0|1,0,0]=3 6422 B11R1.862 COC(=O)C(CN)CC1CC1 Amb19373638 [0,1,0,1,0,0|1,0,0]=3 6423 B11R1.865 C=C(C=O)[C@H]1CC[C@@H](C)[C@@H]1C Amb27782383 [0,1,0,1,0,0|1,0,1]=4 6424 B11R1.865 C=C(C=O)[C@H]1CC[C@@H](C)[C@H]1C Amb28287290 [0,1,0,1,0,0|1,0,1]=4 6425 B11R1.865 C=C(C=O)[C@H]1CC[C@H](C)[C@@H]1C Amb27619211 [0,1,0,1,0,0|1,0,1]=4 6426 B11R1.865 CC1CCC(C(C)CO)C1O Amb28125840 [0,1,0,1,0,0|0,0,2]=4 6427 B11R1.865 CC1CCN(C(=O)CS)C1C Amb27434603 [0,1,0,1,0,0|2,0,0]=4 6428 B11R1.865 CCC(=O)C1COC(C)C1C Amb35732635 [0,1,0,1,0,0|2,0,0]=4 6429 B11R1.865 CNC(=O)C1CCC(C)C1C Amb26564872 [0,1,0,1,0,0|1,0,0]=3 6430 B11R1.865 CNC(=O)C1CCC(C)N1C Amb26448884 [0,1,0,1,0,0|2,0,0]=4 6431 B11R1.865 CNC(=O)C1NCC(O)C1O Amb27602286 [0,1,0,1,0,0|2,0,0]=4 6432 B11R1.865 COC(=O)C1CCC(C)C1=O Amb5395490 [0,1,0,1,0,0|0,0,2]=4 6433 B11R1.865 COC(=O)C1CCC(N)C1C Amb28060963 [0,1,0,1,0,0|2,0,0]=4 6434 B11R1.865 COC(=O)C1CCC(O)C1C Amb26014485 [0,1,0,1,0,0|2,0,0]=4 6435 B11R1.865 COC(=O)C1CCC(O)C1O Amb23456142 [0,1,0,1,0,0|1,0,0]=3 6436 B11R1.865 COC(=O)N1CCC(Cl)C1O Amb27760485 [0,1,0,1,0,0|2,0,0]=4 6437 B11R1.865 COC(=O)[C@@H]1CC[C@@H](C)[C@@H]1N Amb28132892 [0,1,0,1,0,0|1,0,0]=3 6438 B11R1.865 COC(=O)[C@H]1CCC(O)[C@@H]1C Amb27970896 [0,1,0,1,0,0|2,0,0]=4 6439 B11R1.865 COC(=O)[C@H]1CC[C@@H](C)N1C Amb28071478 [0,1,0,1,0,0|2,0,0]=4 6440 B11R1.865 COC(=O)[C@H]1CC[C@@H](Cl)[C@@H]1O Amb27192139 [0,1,0,1,0,0|1,0,0]=3 6441 B11R1.865 COC(=O)[C@H]1CC[C@H](C)N1C Amb28385893 [0,1,0,1,0,0|2,0,0]=4 6442 B11R1.865 COC(=O)[C@H]1NC[C@@H](O)[C@@H]1O Amb27966069 [0,1,0,1,0,0|2,0,0]=4 6443 B11R1.880 COC(=O)C1(C#N)CCC1C Amb28135944 [0,1,0,1,0,0|1,0,1]=4 6444 B11R1.880 COC(=O)C1(CN)CCC1C Amb25076006 [0,1,0,1,0,0|1,0,0]=3 6445 B11R1.906 C=CCCC1(CO)CCC1=O Amb27672543 [0,1,0,1,0,0|0,0,2]=4 6446 B11R1.906 C=C[C@@]1(CCCC)CCC1=O Amb27672343 [0,1,0,1,0,0|1,0,1]=4 6447 B11R1.906 C=C[C@]1(CCCC)CCC1=O Amb27672344 [0,1,0,1,0,0|1,0,1]=4 6448 B11R1.906 CCCC[C@@]1(CO)CCC1=O Amb27672335 [0,1,0,1,0,0|0,0,0]=2 6449 B11R1.906 CCCC[C@]1(CO)CCC1=O Amb27672334 [0,1,0,1,0,0|0,0,0]=2 6450 B11R1.915 CCOCC1(C(=O)NC)CC1 Amb27987492 [0,1,0,1,0,0|2,0,0]=4 6451 B11R1.943 CCC1CC1(C#N)C(=O)OC Amb25938272 [0,1,0,1,0,0|1,0,1]=4 6452 B11R1.1220 COC(=O)C(CN)C1CC1C Amb33144219 [0,1,0,1,0,0|1,0,0]=3 6453 B11R1.1472 C#CC(=O)C1(CN)CCCC1 Amb24411029 [0,1,0,1,0,0|1,0,1]=4 6454 B11R1.1472 C=CC(=O)C1(CC)CCCC1 Amb27175472 [0,1,0,1,0,0|1,0,1]=4 6455 B11R1.1472 C=CC(=O)C1(CN)CCCC1 Amb27595743 [0,1,0,1,0,0|1,0,1]=4 6456 B11R1.1472 CCC(=O)C1(CC)CCCN1 Amb26603471 [0,1,0,1,0,0|2,0,0]=4 6457 B11R1.1472 CCC(=O)C1(CC)CCNC1 Amb27413184 [0,1,0,1,0,0|2,0,0]=4 6458 B11R1.1472 CCC(=O)C1(CN)CCCC1 Amb27253791 [0,1,0,1,0,0|1,0,0]=3 6459 B11R1.1472 CCC(=O)C1(NC)CCCC1 Amb24734484 [0,1,0,1,0,0|2,0,0]=4 6460 B11R1.1472 CCC(=O)C1(OC)CCCC1 Amb28076259 [0,1,0,1,0,0|2,0,0]=4 6461 B11R1.1472 CCC(=O)[C@]1(CC)CCCO1 Amb25892509 [0,1,0,1,0,0|2,0,0]=4 6462 B11R1.1472 CCC(C)C1(CO)CCCC1 Amb27764126 [0,1,0,1,0,0|1,0,1]=4 6463 B11R1.1472 CCC(N)C1(CO)CCCC1 Amb27781297 [0,1,0,1,0,0|1,0,1]=4 6464 B11R1.1472 CCC(O)C1(CO)CCCC1 Amb23513005 [0,1,0,1,0,0|0,0,2]=4 6465 B11R1.1472 CCC1(C(=O)OC)CCCN1 Amb19516960 [0,1,0,1,0,0|2,0,0]=4 6466 B11R1.1472 CCC1(C(=O)OC)CCCN1 Amb22491286 [0,1,0,1,0,0|2,0,0]=4 6467 B11R1.1472 CCC1(C(=O)OC)CCNC1 Amb27454639 [0,1,0,1,0,0|2,0,0]=4 6468 B11R1.1472 CC[C@@]1(C(=O)OC)CCCN1 Amb25362201 [0,1,0,1,0,0|2,0,0]=4 6469 B11R1.1472 CNC(=O)C1(C#N)CCCC1 Amb17334326 [0,1,0,1,0,0|1,0,1]=4 6470 B11R1.1472 CNC(=O)C1(NC)CCCC1 Amb28044569 [0,1,0,1,0,0|2,0,0]=4 6471 B11R1.1472 CNC(=O)C1(NC)CCCC1 Amb33329473 [0,1,0,1,0,0|2,0,0]=4 6472 B11R1.1472 CNC(=O)C1(OC)CCCC1 Amb26421442 [0,1,0,1,0,0|2,0,0]=4 6473 B11R1.1472 CNC1(C(=O)OC)CCCC1 Amb18288964 [0,1,0,1,0,0|2,0,0]=4 6474 B11R1.1472 COC(=O)C1(C#N)CCCC1 Amb6751860 [0,1,0,1,0,0|1,0,1]=4 6475 B11R1.1472 COC(=O)C1(C=O)CCCC1 Amb18644790 [0,1,0,1,0,0|0,0,2]=4 6476 B11R1.1472 COC(=O)C1(CBr)CCCC1 Amb24502034 [0,1,0,1,0,0|1,0,0]=3 6477 B11R1.1472 COC(=O)C1(CBr)CCCO1 Amb33295193 [0,1,0,1,0,0|2,0,0]=4 6478 B11R1.1472 COC(=O)C1(CF)CCNC1 Amb33339110 [0,1,0,1,0,0|2,0,0]=4 6479 B11R1.1472 COC(=O)C1(CF)CCNC1 Amb33457761 [0,1,0,1,0,0|2,0,0]=4 6480 B11R1.1472 COC(=O)C1(CN)CCCC1 Amb18299531 [0,1,0,1,0,0|1,0,0]=3 6481 B11R1.1472 COC(=O)C1(CN)CCCC1 Amb6751904 [0,1,0,1,0,0|1,0,0]=3 6482 B11R1.1472 COC(=O)C1(CN)CCCO1 Amb33804112 [0,1,0,1,0,0|2,0,0]=4 6483 B11R1.1472 COC(=O)C1(CN)CCCO1 Amb33804565 [0,1,0,1,0,0|2,0,0]=4 6484 B11R1.1472 COC(=O)C1(CN)CCOC1 Amb24365282 [0,1,0,1,0,0|2,0,0]=4 6485 B11R1.1472 COC(=O)C1(CN)CCOC1 Amb32756408 [0,1,0,1,0,0|2,0,0]=4 6486 B11R1.1472 COC(=O)C1(CO)CC=CC1 Amb33803812 [0,1,0,1,0,0|0,0,2]=4 6487 B11R1.1472 COC(=O)C1(CO)CCCC1 Amb24432680 [0,1,0,1,0,0|0,0,0]=2 6488 B11R1.1472 COC(=O)C1(CO)CCCN1 Amb27782102 [0,1,0,1,0,0|1,0,0]=3 6489 B11R1.1472 COC(=O)C1(CO)CCCN1 Amb35788910 [0,1,0,1,0,0|1,0,0]=3 6490 B11R1.1472 COC(=O)C1(CO)CCCO1 Amb33330858 [0,1,0,1,0,0|1,0,0]=3 6491 B11R1.1472 COC(=O)C1(CO)CCNC1 Amb24465817 [0,1,0,1,0,0|1,0,0]=3 6492 B11R1.1472 COC(=O)C1(CO)CCNC1 Amb33743740 [0,1,0,1,0,0|1,0,0]=3 6493 B11R1.1472 COC(=O)C1(ON)CCCC1 Amb27592686 [0,1,0,1,0,0|2,0,0]=4 6494 B11R1.1472 COC1(C(=O)CN)CCCC1 Amb30034370 [0,1,0,1,0,0|2,0,0]=4 6495 B11R1.1472 N\C(=N/O)C1(CO)CCCC1 Amb29868526 [0,1,0,1,0,0|1,0,1]=4 6496 B11R1.1472 [C-]#[N+]C1(C(=O)OC)CCCC1 Amb24604397 [0,1,0,1,0,0|2,0,0]=4 6497 B11R1.3 C#CC1CCC(C(C)=O)CC1 Amb25887139 [0,1,0,1,0,0|1,0,1]=4 6498 B11R1.3 C=C(C)C1CCC(CO)CC1 Amb26323067 [0,1,0,1,0,0|2,0,0]=4 6499 B11R1.3 CC(=O)C1CCC(CN)CC1 Amb27398780 [0,1,0,1,0,0|1,0,0]=3 6500 B11R1.3 CC(=O)C1CCC(CN)CC1 Amb33447096 [0,1,0,1,0,0|1,0,0]=3 6501 B11R1.3 CC(=O)N1CCC(CBr)CC1 Amb17103773 [0,1,0,1,0,0|2,0,0]=4 6502 B11R1.3 CC(=O)N1CCC(CCl)CC1 Amb10573759 [0,1,0,1,0,0|2,0,0]=4 6503 B11R1.3 CC(=O)N1CCC(CF)CC1 Amb35605367 [0,1,0,1,0,0|2,0,0]=4 6504 B11R1.3 CC(=O)N1CCC(CN)CC1 Amb19892089 [0,1,0,1,0,0|2,0,0]=4 6505 B11R1.3 CC(=O)N1CCC(CN)CC1 Amb31307974 [0,1,0,1,0,0|2,0,0]=4 6506 B11R1.3 CC(=O)N1CCC(CN)CC1 Amb8010116 [0,1,0,1,0,0|2,0,0]=4 6507 B11R1.3 CC(=O)N1CCC(CO)CC1 Amb16186642 [0,1,0,1,0,0|2,0,0]=4 6508 B11R1.3 CCC1=CC[C@H](C(C)=O)CC1 Amb27836856 [0,1,0,1,0,0|1,0,0]=3 6509 B11R1.3 CCC1CCC(C(=O)O)CC1 Amb2413128 [0,1,0,1,0,0|2,0,0]=4 6510 B11R1.3 CCC1CCC(C(=O)O)CN1 Amb25848341 [0,1,0,1,0,0|2,0,0]=4 6511 B11R1.3 CCC1CCC(C(=O)O)NC1 Amb18126073 [0,1,0,1,0,0|2,0,0]=4 6512 B11R1.3 CCC1CCC(C(C)=O)CC1 Amb24413032 [0,1,0,1,0,0|1,0,0]=3 6513 B11R1.3 CCC1CCC(C(N)=O)CC1 Amb27829081 [0,1,0,1,0,0|2,0,0]=4 6514 B11R1.3 CCC1CCN(C(C)=O)CC1 Amb25923082 [0,1,0,1,0,0|2,0,0]=4 6515 B11R1.3 CCC1CNC(C(=O)O)CO1 Amb28188774 [0,1,0,1,0,0|1,0,0]=3 6516 B11R1.3 CCC1NCC(C(C)C)CO1 Amb33194045 [0,1,0,1,0,0|1,0,1]=4 6517 B11R1.3 CCN1CCC(C(=O)O)CC1 Amb13948946 [0,1,0,1,0,0|2,0,0]=4 6518 B11R1.3 CCN1CCC(C(=O)O)CC1 Amb3941351 [0,1,0,1,0,0|2,0,0]=4 6519 B11R1.3 CCN1CCC(C(C)=O)CC1 Amb8939459 [0,1,0,1,0,0|1,0,0]=3 6520 B11R1.3 CCN1CCC(C(N)=O)CC1 Amb575483 [0,1,0,1,0,0|2,0,0]=4 6521 B11R1.3 CC[C@H]1CC[C@H](C(=O)O)CC1 Amb9786888 [0,1,0,1,0,0|2,0,0]=4 6522 B11R1.3 CNC1CCC(C(=O)O)CC1 Amb18949863 [0,1,0,1,0,0|2,0,0]=4 6523 B11R1.3 CNC1CCC(C(=O)O)CC1 Amb34913416 [0,1,0,1,0,0|2,0,0]=4 6524 B11R1.3 CNC1CCC(C(N)=O)CC1 Amb18951115 [0,1,0,1,0,0|2,0,0]=4 6525 B11R1.3 CNC1CCN(C(C)=O)CC1 Amb19958037 [0,1,0,1,0,0|2,0,0]=4 6526 B11R1.3 CN[C@H]1CC[C@@H](C(=O)O)CC1 Amb27984750 [0,1,0,1,0,0|2,0,0]=4 6527 B11R1.3 COC1CCC(C(=O)Cl)CC1 Amb33545508 [0,1,0,1,0,0|2,0,0]=4 6528 B11R1.3 COC1CCC(C(=O)O)CC1 Amb3939863 [0,1,0,1,0,0|2,0,0]=4 6529 B11R1.3 COC1CCC(C(C)=O)CC1 Amb24570436 [0,1,0,1,0,0|1,0,0]=3 6530 B11R1.3 COC1CCN(C(C)=O)CC1 Amb26562850 [0,1,0,1,0,0|2,0,0]=4 6531 B11R1.3 CO[C@H]1CC[C@@H](C(=O)O)CC1 Amb27760413 [0,1,0,1,0,0|2,0,0]=4 6532 B11R1.3 CO[C@H]1CC[C@H](C(=O)O)CC1 Amb24183374 [0,1,0,1,0,0|2,0,0]=4 6533 B11R1.3 CSC1CCC(C(=O)O)CC1 Amb28292503 [0,1,0,1,0,0|2,0,0]=4 6534 B11R1.3 CSC1CCN(C(C)=O)CC1 Amb27657031 [0,1,0,1,0,0|2,0,0]=4 6535 B11R1.3 NCC1CCC(C(=O)Cl)CC1 Amb24440899 [0,1,0,1,0,0|2,0,0]=4 6536 B11R1.3 NCC1CCC(C(=O)O)CC1 Amb3940763 [0,1,0,1,0,0|2,0,0]=4 6537 B11R1.3 NCC1CCC(C(N)=O)CC1 Amb18287382 [0,1,0,1,0,0|2,0,0]=4 6538 B11R1.3 NCC1CCC(C(N)=O)CC1 Amb20622451 [0,1,0,1,0,0|2,0,0]=4 6539 B11R1.3 NCC1OCC(C(=O)O)CO1 Amb27441090 [0,1,0,1,0,0|2,0,0]=4 6540 B11R1.3 NC[C@H]1CC[C@@H](C(=O)O)CC1 Amb17620787 [0,1,0,1,0,0|2,0,0]=4 6541 B11R1.3 NC[C@H]1CC[C@H](C(=O)O)CC1 Amb540893 [0,1,0,1,0,0|2,0,0]=4 6542 B11R1.3 NC[C@H]1CC[C@H](C(N)=O)CC1 Amb25873866 [0,1,0,1,0,0|2,0,0]=4 6543 B11R1.3 NC[C@H]1CC[C@H](C(N)=O)CC1 Amb32663860 [0,1,0,1,0,0|2,0,0]=4 6544 B11R1.3 NC[C@H]1CO[C@H](C(=O)O)CO1 Amb28385581 [0,1,0,1,0,0|2,0,0]=4 6545 B11R1.3 NC[C@H]1OC[C@H](C(=O)O)CO1 Amb27231624 [0,1,0,1,0,0|2,0,0]=4 6546 B11R1.3 O=C(Cl)C1CCC(CF)CC1 Amb25152717 [0,1,0,1,0,0|2,0,0]=4 6547 B11R1.3 O=C(Cl)[C@H]1CC[C@H](CO)CC1 Amb27829888 [0,1,0,1,0,0|2,0,0]=4 6548 B11R1.3 O=C(O)C1CCC(CO)CC1 Amb7089021 [0,1,0,1,0,0|2,0,0]=4 6549 B11R1.3 O=C(O)C1CCC(CO)NC1 Amb27880322 [0,1,0,1,0,0|2,0,0]=4 6550 B11R1.3 O=C(O)[C@H]1CC[C@@H](CO)CC1 Amb28254647 [0,1,0,1,0,0|2,0,0]=4 6551 B11R1.3 O=C(O)[C@H]1CC[C@H](CF)CC1 Amb25351015 [0,1,0,1,0,0|2,0,0]=4 6552 B11R1.3 O=C(O)[C@H]1CC[C@H](CO)CC1 Amb22750650 [0,1,0,1,0,0|2,0,0]=4 6553 B11R1.124 CC(=O)N1CCC(CCN)C1 Amb25359298 [0,1,0,1,0,0|2,0,0]=4 6554 B11R1.124 CCCC1=NC(C(=O)O)CO1 Amb27965418 [0,1,0,1,0,0|1,0,1]=4 6555 B11R1.124 CCCC1=N[C@H](C(=O)O)CO1 Amb26880393 [0,1,0,1,0,0|1,0,1]=4 6556 B11R1.124 CCCC1CC(C(=O)O)CO1 Amb27791855 [0,1,0,1,0,0|1,0,0]=3 6557 B11R1.124 CCCC1CCC(C(=O)O)O1 Amb27857074 [0,1,0,1,0,0|2,0,0]=4 6558 B11R1.124 CCCC1CC[C@@H](C(=O)O)N1 Amb27478099 [0,1,0,1,0,0|2,0,0]=4 6559 B11R1.124 CCCN1CCC(C(=O)O)C1 Amb18302805 [0,1,0,1,0,0|2,0,0]=4 6560 B11R1.124 CCCN1CCC(C(C)=O)C1 Amb24722835 [0,1,0,1,0,0|1,0,0]=3 6561 B11R1.124 CCC[C@@H]1CC[C@@H](C(=O)Cl)C1 Amb25335438 [0,1,0,1,0,0|2,0,0]=4 6562 B11R1.124 CCC[C@@H]1CC[C@@H](C(=O)O)N1 Amb28400213 [0,1,0,1,0,0|2,0,0]=4 6563 B11R1.124 CCNC1CCN(C(C)=O)C1 Amb10844682 [0,1,0,1,0,0|2,0,0]=4 6564 B11R1.124 CCN[C@@H]1CCN(C(C)=O)C1 Amb22227492 [0,1,0,1,0,0|2,0,0]=4 6565 B11R1.124 CCN[C@H]1CCN(C(C)=O)C1 Amb22227528 [0,1,0,1,0,0|2,0,0]=4 6566 B11R1.124 CCOC1CC(C(=O)O)NO1 Amb27176586 [0,1,0,1,0,0|2,0,0]=4 6567 B11R1.124 CCO[C@@H]1C[C@H](C(=O)O)NO1 Amb27634891 [0,1,0,1,0,0|2,0,0]=4 6568 B11R1.124 CNCC1CCN(C(C)=O)C1 Amb21861189 [0,1,0,1,0,0|2,0,0]=4 6569 B11R1.124 CNCC1CCN(C(C)=O)C1 Amb30584638 [0,1,0,1,0,0|2,0,0]=4 6570 B11R1.124 COCC1CCC(C(=O)O)C1 Amb25780193 [0,1,0,1,0,0|2,0,0]=4 6571 B11R1.124 COC[C@@H]1CC[C@H](C(=O)O)C1 Amb27768044 [0,1,0,1,0,0|2,0,0]=4 6572 B11R1.124 COC[C@H]1CC[C@@H](C(=O)O)C1 Amb27781461 [0,1,0,1,0,0|2,0,0]=4 6573 B11R1.124 CSCC1CC(C(=O)O)CS1 Amb27176550 [0,1,0,1,0,0|1,1,0]=4 6574 B11R1.124 CSCC1CC(C(C)=O)=NO1 Amb28131941 [0,1,0,1,0,0|1,0,1]=4 6575 B11R1.124 O=C(O)C1CSC(CCS)C1 Amb27955882 [0,1,0,1,0,0|1,1,0]=4 6576 B11R1.134 CCCC1OC1(CC)C(N)=O Amb26660602 [0,1,0,1,0,0|2,0,0]=4 