0 B9R1.48 C=C1CC(O)CCCC1 Amb25045697 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.48 CC1=CC(=O)CCC=C1 Amb25318978 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.48 CC1=CC(=O)CCCN1 Amb24428221 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.48 CC1=CC(=O)NCCO1 Amb24451309 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.48 CC1=CC(=O)NCCS1 Amb25728092 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.48 CC1CCCCC(=S)N1 Amb25145977 [0,0,0,0,0,0|2,1,1]=4 9 B9R1.48 CC1CCCCC(N)=N1 Amb25725950 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.48 CC1CCCCC(O)O1 Amb24752219 [0,0,0,0,0,0|1,0,3]=4 11 B9R1.48 CC=1CC(=O)CCCC1 Amb24686530 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.48 CC=1CCCC=C(C)C1 Amb22365190 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.48 CC=1CCCCC(N)N1 Amb24548235 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.48 CC=1CCCNC(=N)C1 Amb24515969 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.48 CC=1CCCNC(=O)C1 Amb25693390 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.48 NC1CC(=O)NCCC1 Amb22229644 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.48 NC1CC(=O)NCCC1 Amb22276469 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.48 NC1CCCCC(=O)N1 Amb22492650 [0,0,0,0,0,0|2,0,1]=3 20 B9R1.48 NC=1CCCCC(=O)C1 Amb25146097 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.48 N[C@@H]1CC(=O)NCCC1 Amb24442197 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.48 O=C1C=C(Cl)CCCN1 Amb24476687 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.48 O=C1CC(=O)NCCC1 Amb18832700 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.48 O=C1CC(=O)NCCO1 Amb25810491 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.48 O=C1CC(Br)CCCC1 Amb25685402 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.48 O=C1CC(Cl)CCCC1 Amb25061378 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.48 O=C1CC(Cl)CCCN1 Amb25105399 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.48 O=C1CC=CNC(=O)C1 Amb24553849 [0,0,0,0,0,0|2,0,2]=4 29 B9R1.48 O=C1CCC=CC(Cl)=C1 Amb25229909 [0,0,0,0,0,0|2,0,2]=4 30 B9R1.48 O=C1CCCCC(=O)C1 Amb10603368 [0,0,0,0,0,0|1,0,0]=1 31 B9R1.48 O=C1CCCCC(=S)N1 Amb24374795 [0,0,0,0,0,0|1,1,0]=2 32 B9R1.48 O=C1CCCCC(Cl)=C1 Amb24357156 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.48 O=C1CCCCC(Cl)N1 Amb25843742 [0,0,0,0,0,0|2,0,1]=3 34 B9R1.48 O=C1CCCNC(=O)N1 Amb25146000 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.48 O=C1COCCC(Cl)C1 Amb25102535 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.48 O=C1COCNC(=O)O1 Amb24476953 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.48 O=C1CSCCS(=O)C1 Amb25112564 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.48 O=C1CSSCC(=O)O1 Amb25283167 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.48 O=C1NC=CCC(=O)N1 Amb25692573 [0,0,0,0,0,0|2,0,2]=4 40 B9R1.48 OC1CC(=O)NCCC1 Amb25147021 [0,0,0,0,0,0|2,0,2]=4 41 B9R1.48 OC1CCCCC(=O)N1 Amb24477685 [0,0,0,0,0,0|1,0,2]=3 42 B9R1.48 OC=1CC=CCC(=O)C1 Amb25701002 [0,0,0,0,0,0|1,0,3]=4 43 B9R1.48 O[C@@H]1CCCCC(=O)O1 Amb25296333 [0,0,0,0,0,0|0,0,2]=2 44 B9R1.48 O[C@H]1CCCCC(=O)O1 Amb24529319 [0,0,0,0,0,0|0,0,2]=2 45 B9R1.48 O[C@H]1CCCCC(Br)=C1 Amb24466250 [0,0,0,0,0,0|2,0,2]=4 46 B8R1.22 BrC1=CCCCCC1 Amb10071167 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.22 C=C1CCCCCC1 Amb25325282 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.22 C=C1CNCCCC1 Amb24624045 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.22 C=C1OCCCCO1 Amb22228877 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.22 CC1CCCCCO1 Amb22364798 [1,0,0,0,0,0|1,0,2]=4 51 B8R1.22 CC=1CCCCCC1 Amb22227978 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.22 N=C1CCCCCN1 Amb22488763 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.22 NC1CCCCC=C1 Amb24377373 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.22 NC=1CCCCCC1 Amb24739386 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.22 NC=1CCCCCN1 Amb19514661 [1,0,0,0,0,0|2,0,1]=4 56 B8R1.22 N[C@@H]1CCCCC=C1 Amb25173829 [1,0,0,0,0,0|2,0,1]=4 57 B8R1.22 N[C@H]1CCCCC=C1 Amb24375976 