6577 B11R1.134 CNCC1CC1(CO)C(C)C Amb33133219 [0,1,0,1,0,0|1,0,1]=4 6578 B11R1.159 CC(=O)C1CCCC(C)=C1C Amb28201049 [0,1,0,1,0,0|1,0,1]=4 6579 B11R1.159 CC(=O)C1CCCC(Cl)C1=O Amb28384112 [0,1,0,1,0,0|0,0,2]=4 6580 B11R1.159 CC(=O)C1CCCC(O)C1O Amb27599413 [0,1,0,1,0,0|0,0,0]=2 6581 B11R1.159 CC(=O)C1CCCN(C)C1=O Amb27256583 [0,1,0,1,0,0|0,0,2]=4 6582 B11R1.159 CC(=O)C1CCCN(C)C1C Amb26496854 [0,1,0,1,0,0|1,0,0]=3 6583 B11R1.159 CC(=O)N1CCC[C@@H](N)[C@H]1C Amb27186981 [0,1,0,1,0,0|2,0,0]=4 6584 B11R1.159 CC(=O)N1CCOC(C)C1C Amb27840247 [0,1,0,1,0,0|2,0,0]=4 6585 B11R1.159 CC(=O)[C@H]1CCC=C(C)[C@@H]1C Amb28429598 [0,1,0,1,0,0|1,0,1]=4 6586 B11R1.159 CC(=O)[C@H]1CCCC(=O)[C@@H]1C Amb28194631 [0,1,0,1,0,0|1,0,1]=4 6587 B11R1.159 CC(C)C1CCCC(C)C1O Amb27970571 [0,1,0,1,0,0|1,0,1]=4 6588 B11R1.159 CC(C)C1CCCC(O)C1O Amb27176392 [0,1,0,1,0,0|1,0,1]=4 6589 B11R1.159 CC(C)[C@@H]1CCC[C@H](O)[C@H]1O Amb27974548 [0,1,0,1,0,0|1,0,1]=4 6590 B11R1.159 CC1C(Cl)CCCC1C(=O)Cl Amb27872344 [0,1,0,1,0,0|2,0,0]=4 6591 B11R1.159 CC1C(N)CCCC1C(N)=O Amb18182134 [0,1,0,1,0,0|2,0,0]=4 6592 B11R1.159 CC1CCCC(C(=O)O)C1N Amb28132204 [0,1,0,1,0,0|2,0,0]=4 6593 B11R1.159 CC1CCCC(C(N)=O)C1C Amb25100897 [0,1,0,1,0,0|2,0,0]=4 6594 B11R1.159 CC1CCC[C@H](N(C)C)[C@H]1O Amb27218982 [0,1,0,1,0,0|2,0,0]=4 6595 B11R1.159 CC1NCCC(C(=O)O)C1C Amb28136882 [0,1,0,1,0,0|2,0,0]=4 6596 B11R1.159 C[C@@H]1CNC[C@H](C(=O)O)[C@@H]1O Amb27233628 [0,1,0,1,0,0|1,0,0]=3 6597 B11R1.159 C[C@@H]1[C@@H](C(=O)O)CCCN1C Amb18199985 [0,1,0,1,0,0|2,0,0]=4 6598 B11R1.159 C[C@H](O)[C@H]1CCC[C@@H](O)[C@H]1O Amb27631311 [0,1,0,1,0,0|0,0,2]=4 6599 B11R1.159 C[C@H]1[C@@H](O)CCC[C@H]1C(=O)O Amb28051870 [0,1,0,1,0,0|2,0,0]=4 6600 B11R1.159 NC1CCCC(C(=O)O)C1O Amb27237633 [0,1,0,1,0,0|1,0,0]=3 6601 B11R1.159 N[C@H]1CCC[C@H](C(=O)O)[C@@H]1O Amb24557744 [0,1,0,1,0,0|1,0,0]=3 6602 B11R1.159 N[C@H]1[C@@H](C(=O)O)CCC[C@H]1O Amb27640678 [0,1,0,1,0,0|2,0,0]=4 6603 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@@H]1O Amb28457421 [0,1,0,1,0,0|2,0,0]=4 6604 B11R1.159 O=C(O)[C@H]1NCC[C@@H](O)[C@H]1O Amb27860415 [0,1,0,1,0,0|2,0,0]=4 6605 B11R1.180 C#CCCCC1COCC1=O Amb35608520 [0,1,0,1,0,0|0,0,1]=3 6606 B11R1.180 C=CCCCC1CCCC1=O Amb27271584 [0,1,0,1,0,0|1,0,1]=4 6607 B11R1.180 C=CCCC[C@@H]1CCCC1=O Amb28080270 [0,1,0,1,0,0|1,0,1]=4 6608 B11R1.180 CC#CCCC1COCC1=O Amb35639032 [0,1,0,1,0,0|0,0,1]=3 6609 B11R1.180 CCC#CCC1CCCC1=O Amb27791342 [0,1,0,1,0,0|1,0,1]=4 6610 B11R1.180 CCCCCC1=COCC1=O Amb27672330 [0,1,0,1,0,0|0,0,2]=4 6611 B11R1.180 CCCCCC1C=CCC1=O Amb27672594 [0,1,0,1,0,0|1,0,1]=4 6612 B11R1.180 CCCCCC1CC=CC1=O Amb17843926 [0,1,0,1,0,0|1,0,1]=4 6613 B11R1.180 CCCCCC1CCCC1=O Amb534714 [0,1,0,1,0,0|1,0,0]=3 6614 B11R1.180 CCCCCC1COCC1=O Amb27672690 [0,1,0,1,0,0|0,0,0]=2 6615 B11R1.180 CCCCCC1COCC1O Amb32945486 [0,1,0,1,0,0|0,0,2]=4 6616 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [0,1,0,1,0,0|2,0,0]=4 6617 B11R1.180 CCCCC[C@@H]1COC[C@H]1O Amb32945059 [0,1,0,1,0,0|0,0,2]=4 6618 B11R1.180 CCCCNC1COCC1Cl Amb27674030 [0,1,0,1,0,0|1,0,1]=4 6619 B11R1.180 CCCCNC1COCC1O Amb19006705 [0,1,0,1,0,0|0,0,2]=4 6620 B11R1.180 CCCCN[C@@H]1COC[C@H]1O Amb27674041 [0,1,0,1,0,0|0,0,2]=4 6621 B11R1.180 CCCCOC1COCC1Br Amb27269074 [0,1,0,1,0,0|1,0,1]=4 6622 B11R1.180 CCCCOC1COCC1I Amb27269075 [0,1,0,1,0,0|1,0,1]=4 6623 B11R1.180 CCCCOC1COCC1O Amb27673883 [0,1,0,1,0,0|0,0,2]=4 6624 B11R1.180 CCCCOC1OCCC1=O Amb27673554 [0,1,0,1,0,0|2,0,0]=4 6625 B11R1.180 CCCCSC1COCC1O Amb27987624 [0,1,0,1,0,0|0,0,2]=4 6626 B11R1.180 CCCC\C=C1\CCCC1=O Amb533060 [0,1,0,1,0,0|1,0,1]=4 6627 B11R1.180 CCCNCC1COCC1N Amb27492039 [0,1,0,1,0,0|1,0,1]=4 6628 B11R1.180 CCCOCC1CCCC1=O Amb27987801 [0,1,0,1,0,0|1,0,0]=3 6629 B11R1.180 CCCOCC1COCC1O Amb32944802 [0,1,0,1,0,0|0,0,2]=4 6630 B11R1.180 CCCOC[C@@H]1COC[C@H]1O Amb32945951 [0,1,0,1,0,0|0,0,2]=4 6631 B11R1.180 CCNCCC1CCNC1=O Amb27674171 [0,1,0,1,0,0|2,0,0]=4 6632 B11R1.180 CCOCCC1CC=CC1=O Amb27672318 [0,1,0,1,0,0|1,0,1]=4 6633 B11R1.180 CCSCCC1CCCC1=O Amb27269774 [0,1,0,1,0,0|1,0,0]=3 6634 B11R1.180 CCSCCC1CSCC1=O Amb27271770 [0,1,0,1,0,0|0,1,0]=3 6635 B11R1.180 CC\C=C/CC1CCCC1=O Amb27272751 [0,1,0,1,0,0|1,0,1]=4 6636 B11R1.180 CC\C=C\CC1CCCC1=O Amb26923884 [0,1,0,1,0,0|1,0,1]=4 6637 B11R1.180 CNCCCN1CCCC1=O Amb19015452 [0,1,0,1,0,0|2,0,0]=4 6638 B11R1.180 COCCCC1COCC1O Amb32944212 [0,1,0,1,0,0|0,0,2]=4 6639 B11R1.180 COCCCN1CCCC1=O Amb24064201 [0,1,0,1,0,0|2,0,0]=4 6640 B11R1.180 COCCC[C@@H]1COC[C@H]1O Amb32944812 [0,1,0,1,0,0|0,0,2]=4 6641 B11R1.180 CSCCCC1CSCC1=O Amb27271771 [0,1,0,1,0,0|0,1,0]=3 6642 B11R1.180 CSCCSC1CCCC1=O Amb28079899 [0,1,0,1,0,0|2,0,0]=4 6643 B11R1.180 N#CCCCC1CCCC1=O Amb25717939 [0,1,0,1,0,0|1,0,1]=4 6644 B11R1.180 NCCCCN1CCCC1=O Amb6244615 [0,1,0,1,0,0|2,0,0]=4 6645 B11R1.180 O=C1CCCC1CCCCBr Amb27672177 [0,1,0,1,0,0|1,0,0]=3 6646 B11R1.180 O=C1CCCC1CCCCF Amb27267015 [0,1,0,1,0,0|1,0,0]=3 6647 B11R1.180 O=C1CCCC1CCCCO Amb27986534 [0,1,0,1,0,0|1,0,0]=3 6648 B11R1.180 O=C1CCCC1SCCCO Amb27271109 [0,1,0,1,0,0|2,0,0]=4 6649 B11R1.180 O=C1CCCN1CCCCBr Amb33545934 [0,1,0,1,0,0|2,0,0]=4 6650 B11R1.180 O=C1CCCN1CCCCCl Amb18184015 [0,1,0,1,0,0|2,0,0]=4 6651 B11R1.180 O=C1CSCC1CCCCF Amb27267016 [0,1,0,1,0,0|0,1,0]=3 6652 B11R1.180 O=C1OCCC1CCCCO Amb27989920 [0,1,0,1,0,0|2,0,0]=4 6653 B11R1.187 CCC1CC(COC)CC1=O Amb35602028 [0,1,0,1,0,0|1,0,0]=3 6654 B11R1.187 CCCC1CC(=O)C(CO)C1 Amb27861371 [0,1,0,1,0,0|0,0,0]=2 6655 B11R1.187 CCCC1CC(=O)N(CN)C1 Amb28255522 [0,1,0,1,0,0|2,0,0]=4 6656 B11R1.187 CCCC1CC(=O)N(CO)C1 Amb28207339 [0,1,0,1,0,0|1,0,0]=3 6657 B11R1.187 CCCC1CC(CO)C(=O)O1 Amb27829894 [0,1,0,1,0,0|1,0,0]=3 6658 B11R1.187 CCCC1CC(O)C(CO)O1 Amb27466863 [0,1,0,1,0,0|0,0,2]=4 6659 B11R1.187 CCN1CC(CCN)CC1=O Amb26040099 [0,1,0,1,0,0|2,0,0]=4 6660 B11R1.187 CCN1CC(CNC)CC1=O Amb8009578 [0,1,0,1,0,0|2,0,0]=4 6661 B11R1.279 CCC1CS(=O)C(CC)CN1 Amb27265383 [0,1,0,1,0,0|2,0,0]=4 6662 B11R1.279 CCN1CCC(CN)CC1=O Amb23586211 [0,1,0,1,0,0|2,0,0]=4 6663 B11R1.279 CCN1CCC(CO)C(O)C1 Amb27651289 [0,1,0,1,0,0|0,0,2]=4 6664 B11R1.279 CCN1CCC(NC)CC1=O Amb25083529 [0,1,0,1,0,0|2,0,0]=4 6665 B11R1.279 CCN1CCN(CC)C(=O)C1 Amb28286129 [0,1,0,1,0,0|2,0,0]=4 6666 B11R1.279 CC[C@H]1CN[C@H](CC)C(=O)N1 Amb27195018 [0,1,0,1,0,0|2,0,0]=4 6667 B11R1.279 COC1CCC(CO)C(C)C1 Amb28365788 [0,1,0,1,0,0|1,0,1]=4 6668 B11R1.298 CC(=O)C(C#N)C1CCCC1 Amb25922950 [0,1,0,1,0,0|1,0,1]=4 6669 B11R1.298 CC(=O)C(CO)N1CCCC1 Amb9783425 [0,1,0,1,0,0|0,0,0]=2 6670 B11R1.298 CC(C)C(CO)C1CCCO1 Amb27843665 [0,1,0,1,0,0|1,0,1]=4 6671 B11R1.298 CC(C)C(CO)C1CCOC1 Amb28286739 [0,1,0,1,0,0|1,0,1]=4 6672 B11R1.298 CC(N)C(CO)N1CCCC1 Amb27985285 [0,1,0,1,0,0|1,0,1]=4 6673 B11R1.298 CCC(C(=O)O)C1CCCC1 Amb18125995 [0,1,0,1,0,0|2,0,0]=4 6674 B11R1.298 CCC(C(=O)O)C1CCCS1 Amb33416231 [0,1,0,1,0,0|2,0,0]=4 6675 B11R1.298 CCC(C(=O)O)C1CCOC1 Amb24701743 [0,1,0,1,0,0|2,0,0]=4 6676 B11R1.298 CCC(C(=O)O)C1CCSC1 Amb18197515 [0,1,0,1,0,0|2,0,0]=4 6677 B11R1.298 CCC(C(=O)O)N1CCCC1 Amb17622083 [0,1,0,1,0,0|2,0,0]=4 6678 B11R1.298 CCC(C(=O)O)N1CCCC1 Amb7089125 [0,1,0,1,0,0|2,0,0]=4 6679 B11R1.298 CCC(C(C)=O)C1CCSC1 Amb35697109 [0,1,0,1,0,0|1,0,0]=3 6680 B11R1.298 CCC(C(N)=O)C1CCNC1 Amb27240213 [0,1,0,1,0,0|2,0,0]=4 6681 B11R1.298 CCC(C(N)=O)N1CCCC1 Amb18787642 [0,1,0,1,0,0|2,0,0]=4 6682 B11R1.298 CCN(C(C)=O)C1CCNC1 Amb2684245 [0,1,0,1,0,0|2,0,0]=4 6683 B11R1.298 CCN(C(C)=O)[C@@H]1CCNC1 Amb22274416 [0,1,0,1,0,0|2,0,0]=4 6684 B11R1.298 CCN(C(C)=O)[C@H]1CCNC1 Amb22274419 [0,1,0,1,0,0|2,0,0]=4 6685 B11R1.298 CC[C@@H](C(=O)O)N1CCCC1 Amb27864404 [0,1,0,1,0,0|2,0,0]=4 6686 B11R1.298 CC[C@@H](C(N)=O)N1CCCC1 Amb26633112 [0,1,0,1,0,0|2,0,0]=4 6687 B11R1.298 CC[C@H](C(=O)O)N1CCCC1 Amb28208723 [0,1,0,1,0,0|2,0,0]=4 6688 B11R1.298 COC(C(C)=O)C1CCOC1 Amb27172446 [0,1,0,1,0,0|2,0,0]=4 6689 B11R1.298 NC(=O)C(CO)C1CCCN1 Amb27225007 [0,1,0,1,0,0|1,0,0]=3 6690 B11R1.298 NCC(C(=O)O)C1CCCC1 Amb18830612 [0,1,0,1,0,0|2,0,0]=4 6691 B11R1.298 NCC(C(=O)O)C1CCCN1 Amb27623580 [0,1,0,1,0,0|2,0,0]=4 6692 B11R1.298 NCC(C(=O)O)C1CCCO1 Amb26530264 [0,1,0,1,0,0|2,0,0]=4 6693 B11R1.298 NCC(C(=O)O)C1CCCS1 Amb33416242 [0,1,0,1,0,0|2,0,0]=4 6694 B11R1.298 NCC(C(=O)O)C1CCNC1 Amb26653533 [0,1,0,1,0,0|2,0,0]=4 6695 B11R1.298 NCC(C(=O)O)C1CCOC1 Amb27160836 [0,1,0,1,0,0|2,0,0]=4 6696 B11R1.298 NCC(C(=O)O)C1CCSC1 Amb33141657 [0,1,0,1,0,0|2,0,0]=4 6697 B11R1.298 NCC(C(=O)O)N1CCCC1 Amb25761853 [0,1,0,1,0,0|2,0,0]=4 6698 B11R1.298 O=C(O)C(CF)C1CCCC1 Amb28140884 [0,1,0,1,0,0|2,0,0]=4 6699 B11R1.298 O=C(O)C(CO)C1CCCN1 Amb27209616 [0,1,0,1,0,0|1,0,0]=3 6700 B11R1.298 O=C(O)C(CO)N1CCCC1 Amb24405358 [0,1,0,1,0,0|1,0,0]=3 6701 B11R1.361 CCCCC1NC(=O)C1CC Amb27672451 [0,1,0,1,0,0|2,0,0]=4 6702 B11R1.361 CCCC[C@@H]1NC(=O)[C@@H]1CC Amb28080164 [0,1,0,1,0,0|2,0,0]=4 6703 B11R1.361 CCCC[C@@H]1NC(=O)[C@H]1CC Amb28080163 [0,1,0,1,0,0|2,0,0]=4 6704 B11R1.361 CCCOC1CC(=O)C1OC Amb27818707 [0,1,0,1,0,0|2,0,0]=4 6705 B11R1.361 O=C1NC(OCCO)C1CO Amb27673664 [0,1,0,1,0,0|2,0,0]=4 6706 B11R1.466 COCC[C@H]1[C@@H](CO)C1(C)C Amb27989513 [0,1,0,1,0,0|1,0,1]=4 6707 B11R1.473 CC(=O)N1CCC(CCl)C1C Amb27431932 [0,1,0,1,0,0|2,0,0]=4 6708 B11R1.473 CCC1CCC(C(=O)O)C1N Amb27596871 [0,1,0,1,0,0|2,0,0]=4 6709 B11R1.473 CCC1CCN(C(C)=O)C1C Amb28400608 [0,1,0,1,0,0|2,0,0]=4 6710 B11R1.473 CCN1CCC(C(C)=O)C1=O Amb27630227 [0,1,0,1,0,0|0,0,2]=4 6711 B11R1.473 CC[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb28052145 [0,1,0,1,0,0|2,0,0]=4 6712 B11R1.473 CC[C@H]1ON=C(C(C)=O)[C@@H]1C Amb28199975 [0,1,0,1,0,0|1,0,1]=4 6713 B11R1.473 CNC1CCC(S(C)=O)C1C Amb28204675 [0,1,0,1,0,0|2,0,0]=4 6714 B11R1.473 CN[C@@H]1CC[C@@H](C(N)=O)[C@@H]1O Amb30530092 [0,1,0,1,0,0|1,0,0]=3 6715 B11R1.473 COC1CCC(C(=O)O)C1N Amb27437876 [0,1,0,1,0,0|2,0,0]=4 6716 B11R1.473 COC1OCC(C(C)=O)C1C Amb28460747 [0,1,0,1,0,0|1,0,0]=3 6717 B11R1.473 CO[C@H]1CC[C@@H](C(=O)O)[C@@H]1N Amb27666963 [0,1,0,1,0,0|2,0,0]=4 6718 B11R1.473 CO[C@H]1OC[C@H](C(C)=O)[C@@H]1C Amb27788470 [0,1,0,1,0,0|1,0,0]=3 6719 B11R1.477 CC(=O)C1CC(CC=O)C1C Amb26965087 [0,1,0,1,0,0|1,0,1]=4 6720 B11R1.616 CC1(C)[C@@H](CO)C[C@H]1CCO Amb28069651 [0,1,0,1,0,0|1,0,1]=4 6721 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [0,1,0,1,0,0|1,0,1]=4 6722 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [0,1,0,1,0,0|1,0,1]=4 6723 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [0,1,0,1,0,0|1,0,0]=3 6724 B11R1.706 CC(=O)N1CC=CCCCC1 Amb26880196 [0,1,0,1,0,0|2,0,0]=4 6725 B11R1.706 CN(C)C1CCCCCOC1 Amb22364642 [0,1,0,1,0,0|2,0,0]=4 6726 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [0,1,0,1,0,0|2,0,0]=4 6727 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|2,0,0]=4 6728 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,1,0,1,0,0|2,0,0]=4 6729 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,1,0,1,0,0|2,0,0]=4 6730 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,1,0,1,0,0|2,0,0]=4 6731 B11R1.944 CC1(O)CCCCOC1CO Amb27206789 [0,1,0,1,0,0|0,0,2]=4 6732 B11R1.944 C[C@@]1(O)CCCCO[C@H]1CO Amb27452368 [0,1,0,1,0,0|0,0,2]=4 6733 B11R1.949 CCN1CCNC(C)CC1=O Amb26489162 [0,1,0,1,0,0|2,0,0]=4 6734 B11R1.991 C#CCCCC1(C(C)=O)CC1 Amb27492159 [0,1,0,1,0,0|1,0,1]=4 6735 B11R1.991 CCCCCC1(C(=O)O)CC1 Amb32426134 [0,1,0,1,0,0|2,0,0]=4 6736 B11R1.991 CCCOCC1(C(=O)O)CC1 Amb23556061 [0,1,0,1,0,0|2,0,0]=4 6737 B11R1.991 CCC\C=C\C1(C(C)=O)CC1 Amb33373748 [0,1,0,1,0,0|1,0,1]=4 6738 B11R1.991 CCSCCC1(C(=O)O)CC1 Amb33171644 [0,1,0,1,0,0|2,0,0]=4 6739 B11R1.991 COCCCC1(C(=O)O)CC1 Amb31378613 [0,1,0,1,0,0|2,0,0]=4 6740 B11R1.991 CSCCCC1(C(=O)O)CC1 Amb33474202 [0,1,0,1,0,0|2,0,0]=4 6741 B11R1.1035 CCNCCC(CO)C1CC1 Amb33133734 [0,1,0,1,0,0|1,0,1]=4 6742 B11R1.1064 CC(=O)C1(C#N)CCCC1C Amb28365382 [0,1,0,1,0,0|1,0,1]=4 6743 B11R1.1064 CC(=O)C1(CO)CCCC1=O Amb27457609 [0,1,0,1,0,0|0,0,1]=3 6744 B11R1.1064 CC(C)C1(CO)CCCC1O Amb25798993 [0,1,0,1,0,0|1,0,1]=4 6745 B11R1.1064 CC(C)[C@@]1(CO)CCC[C@H]1O Amb27201251 [0,1,0,1,0,0|1,0,1]=4 6746 B11R1.1064 CC1CCCC1(CN)C(=O)O Amb24702744 [0,1,0,1,0,0|2,0,0]=4 6747 B11R1.1064 CCC1(C(=O)O)CCCC1C Amb28319268 [0,1,0,1,0,0|2,0,0]=4 6748 B11R1.1064 CCC1(C(=O)O)CCCC1N Amb33232159 [0,1,0,1,0,0|2,0,0]=4 6749 B11R1.1064 CCC1(C(N)=O)CCCC1C Amb25707910 [0,1,0,1,0,0|2,0,0]=4 6750 B11R1.1074 C#CC1(C(C)=O)CCCCC1 Amb24529793 [0,1,0,1,0,0|1,0,1]=4 6751 B11R1.1074 C=C(C)C1(CN)CCCCC1 Amb33199961 [0,1,0,1,0,0|2,0,0]=4 6752 B11R1.1074 C=C(C)C1(CO)CCCCC1 Amb28321319 [0,1,0,1,0,0|1,0,0]=3 6753 B11R1.1074 CC(=O)C1(CN)CCCCC1 Amb24445563 [0,1,0,1,0,0|1,0,0]=3 6754 B11R1.1074 CC(=O)C1(CN)CCCOC1 Amb33307697 [0,1,0,1,0,0|1,0,0]=3 6755 B11R1.1074 CC(=O)C1(CN)CCOCC1 Amb33447094 [0,1,0,1,0,0|1,0,0]=3 6756 B11R1.1074 CC(=O)C1(CO)CCCCC1 Amb27961461 [0,1,0,1,0,0|0,0,0]=2 6757 B11R1.1074 CC(=O)C1(OCl)CCCCC1 Amb28122366 [0,1,0,1,0,0|2,0,0]=4 6758 B11R1.1074 CC(C)C1(CO)CCCCO1 Amb27645815 [0,1,0,1,0,0|1,0,1]=4 6759 B11R1.1074 CC(C)C1(CO)CCCNC1 Amb28652970 [0,1,0,1,0,0|1,0,1]=4 6760 B11R1.1074 CCC1(C(=O)O)CCCCC1 Amb1016524 [0,1,0,1,0,0|2,0,0]=4 6761 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb15701483 [0,1,0,1,0,0|2,0,0]=4 6762 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb19892167 [0,1,0,1,0,0|2,0,0]=4 6763 B11R1.1074 CCC1(C(=O)O)CCCCO1 Amb26529853 [0,1,0,1,0,0|2,0,0]=4 6764 B11R1.1074 CCC1(C(=O)O)CCCNC1 Amb19516876 [0,1,0,1,0,0|2,0,0]=4 6765 B11R1.1074 CCC1(C(=O)O)CCCNC1 Amb21960031 [0,1,0,1,0,0|2,0,0]=4 6766 B11R1.1074 CCC1(C(=O)O)CCCOC1 Amb18288385 [0,1,0,1,0,0|2,0,0]=4 6767 B11R1.1074 CCC1(C(=O)O)CCNCC1 Amb15701262 [0,1,0,1,0,0|2,0,0]=4 6768 B11R1.1074 CCC1(C(=O)O)CCNCC1 Amb17622113 [0,1,0,1,0,0|2,0,0]=4 6769 B11R1.1074 CCC1(C(=O)O)CCOCC1 Amb18288039 [0,1,0,1,0,0|2,0,0]=4 6770 B11R1.1074 CCC1(C(C)=O)CCCNC1 Amb24509473 [0,1,0,1,0,0|1,0,0]=3 6771 B11R1.1074 CCC1(C(C)=O)CCNCC1 Amb25865677 [0,1,0,1,0,0|1,0,0]=3 6772 B11R1.1074 CCC1(C(C)=O)OCCCO1 Amb25918031 [0,1,0,1,0,0|2,0,0]=4 6773 B11R1.1074 CCC1(C(N)=O)CCCCC1 Amb26447680 [0,1,0,1,0,0|2,0,0]=4 6774 B11R1.1074 CCC1(C(N)=O)CCCNC1 Amb19517053 [0,1,0,1,0,0|2,0,0]=4 6775 B11R1.1074 CCC1(C(N)=O)CCCNC1 Amb22587485 [0,1,0,1,0,0|2,0,0]=4 6776 B11R1.1074 CCC1(C(N)=O)CCNCC1 Amb19516742 [0,1,0,1,0,0|2,0,0]=4 6777 B11R1.1074 CCC1(C(N)=O)CCNCC1 Amb22498835 [0,1,0,1,0,0|2,0,0]=4 6778 B11R1.1074 CN(C)C1(CO)CCCCC1 Amb24116821 [0,1,0,1,0,0|2,0,0]=4 6779 B11R1.1074 CN(C)C1(CO)CCNCC1 Amb24116845 [0,1,0,1,0,0|2,0,0]=4 6780 B11R1.1074 CN(C)C1(CO)CCOCC1 Amb24116824 [0,1,0,1,0,0|2,0,0]=4 6781 B11R1.1074 CN(C)C1(CO)CCSCC1 Amb24116828 [0,1,0,1,0,0|2,0,0]=4 6782 B11R1.1074 CNC1(C(C)=O)CCCCC1 Amb24406380 [0,1,0,1,0,0|2,0,0]=4 6783 B11R1.1074 COC1(C(C)=O)CCCCC1 Amb25730283 [0,1,0,1,0,0|2,0,0]=4 6784 B11R1.1074 COC1(C(C)=O)CCCNC1 Amb33131368 [0,1,0,1,0,0|2,0,0]=4 6785 B11R1.1074 COC1(C(C)=O)CCCSC1 Amb27408768 [0,1,0,1,0,0|2,0,0]=4 6786 B11R1.1074 COC1(C(C)=O)CCNCC1 Amb26373087 [0,1,0,1,0,0|2,0,0]=4 6787 B11R1.1074 COC1(C(C)=O)CCOCC1 Amb26488104 [0,1,0,1,0,0|2,0,0]=4 6788 B11R1.1074 COC1(C(C)=O)CCSCC1 Amb28076258 [0,1,0,1,0,0|2,0,0]=4 6789 B11R1.1074 CSC1(C(C)=O)CCCCC1 Amb27859434 [0,1,0,1,0,0|2,0,0]=4 6790 B11R1.1074 NC(=O)C1(CF)CCOCC1 Amb29837951 [0,1,0,1,0,0|2,0,0]=4 6791 B11R1.1074 NC(=S)C1(CO)CCOCC1 Amb33328381 [0,1,0,1,0,0|1,1,0]=4 6792 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb18959883 [0,1,0,1,0,0|2,0,0]=4 6793 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb22371113 [0,1,0,1,0,0|2,0,0]=4 6794 B11R1.1074 NCC1(C(=O)O)CCCNC1 Amb27630487 [0,1,0,1,0,0|2,0,0]=4 6795 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb26021711 [0,1,0,1,0,0|2,0,0]=4 6796 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb30584733 [0,1,0,1,0,0|2,0,0]=4 6797 B11R1.1074 NCC1(C(=O)O)CCNCC1 Amb26341115 [0,1,0,1,0,0|2,0,0]=4 6798 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb24077508 [0,1,0,1,0,0|2,0,0]=4 6799 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb8631333 [0,1,0,1,0,0|2,0,0]=4 6800 B11R1.1074 NCC1(C(N)=O)CCOCC1 Amb13951237 [0,1,0,1,0,0|2,0,0]=4 6801 B11R1.1074 NCC1(C(N)=O)CCOCC1 Amb7969483 [0,1,0,1,0,0|2,0,0]=4 6802 B11R1.1074 O=C(O)C1(CBr)CCCCC1 Amb27803027 [0,1,0,1,0,0|2,0,0]=4 6803 B11R1.1074 O=C(O)C1(CBr)CCOCC1 Amb28456754 [0,1,0,1,0,0|2,0,0]=4 6804 B11R1.1074 O=C(O)C1(CCl)CCCCC1 Amb27439666 [0,1,0,1,0,0|2,0,0]=4 6805 B11R1.1074 O=C(O)C1(CF)CCCCO1 Amb27647178 [0,1,0,1,0,0|2,0,0]=4 6806 B11R1.1074 O=C(O)C1(CF)CCNCC1 Amb27242582 [0,1,0,1,0,0|2,0,0]=4 6807 B11R1.1074 O=C(O)C1(CF)CCOCC1 Amb25348064 [0,1,0,1,0,0|2,0,0]=4 6808 B11R1.1074 O=C(O)C1(CO)CCCCC1 Amb17400032 [0,1,0,1,0,0|1,0,0]=3 6809 B11R1.1074 O=C(O)C1(CO)CCCNC1 Amb26000833 [0,1,0,1,0,0|1,0,0]=3 6810 B11R1.1074 O=C(O)C1(CO)CCCOC1 Amb26454809 [0,1,0,1,0,0|1,0,0]=3 6811 B11R1.1074 O=C(O)C1(CO)CCCSC1 Amb32946227 [0,1,0,1,0,0|1,0,0]=3 6812 B11R1.1074 O=C(O)C1(CO)CCNCC1 Amb28397256 [0,1,0,1,0,0|1,0,0]=3 6813 B11R1.1074 O=C(O)C1(CO)CCOCC1 Amb17400061 [0,1,0,1,0,0|1,0,0]=3 6814 B11R1.1074 O=C(O)C1(CO)CCSCC1 Amb32946216 [0,1,0,1,0,0|1,0,0]=3 6815 B11R1.5 C#CCN1CCCCCC1=O Amb18177185 [0,1,0,1,0,0|2,0,0]=4 6816 B11R1.5 C=C1CCCCCC1CCO Amb27829924 [0,1,0,1,0,0|1,0,0]=3 6817 B11R1.5 C=CCC1CCCCCC1=O Amb18181756 [0,1,0,1,0,0|1,0,0]=3 6818 B11R1.5 C=CCC1CCCCNC1=O Amb27869951 [0,1,0,1,0,0|2,0,0]=4 6819 B11R1.5 CN1CCCCCC1CCO Amb28126475 [0,1,0,1,0,0|2,0,0]=4 6820 B11R1.5 COCC1CCCCCC1O Amb26871984 [0,1,0,1,0,0|0,0,2]=4 6821 B11R1.5 COCC1CCCCNC1=O Amb25093894 [0,1,0,1,0,0|1,0,0]=3 6822 B11R1.5 COC[C@@H]1CCCCC[C@H]1O Amb33213541 [0,1,0,1,0,0|0,0,2]=4 6823 B11R1.5 CONC1CCCCNC1=O Amb28285365 [0,1,0,1,0,0|2,0,0]=4 6824 B11R1.5 N=C1CCCCCN1CCO Amb27757273 [0,1,0,1,0,0|2,0,0]=4 6825 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [0,1,0,1,0,0|1,0,0]=3 6826 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [0,1,0,1,0,0|2,0,0]=4 6827 B11R1.5 NCCN1CCCCCC1=O Amb6252150 [0,1,0,1,0,0|2,0,0]=4 6828 B11R1.5 NCCN1CCCCCC1=O Amb7969849 [0,1,0,1,0,0|2,0,0]=4 6829 B11R1.5 O=C1CCCCCC1CCO Amb27395084 [0,1,0,1,0,0|0,0,0]=2 6830 B11R1.5 O=C1CCCCCN1CCO Amb9370344 [0,1,0,1,0,0|1,0,0]=3 6831 B11R1.5 O=C1CCOCCN1CCO Amb26605397 [0,1,0,1,0,0|2,0,0]=4 6832 B11R1.5 O=C1NCCCCC1CCO Amb26456499 [0,1,0,1,0,0|1,0,0]=3 6833 B11R1.64 C=C(C)C1CCC(C)=C1CO Amb28370031 [0,1,0,1,0,0|1,0,1]=4 6834 B11R1.64 C=C(C)C1CCC(C)C1C=O Amb27238520 [0,1,0,1,0,0|1,0,1]=4 6835 B11R1.64 C=C(C)[C@@H]1CC[C@@H](C)[C@@H]1C=O Amb27788125 [0,1,0,1,0,0|1,0,1]=4 6836 B11R1.64 C=C(C)[C@@H]1CC[C@@H](C)[C@H]1CO Amb28248783 [0,1,0,1,0,0|1,0,0]=3 6837 B11R1.64 C=C(C)[C@@H]1CC[C@H](C)[C@H]1C=O Amb27210240 [0,1,0,1,0,0|1,0,1]=4 6838 B11R1.64 C=C(C)[C@@H]1CC[C@H](C)[C@H]1CO Amb27422433 [0,1,0,1,0,0|1,0,0]=3 6839 B11R1.64 C=C(C)[C@H]1CCC(C)=C1CO Amb27598588 [0,1,0,1,0,0|1,0,1]=4 6840 B11R1.64 C=C(C)[C@H]1CC[C@H](C)[C@@H]1C=O Amb28052647 [0,1,0,1,0,0|1,0,1]=4 6841 B11R1.64 C=C(C)[C@H]1CC[C@H](C)[C@@H]1CO Amb27652913 [0,1,0,1,0,0|1,0,0]=3 6842 B11R1.64 CC(=O)N1CCC(C)C1CCl Amb28291241 [0,1,0,1,0,0|2,0,0]=4 6843 B11R1.64 CC(=O)N1CC[C@@H](O)[C@H]1CO Amb27662324 [0,1,0,1,0,0|2,0,0]=4 6844 B11R1.64 CC(C)=C1CC[C@@H](C)[C@@H]1CO Amb28053557 [0,1,0,1,0,0|1,0,1]=4 6845 B11R1.64 CC(C)[C@@H]1CC[C@H](C)C1CO Amb28435967 [0,1,0,1,0,0|1,0,1]=4 6846 B11R1.64 CC(C)[C@@H]1CC[C@H](C)[C@@H]1CO Amb27184276 [0,1,0,1,0,0|1,0,1]=4 6847 B11R1.64 CC1CCC(C(=O)O)C1CN Amb20623956 [0,1,0,1,0,0|2,0,0]=4 6848 B11R1.64 CC1CCN(C(N)=O)C1CO Amb27251442 [0,1,0,1,0,0|2,0,0]=4 6849 B11R1.64 CC1CCN(S(C)=O)C1CO Amb27250307 [0,1,0,1,0,0|2,0,0]=4 6850 B11R1.81 C#CCN1CCC(C)CC1=O Amb27233814 [0,1,0,1,0,0|2,0,0]=4 6851 B11R1.81 CC1CCN(CC#N)C(=O)C1 Amb28280194 [0,1,0,1,0,0|2,0,0]=4 6852 B11R1.81 CC1CCN(CCBr)C(=O)C1 Amb27830982 [0,1,0,1,0,0|2,0,0]=4 6853 B11R1.81 CC1CCN(CCN)C(=O)C1 Amb28119431 [0,1,0,1,0,0|2,0,0]=4 6854 B11R1.81 CC1CCN(CCO)C(=O)C1 Amb27860138 [0,1,0,1,0,0|1,0,0]=3 6855 B11R1.81 CC1CNC(CCO)C(=O)O1 Amb27782077 [0,1,0,1,0,0|2,0,0]=4 6856 B11R1.81 CC\C=C1\CCC(C)CC1=O Amb28052203 [0,1,0,1,0,0|1,0,1]=4 6857 B11R1.81 CC\C=C1\CC[C@@H](C)CC1=O Amb28386604 [0,1,0,1,0,0|1,0,1]=4 6858 B11R1.81 CN1CCC(CCN)C(=O)C1 Amb18200165 [0,1,0,1,0,0|2,0,0]=4 6859 B11R1.126 CC1CCC(CCO)C1(C)C Amb23589637 [0,1,0,1,0,0|1,0,1]=4 6860 B11R1.185 CCC1CC(=O)N(CCN)C1 Amb28042618 [0,1,0,1,0,0|2,0,0]=4 6861 B11R1.185 CCC1OC(=O)C(CCO)O1 Amb27972455 [0,1,0,1,0,0|2,0,0]=4 6862 B11R1.185 CC[C@@H]1OC(=O)[C@H](CCO)O1 Amb27218885 [0,1,0,1,0,0|2,0,0]=4 6863 B11R1.185 CC[C@H]1OC(=O)[C@H](CCO)O1 Amb28065369 [0,1,0,1,0,0|2,0,0]=4 6864 B11R1.191 COCC1CCCCC1(C)O Amb32945980 [0,1,0,1,0,0|0,0,2]=4 6865 B11R1.191 COC[C@@H]1CCCC[C@@]1(C)O Amb33212847 [0,1,0,1,0,0|0,0,2]=4 6866 B11R1.191 NOCC1CCCCS1(=O)=O Amb35673022 [0,1,0,1,0,0|2,0,0]=4 6867 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,1,0,1,0,0|2,0,0]=4 6868 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [0,1,0,1,0,0|2,0,0]=4 6869 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [0,1,0,1,0,0|2,0,0]=4 6870 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [0,1,0,1,0,0|2,0,0]=4 6871 B11R1.193 CCCC1COCC1C(=O)O Amb27864218 [0,1,0,1,0,0|1,0,0]=3 6872 B11R1.193 CCCC1COCC1C(C)=O Amb29882922 [0,1,0,1,0,0|0,0,0]=2 6873 B11R1.193 CCCC1COCC1C(C)Br Amb35632065 [0,1,0,1,0,0|1,0,1]=4 6874 B11R1.193 CCCC1COCC1C(C)Cl Amb35632064 [0,1,0,1,0,0|1,0,1]=4 6875 B11R1.193 CCCC1COCC1C(C)N Amb35646798 [0,1,0,1,0,0|1,0,1]=4 6876 B11R1.193 CCCC1COCC1C(C)O Amb35651594 [0,1,0,1,0,0|0,0,2]=4 6877 B11R1.193 CCCC1COCC1N(C)N Amb35652377 [0,1,0,1,0,0|2,0,0]=4 6878 B11R1.193 CCCC1SCCN1C(C)=O Amb28061197 [0,1,0,1,0,0|1,1,0]=4 6879 B11R1.193 CCC[C@@H]1CC=C[C@H]1C(C)=O Amb27629704 [0,1,0,1,0,0|1,0,1]=4 6880 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,1,0,1,0,0|2,0,0]=4 6881 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [0,1,0,1,0,0|2,0,0]=4 6882 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992396 [0,1,0,1,0,0|2,0,0]=4 6883 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992397 [0,1,0,1,0,0|2,0,0]=4 6884 B11R1.193 CCNC1COCC1C(C)=O Amb25698028 [0,1,0,1,0,0|1,0,0]=3 