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.22 O=C1C=CCCC=C1 Amb22364722 [1,0,0,0,0,0|1,0,2]=4 59 B8R1.22 O=C1C=CCCCN1 Amb22500450 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.22 O=C1C=CNCCN1 Amb24395067 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.22 O=C1CC=CCCC1 Amb24450177 [1,0,0,0,0,0|1,0,1]=3 62 B8R1.22 O=C1CCC=CC=C1 Amb17593120 [1,0,0,0,0,0|1,0,2]=4 63 B8R1.22 O=C1CCCCC=C1 Amb10601704 [1,0,0,0,0,0|1,0,0]=2 64 B8R1.22 O=C1CCCCCS1 Amb25810807 [1,0,0,0,0,0|0,1,1]=3 65 B8R1.22 O=C1CCCCC[N-]1 Amb22053646 [1,0,0,0,0,0|1,0,1]=3 66 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [1,0,0,0,0,0|1,0,1]=3 67 B8R1.22 O=C1CCCCSC1 Amb10071767 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.22 O=C1CCCSCC1 Amb25318842 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.22 O=C1CCOCCO1 Amb24060726 [1,0,0,0,0,0|1,0,1]=3 70 B8R1.22 O=C1CCSC=CN1 Amb24560312 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.22 O=C1CCSCCN1 Amb21912439 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.22 O=C1CNCCCC1 Amb22000936 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.22 O=C1CNCCCN1 Amb22754482 [1,0,0,0,0,0|2,0,1]=4 74 B8R1.22 O=C1CNCCNC1 Amb25259581 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.22 O=C1COCCC=C1 Amb25295282 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.22 O=C1COCCCC1 Amb25143067 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.22 O=C1COCCCN1 Amb22371065 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.22 O=C1COCCCO1 Amb24558825 [1,0,0,0,0,0|1,0,1]=3 79 B8R1.22 O=C1COCCOC1 Amb22284314 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.22 O=C1COCOC=C1 Amb24422426 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.22 O=C1CSCCCN1 Amb25378108 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.22 O=C1NCCNCC1 Amb10069937 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.22 O=C1NCCNCC1 Amb1107713 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.22 O=C1NCCOCC1 Amb13951193 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.22 O=C1OCCCCO1 Amb25350626 [1,0,0,0,0,0|1,0,1]=3 86 B8R1.22 O[C@@H]1CCCCC=C1 Amb24720019 [1,0,0,0,0,0|1,0,2]=4 87 B8R1.22 S=C1CCCCCN1 Amb1935077 [1,0,0,0,0,0|1,1,1]=4 88 B10R1.162 CC1CCCCC(C=O)=C1 Amb25712019 [0,1,0,0,0,0|2,0,1]=4 89 B10R1.162 CCC1CCCCC(=O)O1 Amb25174027 [0,1,0,0,0,0|1,0,1]=3 90 B10R1.162 CCC=1CCCCC(=O)C1 Amb24478135 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.162 CNC1CC(=O)CCCC1 Amb25260703 [0,1,0,0,0,0|2,0,1]=4 92 B10R1.162 CN[C@H]1CC(=O)CCCC1 Amb25053182 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.162 COC=1CC(=O)CCCN1 Amb25714255 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.162 CO[C@@H]1CCCCC(=O)N1 Amb25840270 [0,1,0,0,0,0|1,0,2]=4 95 B10R1.162 N#CC=1CC(=O)CCCC1 Amb25114861 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.162 N#CC=1CCCCC(=O)C1 Amb25139890 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.162 NCC1CCCCC(=O)N1 Amb19515401 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.162 O=C1CCCCC(CBr)=C1 Amb24724718 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.162 O=C1CCCCC(CCl)N1 Amb19515430 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.162 O=C1CCCC[C@@H](CBr)O1 Amb25351492 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.162 O=CC1CCCCC(=O)N1 Amb24479154 [0,1,0,0,0,0|1,0,1]=3 102 B10R1.162 O=CN1CC(=O)NCCC1 Amb24540538 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.162 OCC1CCCCC(=O)N1 Amb19515428 [0,1,0,0,0,0|1,0,2]=4 104 B10R1.162 OC[C@@H]1CCCCC(=O)N1 Amb24117963 [0,1,0,0,0,0|1,0,2]=4 105 B10R1.162 OC[C@@H]1CCCCC(=O)O1 Amb24481208 [0,1,0,0,0,0|0,0,2]=3 106 B10R1.162 OC[C@H]1CCCCC(=O)N1 Amb25368317 [0,1,0,0,0,0|1,0,2]=4 107 B10R1.275 C=C1CCCCC(=C)C1=O Amb24524658 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.275 CC1C(=C)CCCCC1=O Amb25712972 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.275 CC1C(=O)CCCCC1=O Amb25146573 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.275 CC1C(O)CCCCC1=O Amb25146771 [0,1,0,0,0,0|1,0,2]=4 111 B10R1.275 CC1CCCCC(=O)C1=C Amb24564867 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.275 CC1CCCCC(=O)C1O Amb25285743 