6885 B11R1.193 CCOC1CNCC1C(C)=O Amb29869780 [0,1,0,1,0,0|2,0,0]=4 6886 B11R1.254 O=C(O)C1CC(CO)C1CO Amb28240361 [0,1,0,1,0,0|2,0,0]=4 6887 B11R1.339 C=CCC1C(=O)CC1OCC Amb27672479 [0,1,0,1,0,0|2,0,0]=4 6888 B11R1.339 C=CC[C@@H]1C(=O)C[C@H]1OCC Amb27672553 [0,1,0,1,0,0|2,0,0]=4 6889 B11R1.339 C=CC[C@H]1C(=O)C[C@H]1OCC Amb27672554 [0,1,0,1,0,0|2,0,0]=4 6890 B11R1.339 CCCC1C(=O)CC1OCC Amb27271728 [0,1,0,1,0,0|2,0,0]=4 6891 B11R1.339 CCCC1NC(=O)C1CCC Amb27673659 [0,1,0,1,0,0|2,0,0]=4 6892 B11R1.339 CCC[C@@H]1C(=O)C[C@H]1OCC Amb27672555 [0,1,0,1,0,0|2,0,0]=4 6893 B11R1.339 CCC[C@H]1C(=O)C[C@H]1OCC Amb27672556 [0,1,0,1,0,0|2,0,0]=4 6894 B11R1.339 CCO[C@@H]1CC(=O)[C@@H]1OCC Amb27673708 [0,1,0,1,0,0|2,0,0]=4 6895 B11R1.760 CCCC(C(=O)O)C1CCC1 Amb23590263 [0,1,0,1,0,0|2,0,0]=4 6896 B11R1.760 CS(=O)N(CCO)C1CCC1 Amb27272559 [0,1,0,1,0,0|2,0,0]=4 6897 B11R1.760 CSCC(C(=O)O)C1CCC1 Amb28079649 [0,1,0,1,0,0|1,1,0]=4 6898 B11R1.767 COCC1(C(=O)O)CC1CO Amb32947213 [0,1,0,1,0,0|2,0,0]=4 6899 B11R1.773 CC(N)C1(CCO)CCC1C Amb28365737 [0,1,0,1,0,0|1,0,1]=4 6900 B11R1.773 CCNC1(C(N)=O)CCC1C Amb27167267 [0,1,0,1,0,0|2,0,0]=4 6901 B11R1.773 CCSC1(C(=O)O)CCC1C Amb25739212 [0,1,0,1,0,0|2,0,0]=4 6902 B11R1.806 C#CCN(CC1CC1)C(C)=O Amb27673867 [0,1,0,1,0,0|2,0,0]=4 6903 B11R1.806 CCN[C@H](CC1CC1)C(=O)O Amb33347503 [0,1,0,1,0,0|2,0,0]=4 6904 B11R1.806 COCC(NC1CC1)C(=O)O Amb28652825 [0,1,0,1,0,0|2,0,0]=4 6905 B11R1.905 CCCCC1(C(=O)Cl)CCC1 Amb25383048 [0,1,0,1,0,0|2,0,0]=4 6906 B11R1.905 CCCCC1(C(=O)O)CCC1 Amb26069896 [0,1,0,1,0,0|2,0,0]=4 6907 B11R1.905 CCCNC1(C(=O)O)COC1 Amb27491917 [0,1,0,1,0,0|2,0,0]=4 6908 B11R1.905 CCCNC1(C(N)=O)COC1 Amb27491920 [0,1,0,1,0,0|2,0,0]=4 6909 B11R1.905 CCCOC1(C(=O)O)COC1 Amb32939507 [0,1,0,1,0,0|2,0,0]=4 6910 B11R1.1239 C#CCC1(C(=O)O)CCCC1 Amb25893086 [0,1,0,1,0,0|2,0,0]=4 6911 B11R1.1239 C=CCC1(C(=O)O)CCCC1 Amb25975378 [0,1,0,1,0,0|2,0,0]=4 6912 B11R1.1239 C=CCC1(C(C)=O)CCCC1 Amb25859995 [0,1,0,1,0,0|1,0,0]=3 6913 B11R1.1239 CC(=O)C1(CC=O)CCCC1 Amb25318829 [0,1,0,1,0,0|0,0,1]=3 6914 B11R1.1239 CC(N)C1(CCO)CCCC1 Amb27658691 [0,1,0,1,0,0|1,0,1]=4 6915 B11R1.1239 CCCC1(C(=O)O)CCCC1 Amb18300462 [0,1,0,1,0,0|2,0,0]=4 6916 B11R1.1239 CCCC1(C(C)=O)CCCN1 Amb26607478 [0,1,0,1,0,0|2,0,0]=4 6917 B11R1.1239 CCCC1(C(C)=O)CCNC1 Amb25836666 [0,1,0,1,0,0|2,0,0]=4 6918 B11R1.1239 CCOC1(C(=O)Cl)CCCC1 Amb27483041 [0,1,0,1,0,0|2,0,0]=4 6919 B11R1.1239 CCOC1(C(=O)O)CCCC1 Amb18976726 [0,1,0,1,0,0|2,0,0]=4 6920 B11R1.1239 CCOC1(C(C)=O)CCOC1 Amb28317960 [0,1,0,1,0,0|2,0,0]=4 6921 B11R1.1239 CN(C)C1(CCO)CCCC1 Amb27835035 [0,1,0,1,0,0|2,0,0]=4 6922 B11R1.1239 CNCC1(C(N)=O)CCCC1 Amb27771974 [0,1,0,1,0,0|2,0,0]=4 6923 B11R1.1239 COCC1(C(=O)O)CCCC1 Amb17570028 [0,1,0,1,0,0|1,0,0]=3 6924 B11R1.1239 COCC1(C(=O)O)CCCN1 Amb25065716 [0,1,0,1,0,0|2,0,0]=4 6925 B11R1.1239 COCC1(C(=O)O)CCCN1 Amb33552544 [0,1,0,1,0,0|2,0,0]=4 6926 B11R1.1239 COCC1(C(=O)O)CCCO1 Amb27830689 [0,1,0,1,0,0|2,0,0]=4 6927 B11R1.1239 COCC1(C(=O)O)CCCS1 Amb27946450 [0,1,0,1,0,0|2,0,0]=4 6928 B11R1.1239 COCC1(C(=O)O)CCNC1 Amb25317854 [0,1,0,1,0,0|2,0,0]=4 6929 B11R1.1239 COCC1(C(=O)O)CCNC1 Amb32664730 [0,1,0,1,0,0|2,0,0]=4 6930 B11R1.1239 COCC1(C(=O)O)CCOC1 Amb26542619 [0,1,0,1,0,0|2,0,0]=4 6931 B11R1.1239 COCC1(C(C)=O)CCCN1 Amb33131625 [0,1,0,1,0,0|1,0,0]=3 6932 B11R1.1239 COCC1(C(N)=O)CCCC1 Amb9902166 [0,1,0,1,0,0|1,0,0]=3 6933 B11R1.1239 COCC1(C(N)=O)CCCN1 Amb28182505 [0,1,0,1,0,0|2,0,0]=4 6934 B11R1.1239 COCC1(C(N)=O)CCCN1 Amb32666728 [0,1,0,1,0,0|2,0,0]=4 6935 B11R1.1239 COCC1(C(N)=S)CCCC1 Amb27246104 [0,1,0,1,0,0|1,1,0]=4 6936 B11R1.1239 COC[C@@]1(C(N)=O)CCCN1 Amb28048900 [0,1,0,1,0,0|2,0,0]=4 6937 B11R1.1239 CSCC1(C(=O)O)CCCC1 Amb29868646 [0,1,0,1,0,0|1,1,0]=4 6938 B11R1.1239 N#CCC1(C(=O)O)CCCC1 Amb25685223 [0,1,0,1,0,0|2,0,0]=4 6939 B11R1.1239 NCCC1(C(=O)O)CCCC1 Amb32938539 [0,1,0,1,0,0|2,0,0]=4 6940 B11R1.1239 O=C(O)C1(CCCl)CCCC1 Amb27946449 [0,1,0,1,0,0|2,0,0]=4 6941 B11R1.1239 O=C(O)C1(CCF)CCCC1 Amb25890868 [0,1,0,1,0,0|2,0,0]=4 6942 B11R1.1239 O=C(O)C1(CCO)CCCC1 Amb27590952 [0,1,0,1,0,0|1,0,0]=3 6943 B11R1.1239 O=C(O)C1(CCO)CCNC1 Amb2696580 [0,1,0,1,0,0|2,0,0]=4 6944 B11R1.1239 O=C(O)C1(CCO)CCOC1 Amb28365351 [0,1,0,1,0,0|2,0,0]=4 6945 B11R1.1239 O=C(O)C1(CCO)CCSC1 Amb32946252 [0,1,0,1,0,0|2,0,0]=4 6946 B11R1.66 C=C1CCCC[C@H](O)[C@H]1CC Amb26935629 [0,1,0,1,0,0|2,0,0]=4 6947 B11R1.156 C=C(C)[C@H]1[C@@H](O)CCC[C@H]1C Amb27981688 [0,1,0,1,0,0|1,0,0]=3 6948 B11R1.156 CC(=O)C1C(=O)OCCC1O Amb28421747 [0,1,0,1,0,0|1,0,1]=4 6949 B11R1.156 CC(=O)C1C(O)CCCC1O Amb28074706 [0,1,0,1,0,0|0,0,0]=2 6950 B11R1.156 CC(=O)C1[C@@H](O)CCC[C@H]1O Amb25918229 [0,1,0,1,0,0|0,0,0]=2 6951 B11R1.156 CC(=O)C1[C@H](O)CCC[C@H]1O Amb28053963 [0,1,0,1,0,0|0,0,0]=2 6952 B11R1.156 CC(=O)N1[C@H](C)CCC[C@H]1C Amb27854049 [0,1,0,1,0,0|2,0,0]=4 6953 B11R1.156 CC(=O)[C@H]1[C@@H](O)CCC[C@H]1O Amb27749791 [0,1,0,1,0,0|0,0,0]=2 6954 B11R1.156 CC(C)[C@H]1[C@@H](C)CCC[C@H]1O Amb27853949 [0,1,0,1,0,0|1,0,1]=4 6955 B11R1.156 CC1CCCC(C)C1C(=O)Cl Amb26066220 [0,1,0,1,0,0|2,0,0]=4 6956 B11R1.156 CC1CCCC(C)C1C(N)=O Amb28325824 [0,1,0,1,0,0|2,0,0]=4 6957 B11R1.156 CC1CCCC(O)C1C(=O)O Amb28422448 [0,1,0,1,0,0|1,0,0]=3 6958 B11R1.156 CC1NCCC(O)C1C(=O)O Amb18199875 [0,1,0,1,0,0|2,0,0]=4 6959 B11R1.156 C[C@H]1CCC[C@@H](C)[C@H]1C(N)=O Amb27975426 [0,1,0,1,0,0|2,0,0]=4 6960 B11R1.156 C[C@H]1CCC[C@@H](N)[C@H]1C(=O)O Amb27818148 [0,1,0,1,0,0|2,0,0]=4 6961 B11R1.156 NC1CCCC(O)C1C(=O)O Amb27176362 [0,1,0,1,0,0|1,0,0]=3 6962 B11R1.199 CCCC(=O)C1CCCC1=O Amb17940809 [0,1,0,1,0,0|1,0,1]=4 6963 B11R1.199 CCCC(Br)C1COCC1C Amb35632058 [0,1,0,1,0,0|1,0,1]=4 6964 B11R1.199 CCCC(C)C1COCC1=O Amb35639038 [0,1,0,1,0,0|0,0,0]=2 6965 B11R1.199 CCCC(C)C1COCC1Br Amb35736906 [0,1,0,1,0,0|1,0,1]=4 6966 B11R1.199 CCCC(C)C1COCC1Cl Amb35736810 [0,1,0,1,0,0|1,0,1]=4 6967 B11R1.199 CCCC(C)C1COCC1N Amb29877511 [0,1,0,1,0,0|1,0,1]=4 6968 B11R1.199 CCCC(C)C1COCC1O Amb33212808 [0,1,0,1,0,0|0,0,2]=4 6969 B11R1.199 CCCC(C)[C@@H]1COC[C@H]1O Amb33213391 [0,1,0,1,0,0|0,0,2]=4 6970 B11R1.199 CCCC(Cl)C1COCC1C Amb35632057 [0,1,0,1,0,0|1,0,1]=4 6971 B11R1.199 CCCC(N)C1COCC1C Amb35635629 [0,1,0,1,0,0|1,0,1]=4 6972 B11R1.199 CCCC(N)C1COCC1O Amb29870214 [0,1,0,1,0,0|0,0,2]=4 6973 B11R1.199 CCCC(O)C1COCC1C Amb35651591 [0,1,0,1,0,0|1,0,1]=4 6974 B11R1.199 CCCC(O)C1COCC1N Amb35625436 [0,1,0,1,0,0|1,0,1]=4 6975 B11R1.199 CCOC(=O)C1COCC1=O Amb21963949 [0,1,0,1,0,0|1,0,1]=4 6976 B11R1.199 COCC(N)C1CCCC1=O Amb27881156 [0,1,0,1,0,0|2,0,0]=4 6977 B11R1.424 CC1CCCC(C)(C)C1CO Amb25048146 [0,1,0,1,0,0|1,0,1]=4 6978 B11R1.424 CC1CCCS(=O)(=O)C1CO Amb28453459 [0,1,0,1,0,0|2,0,0]=4 6979 B11R1.424 C[C@@H]1CCCC(C)(C)[C@@H]1CO Amb28138378 [0,1,0,1,0,0|1,0,1]=4 6980 B11R1.424 C[C@H]1CCCC(C)(C)[C@@H]1CO Amb27630317 [0,1,0,1,0,0|1,0,1]=4 6981 B11R1.424 C[C@H]1CCCC(C)(C)[C@H]1CO Amb27213572 [0,1,0,1,0,0|1,0,1]=4 6982 B11R1.464 CC1CC(=O)C(C=O)C(C)C1 Amb26949293 [0,1,0,1,0,0|0,0,2]=4 6983 B11R1.464 CC1CC(C)C(CO)C(C)C1 Amb25084514 [0,1,0,1,0,0|1,0,1]=4 6984 B11R1.464 CCC1C(=O)CC(C)CC1C Amb27267131 [0,1,0,1,0,0|1,0,0]=3 6985 B11R1.464 CCC1C(=O)C[C@H](C)C[C@H]1C Amb27854996 [0,1,0,1,0,0|1,0,0]=3 6986 B11R1.835 CCCC(C)C1(C(=O)O)CC1 Amb25382357 [0,1,0,1,0,0|2,0,0]=4 6987 B11R1.835 CCCC(C)C1(C(C)=O)CC1 Amb33322205 [0,1,0,1,0,0|1,0,0]=3 6988 B11R1.835 CCOC(=O)C1(C(C)=O)CO1 Amb27672392 [0,1,0,1,0,0|1,0,1]=4 6989 B11R1.835 CCOC(C)C1(C(C)=O)CC1 Amb33425006 [0,1,0,1,0,0|2,0,0]=4 6990 B11R1.1021 CCC(C(=O)O)C(N)C1CC1 Amb33036284 [0,1,0,1,0,0|2,0,0]=4 6991 B11R1.1021 CCC(C(=O)O)C(O)C1CC1 Amb19022396 [0,1,0,1,0,0|2,0,0]=4 6992 B11R1.1021 CCC(C(C)=O)C(=O)C1CC1 Amb27672659 [0,1,0,1,0,0|1,0,1]=4 6993 B11R1.1021 CCN(C(C)=O)C(C)C1CC1 Amb27674176 [0,1,0,1,0,0|2,0,0]=4 6994 B11R1.1544 CCC(C(=O)O)C1(N)CCC1 Amb33036396 [0,1,0,1,0,0|2,0,0]=4 6995 B11R1.1544 CCC(C(=O)O)C1(O)CCC1 Amb18298179 [0,1,0,1,0,0|2,0,0]=4 6996 B11R1.19 CC1CCC(S(=O)(=O)Cl)CO1 Amb32692903 [0,1,0,1,0,0|2,0,0]=4 6997 B11R1.19 CC1CCC(S(=O)(=O)F)CO1 Amb33352439 [0,1,0,1,0,0|2,0,0]=4 6998 B11R1.19 CC1CCC(S(C)(=N)=O)CC1 Amb32676129 [0,1,0,1,0,0|2,0,0]=4 6999 B11R1.19 CC1CCC(S(N)(=O)=O)CO1 Amb32691817 [0,1,0,1,0,0|2,0,0]=4 7000 B11R1.45 CCC1CC(S(=O)(=O)Cl)CO1 Amb30028934 [0,1,0,1,0,0|2,0,0]=4 7001 B11R1.45 CCC1CC(S(=O)(=O)F)CO1 Amb33352355 [0,1,0,1,0,0|2,0,0]=4 7002 B11R1.45 CCC1CC(S(N)(=O)=O)CO1 Amb32691857 [0,1,0,1,0,0|2,0,0]=4 7003 B11R1.87 CC(C)(C)C1CCCCC1O Amb6705750 [0,1,0,1,0,0|1,0,1]=4 7004 B11R1.87 CC(C)(C)[C@@H]1CCCC[C@H]1O Amb22224799 [0,1,0,1,0,0|1,0,1]=4 7005 B11R1.87 CC(C)(C)[C@H]1CCCC[C@H]1O Amb28321269 [0,1,0,1,0,0|1,0,1]=4 7006 B11R1.87 CC(C)(O)[C@@H]1CCCC[C@H]1O Amb27448158 [0,1,0,1,0,0|0,0,2]=4 7007 B11R1.87 CC(O)(O)C1CCCCC1O Amb28369676 [0,1,0,1,0,0|0,0,2]=4 7008 B11R1.87 CC1CCCCC1S(C)(=N)=O Amb32676135 [0,1,0,1,0,0|2,0,0]=4 7009 B11R1.87 CP(C)(=O)C1CCCCC1N Amb35750186 [0,1,0,1,0,0|2,0,0]=4 7010 B11R1.87 CS(=O)(=O)C1CCCCC1N Amb13951877 [0,1,0,1,0,0|2,0,0]=4 7011 B11R1.87 CS(=O)(=O)C1CCCCC1N Amb32661088 [0,1,0,1,0,0|2,0,0]=4 7012 B11R1.87 CS(=O)(=O)C1CCCCC1O Amb18184428 [0,1,0,1,0,0|1,0,0]=3 7013 B11R1.87 CS(=O)(=O)[C@@H]1CCCC[C@H]1N Amb25917956 [0,1,0,1,0,0|2,0,0]=4 7014 B11R1.87 CS(=O)(=O)[C@@H]1CCCC[C@H]1N Amb28717823 [0,1,0,1,0,0|2,0,0]=4 7015 B11R1.87 CS(=O)(=O)[C@@H]1CCCC[C@H]1O Amb25247293 [0,1,0,1,0,0|1,0,0]=3 7016 B11R1.87 C[N+](C)(C)[C@@H]1CCCC[C@@H]1O Amb28064024 [0,1,0,1,0,0|2,0,0]=4 7017 B11R1.87 C[Si](C)(C)C1CCCCC1O Amb2612366 [0,1,0,1,0,0|1,1,0]=4 7018 B11R1.87 C[Si](C)(C)[C@@H]1CCCC[C@@H]1O Amb28053448 [0,1,0,1,0,0|1,1,0]=4 7019 B11R1.87 C[Si](C)(C)[C@@H]1CCCC[C@H]1O Amb27186927 [0,1,0,1,0,0|1,1,0]=4 7020 B11R1.87 C[Si](C)(O)[C@@H]1CCCC[C@@H]1O Amb28205978 [0,1,0,1,0,0|0,1,1]=4 7021 B11R1.87 NS(=O)(=O)C1CCCCC1O Amb25702424 [0,1,0,1,0,0|2,0,0]=4 7022 B11R1.87 NS(=O)(=O)[C@@H]1CCCC[C@@H]1O Amb27875430 [0,1,0,1,0,0|2,0,0]=4 7023 B11R1.87 O=P(O)(O)C1CCCCC1O Amb1808620 [0,1,0,1,0,0|2,0,0]=4 7024 B11R1.87 O=S(=O)(Cl)C1CCCCC1O Amb19514726 [0,1,0,1,0,0|2,0,0]=4 7025 B11R1.87 O=S(=O)(F)C1CCCCC1O Amb32716841 [0,1,0,1,0,0|2,0,0]=4 7026 B11R1.87 O=S(=O)(O)[C@@H]1CCCC[C@H]1O Amb28428405 [0,1,0,1,0,0|2,0,0]=4 7027 B11R1.316 CC1CCC(C(C)(C)C)C1O Amb27766528 [0,1,0,1,0,0|1,0,1]=4 7028 B11R1.316 CC1CCC(C(C)(C)O)C1O Amb28345110 [0,1,0,1,0,0|0,0,2]=4 7029 B11R1.316 CC1CC[C@@H](C(C)(C)Cl)[C@@H]1O Amb27484818 [0,1,0,1,0,0|1,0,1]=4 7030 B11R1.316 C[C@@H]1CC[C@@H](C(C)(C)Cl)[C@H]1O Amb27218583 [0,1,0,1,0,0|1,0,1]=4 7031 B11R1.316 C[C@@H]1CC[C@@H](C(C)(C)F)[C@@H]1O Amb27197906 [0,1,0,1,0,0|1,0,1]=4 7032 B11R1.316 C[C@H]1CC[C@@H](C(C)(C)F)[C@@H]1O Amb25964361 [0,1,0,1,0,0|1,0,1]=4 7033 B11R1.377 CC(C)(F)C(CO)C1CCC1 Amb27202120 [0,1,0,1,0,0|1,0,1]=4 7034 B11R1.1061 CC(C)(O)C1(CO)CCCC1 Amb24679276 [0,1,0,1,0,0|0,0,2]=4 7035 B11R1.1061 CC(F)(F)C1(CO)CCCC1 Amb27201745 [0,1,0,1,0,0|1,0,1]=4 7036 B11R1.1061 CS(=O)(=O)C1(CN)CCCC1 Amb13953089 [0,1,0,1,0,0|2,0,0]=4 7037 B11R1.1061 CS(=O)(=O)C1(CN)CCCC1 Amb28652834 [0,1,0,1,0,0|2,0,0]=4 7038 B11R1.1061 CS(=O)(=O)C1(CO)CCCC1 Amb23454247 [0,1,0,1,0,0|1,0,0]=3 7039 B11R1.1061 O=S(=O)(F)C1(CO)CCCC1 Amb32659522 [0,1,0,1,0,0|2,0,0]=4 7040 B11R1.1121 CC(C)(N)C1CCCCOC1 Amb27813404 [0,1,0,1,0,0|1,0,1]=4 7041 B11R1.1121 CS(=O)(=O)C1CCCCNC1 Amb25786469 [0,1,0,1,0,0|2,0,0]=4 7042 B11R1.1121 CS(=O)(=O)C1CCCCNC1 Amb28872344 [0,1,0,1,0,0|2,0,0]=4 7043 B11R1.220 C=C(C)C1(F)CCC(C)NC1 Amb28367267 [0,1,0,1,0,0|2,0,0]=4 7044 B11R1.220 C=C(C)C1(O)CCC(C)OC1 Amb35679108 [0,1,0,1,0,0|1,0,0]=3 7045 B11R1.220 C=C(C)C1(O)CCC(C)SC1 Amb29857687 [0,1,0,1,0,0|1,1,0]=4 7046 B11R1.220 CC(=O)C1(O)CC=C(C)CC1 Amb27475439 [0,1,0,1,0,0|1,0,1]=4 7047 B11R1.220 CC(=O)C1(O)CCN(C)CC1 Amb25032528 [0,1,0,1,0,0|2,0,0]=4 7048 B11R1.220 CC(=O)[C@@]1(Cl)CC=C(C)CC1 Amb28285894 [0,1,0,1,0,0|1,0,1]=4 7049 B11R1.220 CC(=O)[C@]1(O)CC=C(C)CC1 Amb26847058 [0,1,0,1,0,0|1,0,1]=4 7050 B11R1.220 CC1CCC(C)(C(=O)O)CC1 Amb25083864 [0,1,0,1,0,0|2,0,0]=4 7051 B11R1.220 CC1CCC(C)(C(N)=O)CC1 Amb27590311 [0,1,0,1,0,0|2,0,0]=4 7052 B11R1.220 CC1CCC(Cl)(C(=O)Cl)CC1 Amb33127986 [0,1,0,1,0,0|2,0,0]=4 7053 B11R1.220 CC1CCC(Cl)(C(=O)O)CC1 Amb32716553 [0,1,0,1,0,0|2,0,0]=4 7054 B11R1.220 CC1CCC(F)(C(=O)O)CC1 Amb26530517 [0,1,0,1,0,0|2,0,0]=4 7055 B11R1.220 CC1CCC(N)(C(=O)O)CC1 Amb4134830 [0,1,0,1,0,0|2,0,0]=4 7056 B11R1.220 CC1CCC(N)(C(=O)O)CO1 Amb35694652 [0,1,0,1,0,0|1,0,0]=3 7057 B11R1.220 CC1CCC(N)(C(=O)O)CS1 Amb35725377 [0,1,0,1,0,0|1,1,0]=4 7058 B11R1.220 CC1CCC(N)(C(N)=O)CC1 Amb18279188 [0,1,0,1,0,0|2,0,0]=4 7059 B11R1.220 CC1CCC(N)(C(N)=O)CO1 Amb30010474 [0,1,0,1,0,0|1,0,0]=3 7060 B11R1.220 CC1CCC(N)(C(N)=O)CS1 Amb35725313 [0,1,0,1,0,0|1,1,0]=4 7061 B11R1.220 CC1CCC(O)(C(=O)O)CC1 Amb18944702 [0,1,0,1,0,0|2,0,0]=4 7062 B11R1.220 CC1CCC(O)(C(=O)O)CO1 Amb29850026 [0,1,0,1,0,0|1,0,0]=3 7063 B11R1.220 CC1CCC(O)(C(=O)O)CS1 Amb35717586 [0,1,0,1,0,0|1,1,0]=4 7064 B11R1.220 CC1CCC(O)(C(C)C)CO1 Amb35679110 [0,1,0,1,0,0|1,0,1]=4 7065 B11R1.220 CC1CCC(O)(C(N)=O)CC1 Amb18183175 [0,1,0,1,0,0|2,0,0]=4 7066 B11R1.220 CC1CCC(O)(C(N)=O)CO1 Amb29850195 [0,1,0,1,0,0|1,0,0]=3 7067 B11R1.220 CC1CCC(O)(C(N)=O)CS1 Amb35717585 [0,1,0,1,0,0|1,1,0]=4 7068 B11R1.220 C[C@H]1CC[C@@](C)(C(=O)O)CC1 Amb27406355 [0,1,0,1,0,0|2,0,0]=4 7069 B11R1.220 C[C@H]1CC[C@@](N)(C(=O)O)CC1 Amb27863411 [0,1,0,1,0,0|2,0,0]=4 7070 B11R1.364 CCCCC1(C)C(N)CC1O Amb33035212 [0,1,0,1,0,0|1,0,1]=4 7071 B11R1.373 O=C1OC(CO)C[C@]1(O)CO Amb27457572 [0,1,0,1,0,0|2,0,0]=4 7072 B11R1.373 O=C1O[C@H](CO)C[C@]1(O)CO Amb27482920 [0,1,0,1,0,0|2,0,0]=4 7073 B11R1.409 C#CC1(C)CCCCCC1=O Amb25830541 [0,1,0,1,0,0|1,0,1]=4 7074 B11R1.409 CC1(C#N)CCCCCC1=O Amb22755464 [0,1,0,1,0,0|1,0,1]=4 7075 B11R1.409 CC1CCCCCC1(O)CO Amb35672744 [0,1,0,1,0,0|1,0,1]=4 7076 B11R1.409 C[C@H]1OCCCC[C@@]1(O)CO Amb27457851 [0,1,0,1,0,0|0,0,2]=4 7077 B11R1.520 C=C(C)C1(O)CCCCC1C Amb27219328 [0,1,0,1,0,0|2,0,0]=4 7078 B11R1.520 C=C1CCCCC1(C)C(C)=O Amb17593810 [0,1,0,1,0,0|1,0,1]=4 7079 B11R1.520 CC(=O)C1(C)CCCCC1=O Amb17593849 [0,1,0,1,0,0|0,0,2]=4 7080 B11R1.520 CC(=O)C1(C)CCCCC1Br Amb27882892 [0,1,0,1,0,0|1,0,0]=3 7081 B11R1.520 CC(=O)C1(C)CCCCC1C Amb24614744 [0,1,0,1,0,0|1,0,0]=3 7082 B11R1.520 CC(=O)C1(C)CCCCC1N Amb33131336 [0,1,0,1,0,0|1,0,0]=3 7083 B11R1.520 CC(=O)C1(Cl)CCCCC1Cl Amb27484000 [0,1,0,1,0,0|1,0,0]=3 7084 B11R1.520 CC(=O)C1(F)CCCCC1O Amb27176564 [0,1,0,1,0,0|0,0,0]=2 7085 B11R1.520 CC(=O)C1(O)CCC=CC1O Amb27176397 [0,1,0,1,0,0|0,0,2]=4 7086 B11R1.520 CC(=O)C1(O)CCCCC1F Amb25972913 [0,1,0,1,0,0|1,0,0]=3 7087 B11R1.520 CC(=O)C1(O)CCCCC1O Amb27227148 [0,1,0,1,0,0|0,0,0]=2 7088 B11R1.520 CC(=O)[C@@]1(C)CCCC[C@@H]1C Amb27487824 [0,1,0,1,0,0|1,0,0]=3 7089 B11R1.520 CC(=O)[C@@]1(C)CCCC[C@H]1Br Amb27972320 [0,1,0,1,0,0|1,0,0]=3 7090 B11R1.520 CC(=O)[C@@]1(Cl)CCCC[C@@H]1C Amb28351609 [0,1,0,1,0,0|1,0,0]=3 7091 B11R1.520 CC(=O)[C@@]1(O)CCCC[C@@H]1O Amb28057553 [0,1,0,1,0,0|0,0,0]=2 7092 B11R1.520 CC(=O)[C@@]1(O)CCCC[C@H]1C Amb27788506 [0,1,0,1,0,0|1,0,0]=3 7093 B11R1.520 CC(=O)[C@@]1(O)CCCC[C@H]1O Amb28052510 [0,1,0,1,0,0|0,0,0]=2 7094 B11R1.520 CC(=O)[C@]1(C)CCCC[C@@H]1O Amb27433869 [0,1,0,1,0,0|0,0,0]=2 7095 B11R1.520 CC(=O)[C@]1(C)CCCC[C@H]1C Amb26533815 [0,1,0,1,0,0|1,0,0]=3 7096 B11R1.520 CC(=O)[C@]1(Cl)CCCC[C@@H]1C Amb27844204 [0,1,0,1,0,0|1,0,0]=3 7097 B11R1.520 CC(=O)[C@]1(O)CCCC[C@@H]1O Amb27844097 [0,1,0,1,0,0|0,0,0]=2 7098 B11R1.520 CC(O)C1(C)CCCCC1O Amb27430596 [0,1,0,1,0,0|0,0,2]=4 7099 B11R1.520 CC1(C(=O)O)CCCCC1N Amb25759350 [0,1,0,1,0,0|2,0,0]=4 7100 B11R1.520 CC1(C(=O)O)CCCCC1N Amb28652993 [0,1,0,1,0,0|2,0,0]=4 7101 B11R1.520 CC1(C(=O)O)CCCCN1O Amb27201259 [0,1,0,1,0,0|2,0,0]=4 7102 B11R1.520 CC1(C(N)=O)CCCCC1N Amb35688628 [0,1,0,1,0,0|2,0,0]=4 7103 B11R1.520 CC1CCCCC1(C)C(=O)Cl Amb26936060 [0,1,0,1,0,0|2,0,0]=4 7104 B11R1.520 CC1CCCCC1(C)C(=O)F Amb26880402 [0,1,0,1,0,0|2,0,0]=4 7105 B11R1.520 CC1CCCCC1(C)C(=O)O Amb24635732 [0,1,0,1,0,0|2,0,0]=4 7106 B11R1.520 CC1CCCCC1(C)C(N)=O Amb27199691 [0,1,0,1,0,0|2,0,0]=4 7107 B11R1.520 CC1CCCCC1(N)C(=O)O Amb2695544 [0,1,0,1,0,0|2,0,0]=4 7108 B11R1.520 CC1CCCCC1(O)C(N)=O Amb18799805 [0,1,0,1,0,0|2,0,0]=4 7109 B11R1.520 C[C@@H]1CCCC[C@@]1(N)C(=O)O Amb26431408 [0,1,0,1,0,0|2,0,0]=4 7110 B11R1.520 C[C@@H]1CCCC[C@]1(C)C(=O)O Amb28062305 [0,1,0,1,0,0|2,0,0]=4 7111 B11R1.520 C[C@@H]1CCCC[C@]1(N)C(=O)O Amb25263952 [0,1,0,1,0,0|2,0,0]=4 7112 B11R1.520 C[C@@]1(C(=O)O)CCCC[C@@H]1N Amb27870245 [0,1,0,1,0,0|2,0,0]=4 7113 B11R1.520 C[C@H]1CCCC[C@@]1(N)C(N)=O Amb27194330 [0,1,0,1,0,0|2,0,0]=4 7114 B11R1.520 C[C@H]1CCCC[C@]1(N)C(=O)O Amb28319347 [0,1,0,1,0,0|2,0,0]=4 7115 B11R1.520 C[C@H]1CCCC[C@]1(O)C(=O)O Amb28051865 [0,1,0,1,0,0|2,0,0]=4 7116 B11R1.520 C[C@]1(C(=O)O)CCCC[C@@H]1N Amb27202576 [0,1,0,1,0,0|2,0,0]=4 7117 B11R1.520 C[C@]1(C(=O)O)CCCC[C@H]1N Amb27792116 [0,1,0,1,0,0|2,0,0]=4 7118 B11R1.520 NC1(C(=O)O)CCCCC1Cl Amb2695413 [0,1,0,1,0,0|2,0,0]=4 7119 B11R1.520 NC1(C(=O)O)CCCCC1F Amb27784196 [0,1,0,1,0,0|2,0,0]=4 7120 B11R1.520 NC1CCCCC1(N)C(=O)O Amb25348456 [0,1,0,1,0,0|2,0,0]=4 7121 B11R1.520 NC1CCCCC1(O)C(=O)O Amb26350763 [0,1,0,1,0,0|2,0,0]=4 7122 B11R1.520 N[C@@H]1CCCC[C@]1(N)C(=O)O Amb24675453 [0,1,0,1,0,0|2,0,0]=4 7123 B11R1.520 N[C@]1(C(=O)O)CCCCC1O Amb28119925 [0,1,0,1,0,0|1,0,0]=3 7124 B11R1.520 N[C@]1(C(=O)O)CCCC[C@@H]1O Amb24602384 [0,1,0,1,0,0|1,0,0]=3 7125 B11R1.520 N[C@]1(C(=O)O)CCCC[C@H]1O Amb24626559 [0,1,0,1,0,0|1,0,0]=3 7126 B11R1.520 O=C(O)C1(Cl)CCCCC1Cl Amb18652202 [0,1,0,1,0,0|2,0,0]=4 7127 B11R1.520 O=C(O)C1(F)CCCCC1O Amb24334791 [0,1,0,1,0,0|1,0,0]=3 7128 B11R1.520 O=C(O)C1(O)CCCCC1Cl Amb28385703 [0,1,0,1,0,0|2,0,0]=4 7129 B11R1.520 O=C(O)C1(O)CCCCC1O Amb24348654 [0,1,0,1,0,0|1,0,0]=3 7130 B11R1.520 O=C(O)[C@@]1(F)CCCC[C@H]1O Amb27455477 [0,1,0,1,0,0|1,0,0]=3 7131 B11R1.520 O=C(O)[C@]1(F)CCCC[C@@H]1O Amb25912005 [0,1,0,1,0,0|1,0,0]=3 7132 B11R1.737 C=C(C)C1(O)CCCCCC1 Amb28197521 [0,1,0,1,0,0|2,0,0]=4 7133 B11R1.737 CC(=O)C1(O)CCCCCC1 Amb27409593 [0,1,0,1,0,0|1,0,0]=3 7134 B11R1.737 CC1(C(=O)Cl)CCCCCC1 Amb25757006 [0,1,0,1,0,0|2,0,0]=4 7135 B11R1.737 CC1(C(=O)O)CCCCCC1 Amb25152741 [0,1,0,1,0,0|2,0,0]=4 7136 B11R1.737 CC1(C(N)=O)CCCCCC1 Amb27970672 [0,1,0,1,0,0|2,0,0]=4 7137 B11R1.737 NC(=O)C1(N)CCCCCC1 Amb6892253 [0,1,0,1,0,0|2,0,0]=4 7138 B11R1.737 NC(=O)C1(O)CCCCCC1 Amb18799803 [0,1,0,1,0,0|2,0,0]=4 7139 B11R1.737 NC1(C(=O)O)CCCCCC1 Amb1841034 [0,1,0,1,0,0|2,0,0]=4 7140 B11R1.737 NC1(C(=O)O)COCCOC1 Amb27984548 [0,1,0,1,0,0|2,0,0]=4 7141 B11R1.737 O=C(Cl)C1(Cl)CCCCCC1 Amb33127987 [0,1,0,1,0,0|2,0,0]=4 7142 B11R1.737 O=C(F)C1(O)CCCCCC1 Amb25909616 [0,1,0,1,0,0|2,0,0]=4 7143 B11R1.737 O=C(O)C1(Cl)CCCCCC1 Amb26847917 [0,1,0,1,0,0|2,0,0]=4 7144 B11R1.737 O=C(O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|2,0,0]=4 7145 B11R1.737 O=C(O)C1(O)CCCCCC1 Amb33537594 [0,1,0,1,0,0|2,0,0]=4 7146 B11R1.1047 CC1CC[C@](C)(CO)C(C)C1 Amb540764 [0,1,0,1,0,0|1,0,1]=4 7147 B11R1.1047 CC[C@]1(C)CC[C@@H](C)CC1=O Amb28202182 [0,1,0,1,0,0|1,0,0]=3 7148 B11R1.1075 CC1(C)CCCCC1(N)CO Amb27759017 [0,1,0,1,0,0|1,0,1]=4 7149 B11R1.1075 CC1(C)CCCCC1(O)CO Amb25198144 [0,1,0,1,0,0|1,0,1]=4 7150 B11R1.1133 CCCCC1(C)CCCC1=O Amb28194561 [0,1,0,1,0,0|1,0,0]=3 7151 B11R1.1133 CCCCC1(C)CCNC1=O Amb33070920 [0,1,0,1,0,0|2,0,0]=4 7152 B11R1.1133 CCCCC1(O)CCOC1=O Amb27257693 [0,1,0,1,0,0|2,0,0]=4 7153 B11R1.1133 CCCCC1(O)COCC1C Amb35647100 [0,1,0,1,0,0|1,0,1]=4 7154 B11R1.1133 CCCC[C@]1(C)CCCC1=O Amb27823640 [0,1,0,1,0,0|1,0,0]=3 7155 B11R1.1145 C=C(C)C(O)(CC)C1CC1C Amb28239977 [0,1,0,1,0,0|2,0,0]=4 7156 B11R1.1145 CCC(N)(C(N)=O)C1CC1C Amb27246321 [0,1,0,1,0,0|2,0,0]=4 7157 B11R1.1152 CC(CO)(NC1CC1)C(=O)O Amb27269508 [0,1,0,1,0,0|2,0,0]=4 7158 B11R1.1152 CC(CO)(NC1CC1)C(N)=O Amb27269504 [0,1,0,1,0,0|2,0,0]=4 7159 B11R1.1191 CC1CCC(C)(CO)C1(C)C Amb17777994 [0,1,0,1,0,0|1,0,1]=4 7160 B11R1.1191 C[C@@H]1CC[C@](C)(CO)C1(C)C Amb24651863 [0,1,0,1,0,0|1,0,1]=4 7161 B11R1.1191 C[C@H]1CC[C@@](C)(CO)C1(C)C Amb23452542 [0,1,0,1,0,0|1,0,1]=4 7162 B11R1.1229 C=C(C)C1(O)CCC(CC)C1 Amb27793905 [0,1,0,1,0,0|2,0,0]=4 7163 B11R1.1229 C=C(C)C1(O)COC(CC)C1 Amb35653256 [0,1,0,1,0,0|1,0,0]=3 7164 B11R1.1229 CCC1CC(N)(C(=O)O)CN1 Amb28325829 [0,1,0,1,0,0|2,0,0]=4 7165 B11R1.1229 CCC1CC(N)(C(=O)O)CO1 Amb35626631 [0,1,0,1,0,0|1,0,0]=3 7166 B11R1.1229 CCC1CC(N)(C(N)=O)CO1 Amb35614839 [0,1,0,1,0,0|1,0,0]=3 7167 B11R1.1229 CCC1CC(O)(C(=O)O)CO1 Amb35633947 [0,1,0,1,0,0|1,0,0]=3 7168 B11R1.1229 CCC1CC(O)(C(C)C)CO1 Amb35644839 [0,1,0,1,0,0|1,0,1]=4 7169 B11R1.1229 CCC1CC(O)(C(N)=O)CO1 Amb35633946 [0,1,0,1,0,0|1,0,0]=3 7170 B11R1.1229 CCC1CCC(N)(C(N)=O)C1 Amb27863029 [0,1,0,1,0,0|2,0,0]=4 7171 B11R1.1229 CCC1CCC(O)(C(=O)O)C1 Amb33528775 [0,1,0,1,0,0|2,0,0]=4 7172 B11R1.1229 CCC1OCC(C)(C(C)=O)O1 Amb27848464 [0,1,0,1,0,0|1,0,0]=3 7173 B11R1.1229 O=C(O)[C@]1(O)CO[C@H](CO)C1 Amb27983669 [0,1,0,1,0,0|2,0,0]=4 7174 B11R1.1270 C=C1C(C)CCC1(C)C(C)=O Amb28381135 [0,1,0,1,0,0|1,0,1]=4 7175 B11R2.64 O=C1CCN2CCC1CC2 Amb18832015 [0,0,0,2,0,0|2,0,0]=4 7176 B11R2.64 O=C1NCC2CCC1CN2 Amb32412090 [0,0,0,2,0,0|2,0,0]=4 7177 B11R2.123 CC1CCC2(CO1)CC2N Amb35679143 [0,0,0,2,0,0|1,0,1]=4 7178 B11R2.363 CC1=CC[C@H]2C(=O)C[C@H]2C1 Amb27452821 [0,0,0,2,0,0|1,0,1]=4 7179 B11R2.533 CC1(C)C2CCC(O)C1C2 Amb26060658 [0,0,0,2,0,0|1,0,1]=4 7180 B11R2.533 CC1(C)[C@H]2CCC(O)[C@@H]1C2 Amb33200138 [0,0,0,2,0,0|1,0,1]=4 7181 B11R2.533 CC1(C)[C@H]2CC[C@H](O)[C@@H]1C2 Amb27428201 [0,0,0,2,0,0|1,0,1]=4 7182 B11R2.696 C[N+]12CCC(CC1)C(=O)C2 Amb26589875 [0,0,0,2,0,0|2,0,0]=4 7183 B11R2.821 O=C(O)C1CCC2CC1C2 Amb27776869 [0,0,0,2,0,0|2,0,0]=4 7184 B11R2.839 CC(=O)N1CCC2CC2C1 Amb29855652 [0,0,0,2,0,0|2,0,0]=4 7185 B11R2.839 O=C(Cl)C1CCC2CC2C1 Amb35695772 [0,0,0,2,0,0|2,0,0]=4 7186 B11R2.839 O=C(O)C1CCC2CC2C1 Amb27876727 [0,0,0,2,0,0|2,0,0]=4 7187 B11R2.1839 CC(=O)C12CCC(CC1)C2 Amb26626660 [0,0,0,2,0,0|1,0,0]=3 7188 B11R2.1839 CC(=O)C12CCN(CC1)C2 Amb25792505 [0,0,0,2,0,0|2,0,0]=4 7189 B11R2.1839 NC(=O)C12CCC(CC1)C2 Amb1144607 [0,0,0,2,0,0|2,0,0]=4 7190 B11R2.1839 O=C(O)C12CCC(C1)NC2 Amb32665928 [0,0,0,2,0,0|2,0,0]=4 7191 B11R2.1839 O=C(O)C12CCC(C1)OC2 Amb33620694 [0,0,0,2,0,0|1,0,0]=3 7192 B11R2.1839 O=C(O)C12CCC(CC1)C2 Amb3987516 [0,0,0,2,0,0|2,0,0]=4 7193 B11R2.1839 O=C(O)C12CC[C@@H](C1)NC2 Amb10610569 [0,0,0,2,0,0|2,0,0]=4 7194 B11R2.1839 O=C(O)C12CC[C@@H](C1)NC2 Amb27951998 [0,0,0,2,0,0|2,0,0]=4 7195 B11R2.1839 O=C(O)C12CC[C@H](C1)NC2 Amb28341422 [0,0,0,2,0,0|2,0,0]=4 7196 B11R2.1839 O=C(O)C12COC(CN1)C2 Amb34152470 [0,0,0,2,0,0|2,0,0]=4 7197 B11R2.1839 O=C(O)[C@@]12CC[C@@H](C1)NC2 Amb24539198 [0,0,0,2,0,0|2,0,0]=4 7198 B11R2.1839 O=C(O)[C@@]12CC[C@@H](C1)NC2 Amb33620548 [0,0,0,2,0,0|2,0,0]=4 7199 B11R2.48 O=C1CN2CCC[C@@H]1CC2 Amb28255482 [0,0,0,2,0,0|2,0,0]=4 7200 B11R2.48 O=C1C[C@@H]2CCC[C@H]1CC2 Amb28199906 [0,0,0,2,0,0|1,0,0]=3 7201 B11R2.48 O=C1NC2CCC1CNC2 Amb27405712 [0,0,0,2,0,0|2,0,0]=4 7202 B11R2.48 O=C1N[C@@H]2CC[C@H]1CNC2 Amb28290884 [0,0,0,2,0,0|2,0,0]=4 7203 B11R2.48 O=C1N[C@H]2CC[C@@H]1CNC2 Amb22757913 [0,0,0,2,0,0|2,0,0]=4 7204 B11R2.63 CN1C2CCC(=O)C1CC2 Amb22372272 [0,0,0,2,0,0|2,0,0]=4 7205 B11R2.63 CN1[C@@H]2CCC(=O)[C@H]1CC2 Amb24752452 [0,0,0,2,0,0|2,0,0]=4 7206 B11R2.63 O=C1C2CCC(O)C1CC2 Amb24434631 [0,0,0,2,0,0|2,0,0]=4 7207 B11R2.63 O=C1C2CC[C@H](O)[C@H]1CC2 Amb28144044 [0,0,0,2,0,0|2,0,0]=4 7208 B11R2.63 O=C1NCC2CCC1C2Cl Amb28251095 [0,0,0,2,0,0|2,0,0]=4 7209 B11R2.63 O=C1[C@@H]2CC[C@H](Cl)[C@H]1CC2 Amb27619170 [0,0,0,2,0,0|2,0,0]=4 7210 B11R2.63 O=C1[C@H]2CC[C@@H]1CC[C@@H]2O Amb28131936 [0,0,0,2,0,0|2,0,0]=4 7211 B11R2.120 CN1C2CCCC1C(=O)C2 Amb27837989 [0,0,0,2,0,0|2,0,0]=4 7212 B11R2.120 NC1C2CCCC1C(=O)O2 Amb27878980 [0,0,0,2,0,0|2,0,0]=4 7213 B11R2.120 O=C1OC2CCCC1C2Br Amb27797259 [0,0,0,2,0,0|2,0,0]=4 7214 B11R2.120 O=C1O[C@@H]2CCC[C@H]1[C@@H]2O Amb27961367 [0,0,0,2,0,0|1,0,0]=3 7215 B11R2.120 O=C1O[C@@H]2CCC[C@H]1[C@H]2Br Amb27966696 [0,0,0,2,0,0|2,0,0]=4 7216 B11R2.120 O=S1S[C@@H]2CCC[C@H]1[C@@H]2O Amb27420455 [0,0,0,2,0,0|2,0,0]=4 7217 B11R2.120 O=S1S[C@H]2CCC[C@@H]1[C@H]2O Amb28194053 [0,0,0,2,0,0|2,0,0]=4 7218 B11R2.132 CC1C2CCCNC(=O)C12 Amb27843644 [0,0,0,2,0,0|2,0,0]=4 7219 B11R2.160 CC1CC2CC2CC1CO Amb33230262 [0,0,0,2,0,0|1,0,1]=4 7220 B11R2.163 OCC1CC2CCCC1C2 Amb27396913 [0,0,0,2,0,0|1,0,1]=4 7221 B11R2.199 O=C1C2CCCCC1CC2 Amb25046104 [0,0,0,2,0,0|1,0,0]=3 7222 B11R2.210 C#CC12CC1CCCC2=O Amb27750378 [0,0,0,2,0,0|1,0,1]=4 7223 B11R2.210 CCC12CC1CCCC2=O Amb27617095 [0,0,0,2,0,0|1,0,0]=3 7224 B11R2.210 COC12CC1CCCC2=O Amb28199986 [0,0,0,2,0,0|2,0,0]=4 7225 B11R2.218 C=CC12CCCC1CC2=O Amb27861255 [0,0,0,2,0,0|1,0,1]=4 7226 B11R2.225 O=C1CC[C@@H]2C=C[C@]12CO Amb27972978 [0,0,0,2,0,0|0,0,2]=4 7227 B11R2.226 CCC1C(=O)C2OCCC12 Amb27750222 [0,0,0,2,0,0|2,0,0]=4 7228 B11R2.226 COC1C(=O)C2CCCC21 Amb25285018 [0,0,0,2,0,0|2,0,0]=4 7229 B11R2.226 N[C@@H]1[C@@H](CO)[C@H]2CCC[C@@H]12 Amb33734842 [0,0,0,2,0,0|1,0,1]=4 7230 B11R2.226 N[C@@H]1[C@@H](CO)[C@H]2CCC[C@@H]12 Amb33734843 [0,0,0,2,0,0|1,0,1]=4 7231 B11R2.226 O=C1[C@H]2CCC[C@H]2N1CO Amb28428619 [0,0,0,2,0,0|1,0,0]=3 7232 B11R2.264 CCC1CCC2CC2C1=O Amb23594430 [0,0,0,2,0,0|1,0,0]=3 7233 B11R2.266 OCC1CCC2CCC1N2 Amb27838025 [0,0,0,2,0,0|1,0,1]=4 7234 B11R2.266 OC[C@@H]1CC[C@@H]2CC[C@H]1N2 Amb27449230 [0,0,0,2,0,0|1,0,1]=4 7235 B11R2.471 CC1CCCCCC12CO2 Amb35725720 [0,0,0,2,0,0|1,0,1]=4 7236 B11R2.471 ClC1CCCCCC12CO2 Amb28182466 [0,0,0,2,0,0|1,0,1]=4 7237 B11R2.471 O=C1CCCCCC12CC2 Amb18203004 [0,0,0,2,0,0|1,0,0]=3 7238 B11R2.471 O=C1NCCCCC12CC2 Amb32862915 [0,0,0,2,0,0|2,0,0]=4 7239 B11R2.474 O=C1CCCC2CCC1O2 Amb22364978 [0,0,0,2,0,0|2,0,0]=4 7240 B11R2.474 O=C1CCC[C@H]2CC[C@@H]1C2 Amb27199066 [0,0,0,2,0,0|1,0,0]=3 7241 B11R2.474 O=C1CCC[C@H]2CC[C@@H]1O2 Amb27844151 [0,0,0,2,0,0|2,0,0]=4 7242 B11R2.711 O=C1CC2CCCCCC12 Amb27424796 [0,0,0,2,0,0|1,0,0]=3 7243 B11R2.711 O=C1NC2CCCCCC12 Amb20622529 [0,0,0,2,0,0|2,0,0]=4 7244 B11R2.711 O=C1N[C@@H]2CCCCC[C@H]12 Amb27188465 [0,0,0,2,0,0|2,0,0]=4 7245 B11R2.711 O=C1N[C@H]2CCCCC[C@@H]12 Amb27259331 [0,0,0,2,0,0|2,0,0]=4 7246 B11R2.711 OC1C[C@H]2CCCCC[C@@H]12 Amb28455280 [0,0,0,2,0,0|1,0,1]=4 7247 B11R2.711 O[C@@H]1C[C@@H]2CCCCC[C@@H]21 Amb27197162 [0,0,0,2,0,0|1,0,1]=4 7248 B11R2.1388 C[C@]12CCCC[C@H]1C2CO Amb27254609 [0,0,0,2,0,0|1,0,1]=4 7249 B11R2.118 C=C1CC2CCC1C(=O)C2 Amb28381873 [0,0,0,2,0,0|1,0,1]=4 7250 B11R2.118 C=C1C[C@@H]2CC[C@H]1C(=O)C2 Amb28052287 [0,0,0,2,0,0|1,0,1]=4 7251 B11R2.118 C=C1C[C@@H]2CC[C@H]1[C@H](O)C2 Amb27805066 [0,0,0,2,0,0|1,0,0]=3 7252 B11R2.118 CC1CC2CCC1C(O)C2 Amb26044636 [0,0,0,2,0,0|1,0,1]=4 7253 B11R2.118 CC1CN2CCC1C(=O)C2 Amb27965382 [0,0,0,2,0,0|2,0,0]=4 7254 B11R2.118 CC1CN2CC[C@@H]1C(=O)C2 Amb6298271 [0,0,0,2,0,0|2,0,0]=4 7255 B11R2.118 CN1CC2CCC1C(=O)C2 Amb28041111 [0,0,0,2,0,0|2,0,0]=4 7256 B11R2.118 CN1C[C@@H]2CC[C@@H]1[C@@H](O)C2 Amb28057511 [0,0,0,2,0,0|2,0,0]=4 7257 B11R2.118 CN1C[C@H]2CC[C@H]1C(=O)C2 Amb28052382 [0,0,0,2,0,0|2,0,0]=4 7258 B11R2.118 C[C@@H]1CC2CCC1[C@H](O)C2 Amb3429533 [0,0,0,2,0,0|1,0,1]=4 7259 B11R2.118 C[C@@H]1C[C@@H]2CC[C@H]1[C@@H](O)C2 Amb27422261 [0,0,0,2,0,0|1,0,1]=4 7260 B11R2.118 C[C@@H]1C[C@@H]2CC[C@H]1[C@H](O)C2 Amb27422256 [0,0,0,2,0,0|1,0,1]=4 7261 B11R2.118 C[C@H]1CN2CC[C@@H]1C(=O)C2 Amb27626857 [0,0,0,2,0,0|2,0,0]=4 7262 B11R2.118 O=C1NC2CCC1C(O)C2 Amb27256629 [0,0,0,2,0,0|1,0,0]=3 7263 B11R2.118 O=C1NC2CCC1[C@H](O)C2 Amb26845964 [0,0,0,2,0,0|1,0,0]=3 7264 B11R2.125 CC1CCC2(CO2)C(C)C1 Amb27469525 [0,0,0,2,0,0|1,0,1]=4 7265 B11R2.125 C[C@@H]1CCC2(CC2)C(=O)C1 Amb27781999 [0,0,0,2,0,0|1,0,0]=3 7266 B11R2.162 COC1CC2CC1CC2=O Amb26362049 [0,0,0,2,0,0|2,0,0]=4 7267 B11R2.162 CO[C@@H]1C[C@H]2C[C@@H]1CC2=O Amb33743891 [0,0,0,2,0,0|2,0,0]=4 7268 B11R2.162 CO[C@H]1C[C@@H]2C[C@H]1CC2=O Amb27441565 [0,0,0,2,0,0|2,0,0]=4 7269 B11R2.162 CSC1CC2CC1CC2=O Amb28194572 [0,0,0,2,0,0|2,0,0]=4 7270 B11R2.162 O=C1CC2CC1CC2CBr Amb27491460 [0,0,0,2,0,0|2,0,0]=4 7271 B11R2.162 O=C1CC2CC1CC2CO Amb27226536 [0,0,0,2,0,0|2,0,0]=4 7272 B11R2.162 O=C1CC2CC1C[C@@H]2CO Amb27433059 [0,0,0,2,0,0|2,0,0]=4 7273 B11R2.162 O=C1C[C@@H]2C[C@H]1C[C@@H]2CBr Amb27667028 [0,0,0,2,0,0|2,0,0]=4 7274 B11R2.201 C[C@H]1CC(=O)[C@@H]2CC[C@H]1C2 Amb27256543 [0,0,0,2,0,0|1,0,0]=3 7275 B11R2.222 CCC12CCC(CC1=O)C2 Amb8503566 [0,0,0,2,0,0|1,0,0]=3 7276 B11R2.222 NC1CC2CCC1(CO)C2 Amb33743636 [0,0,0,2,0,0|1,0,1]=4 7277 B11R2.222 NC1CC2CCC1(CO)C2 Amb33743668 [0,0,0,2,0,0|1,0,1]=4 7278 B11R2.222 NCC12CCC(CC1=O)C2 Amb33276099 [0,0,0,2,0,0|1,0,0]=3 7279 B11R2.222 N[C@@H]1C[C@@H]2CC[C@@]1(CO)C2 Amb33803490 [0,0,0,2,0,0|1,0,1]=4 7280 B11R2.222 N[C@@H]1C[C@@H]2CC[C@@]1(CO)C2 Amb33803871 [0,0,0,2,0,0|1,0,1]=4 7281 B11R2.222 O=C1CC2CCC1(CBr)C2 Amb33276075 [0,0,0,2,0,0|1,0,0]=3 7282 B11R2.222 O=C1CC2CCC1(CCl)C2 Amb33276098 [0,0,0,2,0,0|1,0,0]=3 7283 B11R2.222 O=C1CC2CCC1(CO)C2 Amb33254948 [0,0,0,2,0,0|0,0,0]=2 7284 B11R2.222 O=CC12CCC(CC1=O)C2 Amb26365220 [0,0,0,2,0,0|0,0,2]=4 7285 B11R2.222 OCC12CCC(CC1Br)C2 Amb27768723 [0,0,0,2,0,0|1,0,1]=4 7286 B11R2.222 OCC12CC[C@H](C[C@H]1Br)C2 Amb27215378 [0,0,0,2,0,0|1,0,1]=4 7287 B11R2.1 BrC1=NOC2CCCCC12 Amb23449431 [0,0,0,2,0,0|2,0,0]=4 7288 B11R2.1 CC1=NCC2CCCCC12 Amb28250078 [0,0,0,2,0,0|2,0,0]=4 7289 B11R2.1 NC1COC2CCCCC12 Amb23598909 [0,0,0,2,0,0|1,0,1]=4 7290 B11R2.1 NC1COC2CCCCC12 Amb28991390 [0,0,0,2,0,0|1,0,1]=4 7291 B11R2.1 O=C1C=C[C@@H]2CCCC[C@H]12 Amb28052345 [0,0,0,2,0,0|1,0,1]=4 7292 B11R2.1 O=C1C=C[C@H]2CCCC[C@H]12 Amb27253540 [0,0,0,2,0,0|1,0,1]=4 7293 B11R2.1 O=C1CCC2CCCCC12 Amb22365209 [0,0,0,2,0,0|1,0,0]=3 7294 B11R2.1 O=C1CCC2CCCCN12 Amb22230751 [0,0,0,2,0,0|2,0,0]=4 7295 B11R2.1 O=C1CCN2CCCCC12 Amb10610141 [0,0,0,2,0,0|2,0,0]=4 7296 B11R2.1 O=C1CC[C@@H]2CCCC[C@H]12 Amb26053513 [0,0,0,2,0,0|1,0,0]=3 7297 B11R2.1 O=C1CC[C@H]2CCCCN12 Amb28141967 [0,0,0,2,0,0|2,0,0]=4 7298 B11R2.1 O=C1CNC2CCNCC12 Amb28060706 [0,0,0,2,0,0|2,0,0]=4 7299 B11R2.1 O=C1CNC2CCSCC12 Amb27419774 [0,0,0,2,0,0|2,0,0]=4 7300 B11R2.1 O=C1CO[C@@H]2CCCC[C@H]12 Amb27780819 [0,0,0,2,0,0|0,0,0]=2 7301 B11R2.1 O=C1CO[C@@H]2OCCC[C@H]12 Amb27802667 [0,0,0,2,0,0|1,0,0]=3 7302 B11R2.1 O=C1NCC2CCCCC12 Amb20247550 [0,0,0,2,0,0|2,0,0]=4 7303 B11R2.1 O=C1NC[C@@H]2CCCC[C@@H]12 Amb25175082 [0,0,0,2,0,0|2,0,0]=4 7304 B11R2.1 O=C1NC[C@@H]2CCCC[C@H]12 Amb25174981 [0,0,0,2,0,0|2,0,0]=4 7305 B11R2.1 O=C1NC[C@H]2CCCC[C@H]12 Amb27472808 [0,0,0,2,0,0|2,0,0]=4 7306 B11R2.1 O=C1NO[C@@H]2CNCC[C@H]12 Amb24515004 [0,0,0,2,0,0|2,0,0]=4 7307 B11R2.1 O=C1OCC2CCCCC12 Amb22551108 [0,0,0,2,0,0|2,0,0]=4 7308 B11R2.1 O=C1OC[C@@H]2CCCC[C@H]12 Amb26594527 [0,0,0,2,0,0|2,0,0]=4 7309 B11R2.1 OC1COC2CCCCC12 Amb27662205 [0,0,0,2,0,0|0,0,2]=4 7310 B11R2.1 OC1CO[C@@H]2CCCC[C@H]12 Amb27261694 [0,0,0,2,0,0|0,0,2]=4 7311 B11R2.1 O[C@@H]1CO[C@@H]2CCCC[C@H]12 Amb27486575 [0,0,0,2,0,0|0,0,2]=4 7312 B11R2.1 O[C@H]1CO[C@@H]2CCCC[C@H]12 Amb27448752 [0,0,0,2,0,0|0,0,2]=4 7313 B11R2.3 C=C1CCCC12CCCC2 Amb25172666 [0,0,0,2,0,0|2,0,0]=4 7314 B11R2.3 O=C1C=CCC12CCCC2 Amb28049887 [0,0,0,2,0,0|1,0,1]=4 7315 B11R2.3 O=C1CCCC12CCCC2 Amb17593511 [0,0,0,2,0,0|1,0,0]=3 7316 B11R2.3 O=C1CCCC12CCCN2 Amb27473292 [0,0,0,2,0,0|2,0,0]=4 7317 B11R2.3 O=C1CCCC12CCCO2 Amb22737397 [0,0,0,2,0,0|2,0,0]=4 7318 B11R2.3 O=C1CCCC12CCNC2 Amb18832016 [0,0,0,2,0,0|2,0,0]=4 7319 B11R2.3 O=C1CCC[C@@]12CCCS2 Amb27598013 [0,0,0,2,0,0|2,0,0]=4 7320 B11R2.3 O=C1CCC[C@]12CCCO2 Amb26492771 [0,0,0,2,0,0|2,0,0]=4 7321 B11R2.3 O=C1CCOC12CCCC2 Amb25371947 [0,0,0,2,0,0|2,0,0]=4 7322 B11R2.3 O=C1CNCC12CCCC2 Amb27204694 [0,0,0,2,0,0|1,0,0]=3 7323 B11R2.3 O=C1NCCC12CCCC2 Amb20242297 [0,0,0,2,0,0|2,0,0]=4 7324 B11R2.3 O=C1OCCC12CCCC2 Amb26503686 [0,0,0,2,0,0|2,0,0]=4 7325 B11R2.60 O=C1CC[C@@H]2[C@@H](O)CC[C@H]12 Amb27880611 [0,0,0,2,0,0|2,0,0]=4 7326 B11R2.102 O=C1NC2CCCCC1C2 Amb28292243 [0,0,0,2,0,0|2,0,0]=4 7327 B11R2.115 O=C1CCCC1CC2CC2 Amb27867430 [0,0,0,2,0,0|1,0,0]=3 7328 B11R2.115 O=C1CNCN1CC2CC2 Amb28369474 [0,0,0,2,0,0|2,0,0]=4 7329 B11R2.115 O=C1COCC1CC2CC2 Amb33741687 [0,0,0,2,0,0|0,0,0]=2 7330 B11R2.115 O=C1NCCC1CC2CC2 Amb26556595 [0,0,0,2,0,0|2,0,0]=4 7331 B11R2.115 OC1COCC1CC2CC2 Amb32950532 [0,0,0,2,0,0|0,0,2]=4 7332 B11R2.115 O[C@@H]1COC[C@H]1CC2CC2 Amb32950453 [0,0,0,2,0,0|0,0,2]=4 7333 B11R2.158 CCC1OC12CCCC2=O Amb28246547 [0,0,0,2,0,0|2,0,0]=4 7334 B11R2.177 CO[C@@H]1C[C@@H]2CC[C@@H]1C2=O Amb27781649 [0,0,0,2,0,0|2,0,0]=4 7335 B11R2.177 CO[C@@H]1C[C@H]2CC[C@H]1C2=O Amb27435459 [0,0,0,2,0,0|2,0,0]=4 7336 B11R2.177 CO[C@H]1C[C@H]2CC[C@@H]1C2=O Amb28194548 [0,0,0,2,0,0|2,0,0]=4 7337 B11R2.350 CCC[C@H]1[C@@H]2CCC(=O)[C@H]12 Amb27432614 [0,0,0,2,0,0|1,0,0]=3 7338 B11R2.350 COCC1C2CCC(=O)C21 Amb24588868 [0,0,0,2,0,0|2,0,0]=4 7339 B11R2.402 C[C@]12CCCC[C@H]1COC2 Amb25974054 [0,0,0,2,0,0|1,0,1]=4 7340 B11R2.459 BrC1COCC1C2CCC2 Amb35736887 [0,0,0,2,0,0|1,0,1]=4 7341 B11R2.459 ClC1COCC1C2CCC2 Amb35736793 [0,0,0,2,0,0|1,0,1]=4 7342 B11R2.459 NC1COCC1C2CCC2 Amb27633458 [0,0,0,2,0,0|1,0,1]=4 7343 B11R2.459 O=C1CCCC1C2CCC2 Amb26555851 [0,0,0,2,0,0|1,0,0]=3 7344 B11R2.459 O=C1CNCN1C2CCC2 Amb28188966 [0,0,0,2,0,0|2,0,0]=4 7345 B11R2.459 O=C1COCC1C2CCC2 Amb35639026 [0,0,0,2,0,0|0,0,0]=2 7346 B11R2.459 OC1COCC1C2CCC2 Amb32944271 [0,0,0,2,0,0|0,0,2]=4 7347 B11R2.459 O[C@@H]1COC[C@H]1C2CCC2 Amb32950766 [0,0,0,2,0,0|0,0,2]=4 7348 B11R2.169 O=C1CC2OC(CO)CN12 Amb27946573 [0,0,0,2,0,0|2,0,0]=4 7349 B11R2.169 O=C1C[C@@H]2O[C@@H](CBr)CN12 Amb27440157 [0,0,0,2,0,0|2,0,0]=4 7350 B11R2.576 CC(=O)[C@@]12CC[C@@H](C1)[C@H]2C Amb28054455 [0,0,0,2,0,0|1,0,0]=3 7351 B11R2.842 CC(=O)N1CC2CCC2C1 Amb29872147 [0,0,0,2,0,0|2,0,0]=4 7352 B11R2.842 NC(=O)C1CC2CCC2C1 Amb24408898 [0,0,0,2,0,0|2,0,0]=4 7353 B11R2.842 O=C(Cl)C1CC2CCC2C1 Amb27983531 [0,0,0,2,0,0|2,0,0]=4 7354 B11R2.842 O=C(O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|2,0,0]=4 7355 B11R2.845 C=C(C)C1CC2CCC1O2 Amb27860408 [0,0,0,2,0,0|1,0,0]=3 7356 B11R2.845 CC(=O)C1CC2CCC1C2 Amb2154722 [0,0,0,2,0,0|1,0,0]=3 7357 B11R2.845 CC(=O)C1CC2CCC1N2 Amb28050434 [0,0,0,2,0,0|1,0,0]=3 7358 B11R2.845 CC(=O)C1CC2CCC1O2 Amb22284669 [0,0,0,2,0,0|0,0,0]=2 7359 B11R2.845 CC(=O)C1CN2CCC1C2 Amb28049861 [0,0,0,2,0,0|2,0,0]=4 7360 B11R2.845 CC(=O)C1C[C@H]2CC[C@@H]1C2 Amb25292344 [0,0,0,2,0,0|1,0,0]=3 7361 B11R2.845 CC(=O)[C@@H]1CN2CC[C@@H]1C2 Amb28052568 [0,0,0,2,0,0|2,0,0]=4 7362 B11R2.845 CC(=O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb28351653 [0,0,0,2,0,0|1,0,0]=3 7363 B11R2.845 CC(=O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb28253667 [0,0,0,2,0,0|0,0,0]=2 7364 B11R2.845 CC(=O)[C@H]1C[C@H]2CC[C@H]1C2 Amb28052355 [0,0,0,2,0,0|1,0,0]=3 7365 B11R2.845 CC(N)C1CC2CCC1O2 Amb26612508 [0,0,0,2,0,0|1,0,1]=4 7366 B11R2.845 CC(O)C1CC2CCC1O2 Amb27622617 [0,0,0,2,0,0|0,0,2]=4 7367 B11R2.845 CC(S)C1CC2CCC1O2 Amb27860418 [0,0,0,2,0,0|0,1,1]=4 7368 B11R2.845 C[C@@H](N)C1CC2CCC1O2 Amb27979878 [0,0,0,2,0,0|1,0,1]=4 7369 B11R2.845 C[C@@H](O)C1CC2CCC1O2 Amb26026083 [0,0,0,2,0,0|0,0,2]=4 7370 B11R2.845 C[C@H](N)C1CC2CCC1O2 Amb27829161 [0,0,0,2,0,0|1,0,1]=4 7371 B11R2.845 C[C@H](O)C1CC2CCC1O2 Amb24576125 [0,0,0,2,0,0|0,0,2]=4 7372 B11R2.845 N=C(N)C1CC2CCC1O2 Amb26069306 [0,0,0,2,0,0|2,0,0]=4 7373 B11R2.845 NC(=O)C1CC2CCC1O2 Amb24615277 [0,0,0,2,0,0|1,0,0]=3 7374 B11R2.845 NC(=O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb32723446 [0,0,0,2,0,0|2,0,0]=4 7375 B11R2.845 NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb27975970 [0,0,0,2,0,0|1,0,0]=3 7376 B11R2.845 NC(=O)[C@H]1CC2CCC1C2 Amb27831874 [0,0,0,2,0,0|2,0,0]=4 7377 B11R2.845 NC(=O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb28429311 [0,0,0,2,0,0|2,0,0]=4 7378 B11R2.845 NC(=S)C1CC2CCC1O2 Amb27185747 [0,0,0,2,0,0|1,1,0]=4 7379 B11R2.845 O=C(Cl)C1CC2CCC1C2 Amb6744961 [0,0,0,2,0,0|2,0,0]=4 7380 B11R2.845 O=C(O)C1CC2CCC1C2 Amb32643951 [0,0,0,2,0,0|2,0,0]=4 7381 B11R2.845 O=C(O)C1CC2CCC1C2 Amb6335820 [0,0,0,2,0,0|2,0,0]=4 7382 B11R2.845 O=C(O)C1CC2CCC1N2 Amb28048880 [0,0,0,2,0,0|2,0,0]=4 7383 B11R2.845 O=C(O)C1CC2CCC1N2 Amb32932453 [0,0,0,2,0,0|2,0,0]=4 7384 B11R2.845 O=C(O)C1CC2CCC1O2 Amb18202638 [0,0,0,2,0,0|1,0,0]=3 7385 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 Amb28068735 [0,0,0,2,0,0|2,0,0]=4 7386 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]1O2 Amb28133849 [0,0,0,2,0,0|1,0,0]=3 7387 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb27421974 [0,0,0,2,0,0|2,0,0]=4 7388 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23385246 [0,0,0,2,0,0|2,0,0]=4 7389 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 Amb24120328 [0,0,0,2,0,0|1,0,0]=3 7390 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24630346 [0,0,0,2,0,0|2,0,0]=4 7391 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23385249 [0,0,0,2,0,0|2,0,0]=4 7392 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1N2 Amb27254084 [0,0,0,2,0,0|2,0,0]=4 7393 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19334556 [0,0,0,2,0,0|1,0,0]=3 7394 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@H]1O2 Amb27963653 [0,0,0,2,0,0|1,0,0]=3 7395 B11R2.845 O=C(O)[C@H]1CC2CCC1C2 Amb27252127 [0,0,0,2,0,0|2,0,0]=4 7396 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 Amb27420163 [0,0,0,2,0,0|2,0,0]=4 7397 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2 Amb27631268 [0,0,0,2,0,0|2,0,0]=4 7398 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1O2 Amb27810803 [0,0,0,2,0,0|1,0,0]=3 7399 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb24548859 [0,0,0,2,0,0|2,0,0]=4 7400 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1O2 Amb24681023 [0,0,0,2,0,0|1,0,0]=3 7401 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@H]1O2 Amb25230625 [0,0,0,2,0,0|1,0,0]=3 7402 B11R2.845 O=S([O-])C1CC2CCC1O2 Amb32755231 [0,0,0,2,0,0|2,0,0]=4 7403 B11R2.845 O=S([O-])[C@@H]1C[C@@H]2CC[C@H]1O2 Amb32755223 [0,0,0,2,0,0|2,0,0]=4 7404 B11R2.845 O=S([O-])[C@H]1C[C@@H]2CC[C@H]1O2 Amb32755235 [0,0,0,2,0,0|2,0,0]=4 7405 B11R2.1005 CCC1CC2(CO1)CC2N Amb35614901 [0,0,0,2,0,0|1,0,1]=4 7406 B11R2.1868 CC(=O)N1CCC2(CC2)C1 Amb27631081 [0,0,0,2,0,0|2,0,0]=4 7407 B11R2.1868 O=C(O)C1CCC2(CC2)C1 Amb28423485 [0,0,0,2,0,0|2,0,0]=4 7408 B11R2.116 CN1CC2CCC(O)C1C2 Amb27857471 [0,0,0,2,0,0|2,0,0]=4 7409 B11R2.116 N[C@H]1CC[C@@H]2C[C@H]1C(=O)N2 Amb28134623 [0,0,0,2,0,0|2,0,0]=4 7410 B11R2.116 N[C@H]1CC[C@@H]2C[C@H]1C(=O)O2 Amb27815062 [0,0,0,2,0,0|2,0,0]=4 7411 B11R2.116 O=C1CC2CCC(Cl)C1C2 Amb27454991 [0,0,0,2,0,0|1,0,0]=3 7412 B11R2.116 O=C1CCC2CC(=O)C1C2 Amb23452863 [0,0,0,2,0,0|0,0,2]=4 7413 B11R2.738 CC1=CC2CC1C(O)C2O Amb28138574 [0,0,0,2,0,0|2,0,0]=4 7414 B11R2.738 CC1C2CC(=O)C(C2)C1C Amb27954198 [0,0,0,2,0,0|1,0,0]=3 7415 B11R2.738 C[C@@H]1[C@@H]2C[C@H](CC2=O)[C@@H]1C Amb27432687 [0,0,0,2,0,0|1,0,0]=3 7416 B11R2.738 O=C1CC2CC1C(Cl)C2Cl Amb27838127 [0,0,0,2,0,0|2,0,0]=4 7417 B11R2.738 O=C1C[C@@H]2C[C@@H]1[C@H](Cl)[C@H]2Cl Amb27491036 [0,0,0,2,0,0|2,0,0]=4 7418 B11R2.738 O=C1C[C@@H]2C[C@H]1[C@@H](F)[C@H]2F Amb25202301 [0,0,0,2,0,0|2,0,0]=4 7419 B11R2.738 O=C1C[C@H]2C[C@@H]1[C@@H](O)[C@@H]2O Amb27858294 [0,0,0,2,0,0|1,0,0]=3 7420 B11R2.738 O=C1C[C@H]2O[C@@H]1[C@@H](O)[C@@H]2O Amb28057554 [0,0,0,2,0,0|2,0,0]=4 7421 B11R2.738 O=C1NC2CC1C(O)C2O Amb25229024 [0,0,0,2,0,0|2,0,0]=4 7422 B11R2.738 O=C1N[C@@H]2C[C@H]1[C@@H](O)[C@H]2O Amb24669283 [0,0,0,2,0,0|2,0,0]=4 7423 B11R2.22 OCC1CCCCC12CO2 Amb28292565 [0,0,0,2,0,0|0,0,2]=4 7424 B11R2.200 CC12CCCCC1C(=O)C2 Amb27236759 [0,0,0,2,0,0|1,0,0]=3 7425 B11R2.200 CC12CCCCC1C(=O)N2 Amb27236881 [0,0,0,2,0,0|2,0,0]=4 7426 B11R2.200 C[C@@]12CCCC[C@@H]1C(=O)N2 Amb25811658 [0,0,0,2,0,0|2,0,0]=4 7427 B11R2.1081 CC12CCCCC1(CO)O2 Amb27472559 [0,0,0,2,0,0|0,0,2]=4 7428 B11R2.1688 CC1(C)CCCCC12CO2 Amb27261467 [0,0,0,2,0,0|1,0,1]=4 7429 B11R2.38 CC1CC12CCCCC2O Amb27589725 [0,0,0,2,0,0|1,0,1]=4 7430 B11R2.38 CC1C[C@]12CCCC[C@@H]2O Amb27452012 [0,0,0,2,0,0|1,0,1]=4 7431 B11R2.55 OC1CCCCC1C2CC2 Amb25736550 [0,0,0,2,0,0|1,0,1]=4 7432 B11R2.55 OC1CCCCC1C2CO2 Amb28043717 [0,0,0,2,0,0|0,0,2]=4 7433 B11R2.55 O[C@@H]1CCCC[C@H]1C2CC2 Amb25210827 [0,0,0,2,0,0|1,0,1]=4 7434 B11R2.468 O=C1CC2SCCC(O)N12 Amb28050765 [0,0,0,2,0,0|2,0,0]=4 7435 B11R2.540 NC1CCC2CC12C(=O)O Amb27796812 [0,0,0,2,0,0|2,0,0]=4 7436 B11R2.608 NC1C(C(=O)O)CC2CC21 Amb27445578 [0,0,0,2,0,0|2,0,0]=4 7437 B11R2.718 CC1(C)C2CCCC(O)C21 Amb27753050 [0,0,0,2,0,0|1,0,1]=4 7438 B11R2.718 CC1(C)[C@H]2[C@@H](O)CCC[C@H]21 Amb27452898 [0,0,0,2,0,0|1,0,1]=4 7439 B11R2.732 CC1(C)C2CCC1C(O)C2 Amb27220270 [0,0,0,2,0,0|1,0,1]=4 7440 B11R2.732 CC1(C)[C@@H]2CC[C@H]1[C@@H](O)C2 Amb27431361 [0,0,0,2,0,0|1,0,1]=4 7441 B11R2.732 CC1(C)[C@H]2CC[C@@H]1[C@H](O)C2 Amb28129650 [0,0,0,2,0,0|1,0,1]=4 7442 B11R2.813 CC(=O)C12C=CCCC1C2 Amb25707920 [0,0,0,2,0,0|1,0,1]=4 7443 B11R2.813 CC(=O)C12CCCCC1C2 Amb24602616 [0,0,0,2,0,0|1,0,0]=3 7444 B11R2.813 CC(=O)C12CCCCC1O2 Amb26992382 [0,0,0,2,0,0|0,0,0]=2 7445 B11R2.813 CC(=O)[C@@]12CCCC[C@@H]1C2 Amb27267199 [0,0,0,2,0,0|1,0,0]=3 7446 B11R2.813 CC(=O)[C@@]12CCCC[C@@H]1O2 Amb27440077 [0,0,0,2,0,0|0,0,0]=2 7447 B11R2.813 CN(C)C12CCCCC1O2 Amb27409347 [0,0,0,2,0,0|2,0,0]=4 7448 B11R2.813 C[C@H](O)[C@@]12CCCC[C@@H]1O2 Amb27422228 [0,0,0,2,0,0|0,0,2]=4 7449 B11R2.813 C[C@H](O)[C@]12CCCC[C@H]1O2 Amb27198080 [0,0,0,2,0,0|0,0,2]=4 7450 B11R2.813 NC(=O)C12CCCCC1C2 Amb35692384 [0,0,0,2,0,0|2,0,0]=4 7451 B11R2.813 NC(=O)C12CNCCC1C2 Amb27670222 [0,0,0,2,0,0|2,0,0]=4 7452 B11R2.813 O=C(Cl)C12CCCCC1C2 Amb27760357 [0,0,0,2,0,0|2,0,0]=4 7453 B11R2.813 O=C(O)C12CCCCC1C2 Amb25709012 [0,0,0,2,0,0|2,0,0]=4 7454 B11R2.813 O=C(O)C12CCCCC1O2 Amb26396244 [0,0,0,2,0,0|1,0,0]=3 7455 B11R2.813 O=C(O)C12CNCCC1C2 Amb10610566 [0,0,0,2,0,0|2,0,0]=4 7456 B11R2.813 O=C(O)C12CNCCC1C2 Amb24426368 [0,0,0,2,0,0|2,0,0]=4 7457 B11R2.813 O=C(O)C12CNCCC1O2 Amb28434668 [0,0,0,2,0,0|2,0,0]=4 7458 B11R2.813 O=C(O)C12COCCC1O2 Amb27240327 [0,0,0,2,0,0|2,0,0]=4 7459 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662009 [0,0,0,2,0,0|2,0,0]=4 7460 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1C2 Amb32662022 [0,0,0,2,0,0|2,0,0]=4 7461 B11R2.813 O=C(O)[C@@]12CNCC[C@@H]1O2 Amb27252360 [0,0,0,2,0,0|2,0,0]=4 7462 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662007 [0,0,0,2,0,0|2,0,0]=4 7463 B11R2.813 O=C(O)[C@@]12CNCC[C@H]1C2 Amb32662020 [0,0,0,2,0,0|2,0,0]=4 7464 B11R2.813 O=C(O)[C@]12CNCC[C@@H]1C2 Amb28429201 [0,0,0,2,0,0|2,0,0]=4 7465 B11R2.838 CC(=O)C1CCC2CC21C Amb26477247 [0,0,0,2,0,0|1,0,0]=3 7466 B11R2.1726 CC1C2CCCC12C(=O)O Amb28251035 [0,0,0,2,0,0|2,0,0]=4 7467 B11R2.1726 O=C(O)C12CCCC1C2Br Amb32666703 [0,0,0,2,0,0|2,0,0]=4 7468 B11R2.1726 O=C(O)[C@@]12CCC[C@@H]1[C@H]2Br Amb32679607 [0,0,0,2,0,0|2,0,0]=4 7469 B11R2.1726 O=C(O)[C@]12CCC[C@H]1[C@@H]2Br Amb32668409 [0,0,0,2,0,0|2,0,0]=4 7470 B11R2.1824 CC(=O)C1C2CCCC1C2 Amb28246563 [0,0,0,2,0,0|1,0,0]=3 7471 B11R2.1837 CC(=O)N1CCC[C@@H]2C[C@@H]21 Amb27979316 [0,0,0,2,0,0|2,0,0]=4 7472 B11R2.1837 NC(=O)C1CCCC2CC21 Amb30008213 [0,0,0,2,0,0|2,0,0]=4 7473 B11R2.1837 O=C(Cl)C1CCCC2CC21 Amb30007985 [0,0,0,2,0,0|2,0,0]=4 7474 B11R2.1837 O=C(O)C1CCCC2CC21 Amb26335134 [0,0,0,2,0,0|2,0,0]=4 7475 B11R2.1837 O=C(O)C1CCCC2OC21 Amb26014539 [0,0,0,2,0,0|1,0,0]=3 7476 B11R2.1837 O=C(O)[C@@H]1CCC[C@@H]2O[C@@H]21 Amb27626945 [0,0,0,2,0,0|1,0,0]=3 7477 B11R2.1837 O=C(O)[C@H]1CCC[C@@H]2C[C@H]12 Amb27630509 [0,0,0,2,0,0|2,0,0]=4 7478 B11R2.1854 C[C@]12CCC[C@@H]1[C@@H]2C(=O)O Amb28423498 [0,0,0,2,0,0|2,0,0]=4 7479 B11R2.814 CC(=O)C1CC2CCOC21 Amb33330259 [0,0,0,2,0,0|0,0,0]=2 7480 B11R2.814 CC(=O)N1CC2CCCC21 Amb28065396 [0,0,0,2,0,0|2,0,0]=4 7481 B11R2.814 NC(=O)C1CC2CCCC21 Amb25269534 [0,0,0,2,0,0|2,0,0]=4 7482 B11R2.814 O=C(O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|2,0,0]=4 7483 B11R2.814 O=C(O)C1C[C@H]2CCC[C@@H]12 Amb28196683 [0,0,0,2,0,0|2,0,0]=4 7484 B11R2.814 O=C(O)[C@@H]1C[C@H]2CCO[C@H]21 Amb28059243 [0,0,0,2,0,0|1,0,0]=3 7485 B11R2.819 O=C(O)C12CCC1CNC2 Amb25688250 [0,0,0,2,0,0|2,0,0]=4 7486 B11R2.819 O=C(O)C12CCC1CNC2 Amb32661276 [0,0,0,2,0,0|2,0,0]=4 7487 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb32992853 [0,0,0,2,0,0|2,0,0]=4 7488 B11R2.819 O=C(O)[C@]12CC[C@H]1CNC2 Amb33482775 [0,0,0,2,0,0|2,0,0]=4 7489 B11R2.1869 O=C(O)C1CCC12CCC2 Amb27882602 [0,0,0,2,0,0|2,0,0]=4 7490 B11R2.435 CC1CC12C(C)C2C(=O)O Amb28434593 [0,0,0,2,0,0|2,0,0]=4 7491 B11R2.435 C[C@@H]1C[C@]12[C@H](C)[C@H]2C(=O)O Amb28411312 [0,0,0,2,0,0|2,0,0]=4 7492 B11R2.1493 CC1C(C(=O)O)C1C2CC2 Amb32668498 [0,0,0,2,0,0|2,0,0]=4 7493 B11R2.1852 CC(=O)C1C2CCCNC21 Amb27469821 [0,0,0,2,0,0|1,0,0]=3 7494 B11R2.1852 CC(=O)C1C2CCCSC21 Amb27883048 [0,0,0,2,0,0|0,1,0]=3 7495 B11R2.1852 CC(=O)C1[C@H]2CCCC[C@@H]12 Amb27440691 [0,0,0,2,0,0|1,0,0]=3 7496 B11R2.1852 CC(=O)C1[C@H]2CCCS[C@@H]12 Amb28240533 [0,0,0,2,0,0|0,1,0]=3 7497 B11R2.1852 CC(=O)[C@H]1[C@@H]2OCCO[C@@H]21 Amb27749800 [0,0,0,2,0,0|1,0,0]=3 7498 B11R2.1852 NC(=O)C1C2CCCCC21 Amb25983598 [0,0,0,2,0,0|2,0,0]=4 7499 B11R2.1852 NC(=O)[C@H]1[C@H]2CCCC[C@H]21 Amb27173630 [0,0,0,2,0,0|2,0,0]=4 7500 B11R2.1852 O=C(O)C1C2CCCCC21 Amb9774962 [0,0,0,2,0,0|2,0,0]=4 7501 B11R2.1852 O=C(O)C1C2CCCNC21 Amb18831774 [0,0,0,2,0,0|2,0,0]=4 7502 B11R2.1852 O=C(O)C1C2CCCOC21 Amb9677556 [0,0,0,2,0,0|1,0,0]=3 7503 B11R2.1852 O=C(O)C1C2OCCOC21 Amb26885378 [0,0,0,2,0,0|2,0,0]=4 7504 B11R2.1852 O=C(O)C1[C@H]2CCCO[C@@H]12 Amb28135263 [0,0,0,2,0,0|1,0,0]=3 7505 B11R2.1852 O=C(O)C1[C@H]2CCCS[C@@H]12 Amb27403707 [0,0,0,2,0,0|1,1,0]=4 7506 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCC[C@H]21 Amb27615049 [0,0,0,2,0,0|2,0,0]=4 7507 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCO[C@H]21 Amb27784643 [0,0,0,2,0,0|1,0,0]=3 7508 B11R2.1852 O=C(O)[C@H]1[C@@H]2CCCO[C@@H]21 Amb25296387 [0,0,0,2,0,0|1,0,0]=3 7509 B11R2.1852 O=C(O)[C@H]1[C@@H]2OCCO[C@@H]21 Amb28397915 [0,0,0,2,0,0|2,0,0]=4 7510 B11R2.1852 O=C(O)[C@H]1[C@H]2CCCO[C@@H]12 Amb27784682 [0,0,0,2,0,0|1,0,0]=3 7511 B11R2.1362 CC1(C)C(CO)C12CCC2 Amb27256718 [0,0,0,2,0,0|1,0,1]=4 7512 B11R2.1734 CC1(C)[C@H]2CC[C@]1(C)[C@H]2O Amb28429632 [0,0,0,2,0,0|1,0,1]=4 7513 B11R2.451 CC(=O)C1(C2CC2C)CC1 Amb33143876 [0,0,0,2,0,0|1,0,0]=3 7514 B11R2.451 CC1CC1C2(C(=O)O)CC2 Amb33145411 [0,0,0,2,0,0|2,0,0]=4 7515 B11R2.128 CC1NC(=O)C1C2CCC2 Amb27212705 [0,0,0,2,0,0|2,0,0]=4 7516 B11R2.1876 CC(=O)C1(C2CCC2)CC1 Amb33225933 [0,0,0,2,0,0|1,0,0]=3 7517 B11R2.1876 O=C(O)C1(C2CCC2)CC1 Amb26018203 [0,0,0,2,0,0|2,0,0]=4 7518 B11R2.72 NC1CC(O)C12CCCC2 Amb33035206 [0,0,0,2,0,0|1,0,1]=4 7519 B11R2.1882 CC(=O)C1(CC2CC2)CC1 Amb27874902 [0,0,0,2,0,0|1,0,0]=3 7520 B11R2.1882 O=C(O)C1(CC2CC2)CC1 Amb22737091 [0,0,0,2,0,0|2,0,0]=4 7521 B9R0.4 C=C(C)CC(O)CCCC Amb27221835 [1,0,0,0,0,1|1,0,0]=3 7522 B9R0.4 C=C(C)CC(O)CCCCl Amb27648663 [1,0,0,0,0,1|2,0,0]=4 7523 B9R0.4 C=C(C)CC(O)CCSC Amb27805568 [1,0,0,0,0,1|2,0,0]=4 7524 B9R0.4 C=C(C)CC(O)COCC Amb27960730 [1,0,0,0,0,1|2,0,0]=4 7525 B9R0.4 C=CCCC(C)CC(C)=O Amb24738371 [1,0,0,0,0,1|0,0,2]=4 7526 B9R0.4 C=CCC[C@@H](O)CC(C)=O Amb28122093 [1,0,0,0,0,1|0,0,2]=4 7527 B9R0.4 CC#CCC(C)CC(C)=O Amb27839057 [1,0,0,0,0,1|0,0,2]=4 7528 B9R0.4 CC(=O)CC(C)CCC=O Amb27838122 [1,0,0,0,0,1|1,0,1]=4 7529 B9R0.4 CC(=O)C[C@@H](O)CCC#N Amb26599245 [1,0,0,0,0,1|1,0,1]=4 7530 B9R0.4 CC(=O)C[C@H](O)CCC#N Amb28314339 [1,0,0,0,0,1|1,0,1]=4 7531 B9R0.4 CC(=O)NC(C)CCCO Amb28120258 [1,0,0,0,0,1|1,0,0]=3 7532 B9R0.4 CC(=O)OC(C)COCCl Amb27244906 [1,0,0,0,0,1|2,0,0]=4 7533 B9R0.4 CC(C)=CC(C)CCCO Amb28079248 [1,0,0,0,0,1|2,0,0]=4 7534 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [1,0,0,0,0,1|2,0,0]=4 7535 B9R0.4 CC(CCCN)NS(C)=O Amb28199697 [1,0,0,0,0,1|2,0,0]=4 7536 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [1,0,0,0,0,1|2,0,0]=4 7537 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [1,0,0,0,0,1|2,0,0]=4 7538 B9R0.4 CCCCC(=O)CC(C)=O Amb9775080 [1,0,0,0,0,1|0,0,2]=4 7539 B9R0.4 CCCCC(=O)OC(C)=O Amb34916560 [1,0,0,0,0,1|0,0,2]=4 7540 B9R0.4 CCCCC(=S)NC(C)=O Amb28341039 [1,0,0,0,0,1|0,1,1]=4 7541 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [1,0,0,0,0,1|1,0,0]=3 7542 B9R0.4 CCCCC(C)CC(C)Cl Amb27972096 [1,0,0,0,0,1|1,0,1]=4 7543 B9R0.4 CCCCC(C)CC(C)N Amb27618079 [1,0,0,0,0,1|1,0,1]=4 7544 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [1,0,0,0,0,1|0,0,2]=4 7545 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [1,0,0,0,0,1|1,0,0]=3 7546 B9R0.4 CCCCC(C)NC(=N)N Amb27790523 [1,0,0,0,0,1|2,0,0]=4 7547 B9R0.4 CCCCC(C)NC(C)=O Amb27487886 [1,0,0,0,0,1|0,0,0]=2 7548 B9R0.4 CCCCC(C)NC(C)C Amb9622306 [1,0,0,0,0,1|1,0,1]=4 7549 B9R0.4 CCCCC(C)OC(=O)Cl Amb32654980 [1,0,0,0,0,1|1,0,0]=3 7550 B9R0.4 CCCCC(C)OC(C)=O Amb27594424 [1,0,0,0,0,1|0,0,0]=2 7551 B9R0.4 CCCCC(C)OC(N)=O Amb28050035 [1,0,0,0,0,1|1,0,0]=3 7552 B9R0.4 CCCCC(N)C=C(C)C Amb27486513 [1,0,0,0,0,1|2,0,0]=4 7553 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [1,0,0,0,0,1|2,0,0]=4 7554 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [1,0,0,0,0,1|2,0,0]=4 7555 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [1,0,0,0,0,1|2,0,0]=4 7556 B9R0.4 CCCCC(O)C=C(Cl)Cl Amb27394754 [1,0,0,0,0,1|2,0,0]=4 7557 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [1,0,0,0,0,1|1,0,0]=3 7558 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [1,0,0,0,0,1|0,0,0]=2 7559 B9R0.4 CCCCC(O)CC(C)C Amb22734801 [1,0,0,0,0,1|1,0,1]=4 7560 B9R0.4 CCCCN(C)CC(=O)Cl Amb17142904 [1,0,0,0,0,1|2,0,0]=4 7561 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [1,0,0,0,0,1|2,0,0]=4 7562 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [1,0,0,0,0,1|1,0,0]=3 7563 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [1,0,0,0,0,1|0,0,0]=2 7564 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [1,0,0,0,0,1|2,0,0]=4 7565 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [1,0,0,0,0,1|2,0,0]=4 7566 B9R0.4 CCCC[C@@H](O)C=C(C)C Amb27650406 [1,0,0,0,0,1|1,0,0]=3 7567 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [1,0,0,0,0,1|1,0,0]=3 7568 B9R0.4 CCCC[C@@H](O)CC(C)C Amb27399625 [1,0,0,0,0,1|1,0,1]=4 7569 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [1,0,0,0,0,1|0,0,2]=4 7570 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [1,0,0,0,0,1|1,0,0]=3 7571 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [1,0,0,0,0,1|0,0,0]=2 7572 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [1,0,0,0,0,1|1,0,0]=3 7573 B9R0.4 CCCC[C@H](C)NC(C)=O Amb27173638 [1,0,0,0,0,1|0,0,0]=2 7574 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [1,0,0,0,0,1|2,0,0]=4 7575 B9R0.4 CCCC[C@H](O)CC(C)C Amb28429013 [1,0,0,0,0,1|1,0,1]=4 7576 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [1,0,0,0,0,1|0,0,2]=4 7577 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [1,0,0,0,0,1|0,0,2]=4 7578 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [1,0,0,0,0,1|1,0,1]=4 7579 B9R0.4 CCCC\C(C)=N\C(N)=O Amb27645991 [1,0,0,0,0,1|1,0,1]=4 7580 B9R0.4 CCCC\C(O)=C/C(C)=O Amb28184671 [1,0,0,0,0,1|0,0,1]=3 7581 B9R0.4 CCCC\C(O)=C\C(C)=O Amb27432598 [1,0,0,0,0,1|0,0,1]=3 7582 B9R0.4 CCCN\C(C)=C/C(C)=O Amb27410248 [1,0,0,0,0,1|1,0,1]=4 7583 B9R0.4 CCCOC(C)CC(C)=O Amb28344519 [1,0,0,0,0,1|1,0,0]=3 7584 B9R0.4 CCC\C=C(\C)CC(C)=O Amb28285885 [1,0,0,0,0,1|0,0,2]=4 7585 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [1,0,0,0,0,1|2,0,0]=4 7586 B9R0.4 CCOCC(C)OC(=O)Cl Amb26020310 [1,0,0,0,0,1|2,0,0]=4 7587 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [1,0,0,0,0,1|1,0,0]=3 7588 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [1,0,0,0,0,1|2,0,0]=4 7589 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [1,0,0,0,0,1|2,0,0]=4 7590 B9R0.4 CCSCC(C)NC(C)=N Amb27454411 [1,0,0,0,0,1|2,0,0]=4 7591 B9R0.4 CCSCC(Cl)OC(C)=O Amb17940617 [1,0,0,0,0,1|2,0,0]=4 7592 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [1,0,0,0,0,1|2,0,0]=4 7593 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [1,0,0,0,0,1|2,0,0]=4 7594 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [1,0,0,0,0,1|2,0,0]=4 7595 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [1,0,0,0,0,1|2,0,0]=4 7596 B9R0.4 COCCC(C)OC(=O)Cl Amb32656123 [1,0,0,0,0,1|2,0,0]=4 7597 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [1,0,0,0,0,1|2,0,0]=4 7598 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [1,0,0,0,0,1|2,0,0]=4 7599 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [1,0,0,0,0,1|2,0,0]=4 7600 B9R0.4 COCO[C@@H](C)CC(C)=O Amb27783387 [1,0,0,0,0,1|2,0,0]=4 7601 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [1,0,0,0,0,1|2,0,0]=4 7602 B9R0.4 CSCCC(C)NC(C)=O Amb27868995 [1,0,0,0,0,1|1,0,0]=3 7603 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [1,0,0,0,0,1|2,0,0]=4 7604 B9R0.4 CSCCN(C)CC(C)=O Amb27880841 [1,0,0,0,0,1|2,0,0]=4 7605 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [1,0,0,0,0,1|2,0,0]=4 7606 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [1,0,0,0,0,1|2,0,0]=4 7607 B9R0.14 C#CC(CCC)NC(C)=O Amb28143405 [1,0,0,0,0,1|1,0,1]=4 7608 B9R0.14 C=C(C)CC(CBr)CCC Amb32689649 [1,0,0,0,0,1|2,0,0]=4 7609 B9R0.14 C=C(C)CC(CCl)CCC Amb25132141 [1,0,0,0,0,1|2,0,0]=4 7610 B9R0.14 C=CC(CCC)OC(C)=O Amb22227963 [1,0,0,0,0,1|1,0,1]=4 7611 B9R0.14 C=CCC(CO)NC(C)=O Amb27838085 [1,0,0,0,0,1|0,0,2]=4 7612 B9R0.14 CC(=O)NC(CO)CCO Amb26855329 [1,0,0,0,0,1|1,0,0]=3 7613 B9R0.14 CC(=O)N[C@H](CO)CCO Amb28043105 [1,0,0,0,0,1|1,0,0]=3 7614 B9R0.14 CC(=O)OC(CCl)CCCl Amb22359668 [1,0,0,0,0,1|2,0,0]=4 7615 B9R0.14 CC(=O)OC(CO)CC#N Amb27589538 [1,0,0,0,0,1|1,0,1]=4 7616 B9R0.14 CCC(CCN)NC(C)=O Amb19028043 [1,0,0,0,0,1|2,0,0]=4 7617 B9R0.14 CCC(CCO)OC(C)=O Amb28050736 [1,0,0,0,0,1|2,0,0]=4 7618 B9R0.14 CCCC(=C=C(C)C)CO Amb28050691 [1,0,0,0,0,1|1,0,1]=4 7619 B9R0.14 CCCC(C#N)CC(C)=O Amb25714287 [1,0,0,0,0,1|1,0,1]=4 7620 B9R0.14 CCCC(C#N)OC(C)=O Amb28345160 [1,0,0,0,0,1|1,0,1]=4 7621 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [1,0,0,0,0,1|0,0,2]=4 7622 B9R0.14 CCCC(CC)CC(=O)O Amb18124694 [1,0,0,0,0,1|2,0,0]=4 7623 B9R0.14 CCCC(CC)NC(C)=N Amb27466822 [1,0,0,0,0,1|2,0,0]=4 7624 B9R0.14 CCCC(CC)NC(N)=O Amb4009047 [1,0,0,0,0,1|2,0,0]=4 7625 B9R0.14 CCCC(CC)OC(=O)Cl Amb32655634 [1,0,0,0,0,1|2,0,0]=4 7626 B9R0.14 CCCC(CI)CC(=O)O Amb8395787 [1,0,0,0,0,1|2,0,0]=4 7627 B9R0.14 CCCC(CN)CC(=O)O Amb24587738 [1,0,0,0,0,1|2,0,0]=4 7628 B9R0.14 CCCC(CO)NC(C)C Amb27460753 [1,0,0,0,0,1|1,0,1]=4 7629 B9R0.14 CCC\C(=C\C(C)=O)CC Amb26907948 [1,0,0,0,0,1|1,0,1]=4 7630 B9R0.14 CCOC(CCl)CC(C)=O Amb27618172 [1,0,0,0,0,1|2,0,0]=4 7631 B9R0.14 COCC(CCl)NC(C)=O Amb27766500 [1,0,0,0,0,1|2,0,0]=4 7632 B9R0.14 COCC(CCl)OC(C)=O Amb27203315 [1,0,0,0,0,1|2,0,0]=4 7633 B9R0.14 COCC(CO)NC(N)=O Amb28118310 [1,0,0,0,0,1|2,0,0]=4 7634 B9R0.14 COC[C@H](CO)NC(C)=O Amb28342322 [1,0,0,0,0,1|1,0,0]=3 7635 B9R0.14 COC[C@H](CO)NC(N)=O Amb28453946 [1,0,0,0,0,1|2,0,0]=4 7636 B9R0.14 C\C=C\C(CO)NC(C)=O Amb27838102 [1,0,0,0,0,1|0,0,2]=4 7637 B9R0.14 NC(=O)N[C@H](CO)CCO Amb28043702 [1,0,0,0,0,1|2,0,0]=4 7638 B11R0.164 CCCCC(CC)CCC(=O)O Amb10807481 [0,0,0,0,0,2|2,0,0]=4 7639 B11R0.164 CCCCC(CC)COC(=O)Cl Amb8396198 [0,0,0,0,0,2|2,0,0]=4 7640 B11R0.164 CCCCC(CC)COC(C)=O Amb4017798 [0,0,0,0,0,2|1,0,0]=3