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.275 C[C@H]1CCCCC(=O)C1=C Amb25713535 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.275 NN1C(=O)CCCCC1=O Amb25334094 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.275 O=C1CCCCC(=O)C1Cl Amb25052443 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.275 O=C1CCCCC(=O)C1F Amb25706990 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.275 O=C1CCCCC(Cl)C1=O Amb24711283 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.275 OC1CCCCC(=O)C1=O Amb25146740 [0,1,0,0,0,0|1,0,2]=4 119 B10R1.275 OC1CCCCC(=O)C1Br Amb24502162 [0,1,0,0,0,0|1,0,2]=4 120 B10R1.275 OC1CCCCC(=O)C1Cl Amb25275004 [0,1,0,0,0,0|1,0,2]=4 121 B10R1.275 ON1C(=O)CCCCC1=O Amb25174092 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.276 O=C1CCCCS(=O)(=O)C1 Amb10071768 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.276 O=C1NCCCS(=O)(=O)S1 Amb24477307 [0,1,0,0,0,0|2,1,0]=4 124 B10R1.276 O=C1NS(=O)(=O)CCCN1 Amb24743380 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.277 CC1=CC(=O)CCCC1C Amb24478380 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.277 CC1=CCCC(=O)CC1=O Amb25759509 [0,1,0,0,0,0|1,0,2]=4 127 B10R1.277 CC1CCCC(C)NC1=O Amb19335341 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.277 CC=1CC(=O)C(C)CCC1 Amb25087146 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.277 CC=1CC(=O)CCCC1C Amb25830563 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.277 CC=1CCCC(C)C(=O)C1 Amb25358929 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.277 CN1CCCC(=O)CC1=S Amb24736355 [0,1,0,0,0,0|2,1,0]=4 132 B10R1.277 CN1CCNC(=O)NC1=O Amb24473041 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.277 C[C@@H]1CC(=O)C(C)CCC1 Amb25146718 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.277 C[C@@H]1CC(=O)CCC[C@@H]1C Amb25319342 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.277 C[C@@H]1CC(=O)CCC[C@H]1C Amb25179540 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.277 C[C@H]1CC(=O)C(C)CCC1 Amb25094452 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.277 C[C@H]1CC(=O)CCC[C@H]1C Amb25179623 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.277 O=C1CC(=O)C(Cl)=CCC1 Amb24737475 [0,1,0,0,0,0|1,0,2]=4 139 B10R1.330 C=C1CC(=O)CCC(=O)C1 Amb25145679 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.330 CC1CC(=O)NC(C)CC1 Amb25759705 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.330 CC1CC(C)NC(=O)CC1 Amb24400989 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.330 CC=1CC(=O)CCC(C)C1 Amb24436317 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.330 CC=1CCC(Cl)CC(=O)C1 Amb24693957 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.330 C[C@@H]1CC(=O)C[C@@H](C)CC1 Amb25179593 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.330 C[C@H]1CC(=O)C[C@H](C)CC1 Amb25262784 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.330 C[C@H]1CC(=O)N[C@H](C)CC1 Amb24551919 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.330 C[C@H]1C[C@H](C)CC(=O)CC1 Amb24621210 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.330 O=C1CNC(=O)NC(=O)C1 Amb1971722 [0,1,0,0,0,0|2,0,1]=4 149 B8R0.1 C=CCC(=O)CCCCl Amb25138063 [0,0,1,0,0,0|3,0,0]=4 150 B8R0.1 C=CCC(=O)CCCO Amb24633875 [0,0,1,0,0,0|3,0,0]=4 151 B8R0.1 C=COC(=O)CCCBr Amb24576258 [0,0,1,0,0,0|2,0,0]=3 152 B8R0.1 C=COC(=O)CCCCl Amb25113897 [0,0,1,0,0,0|2,0,0]=3 153 B8R0.1 C=COC(=O)NCCO Amb25328650 [0,0,1,0,0,0|3,0,0]=4 154 B8R0.1 CC(CCCBr)OC=O Amb24627078 [0,0,1,0,0,0|2,0,1]=4 155 B8R0.1 CC=CC(=O)NCCC Amb22364983 [0,0,1,0,0,0|3,0,0]=4 156 B8R0.1 CCCCC(=C)\C=C/Br Amb24480295 [0,0,1,0,0,0|3,0,0]=4 157 B8R0.1 CCCCC(=C)\C=C\Br Amb24540792 [0,0,1,0,0,0|3,0,0]=4 158 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,0,1,0,0,0|2,0,1]=4 159 B8R0.1 CCCCC(=O)CC=C Amb10567269 [0,0,1,0,0,0|2,0,0]=3 160 B8R0.1 CCCCC(=O)CCCl Amb25705250 [0,0,1,0,0,0|2,0,1]=4 161 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,0,1,0,0,0|3,0,0]=4 162 B8R0.1 CCCCC(=O)COC Amb19374627 [0,0,1,0,0,0|3,0,0]=4 163 B8R0.1 CCCCC(=O)N=C=O Amb17231844 [0,0,1,0,0,0|1,0,1]=3 164 B8R0.1 CCCCC(=O)NC#N Amb24532849 [0,0,1,0,0,0|2,0,1]=4 165 B8R0.1 CCCCC(=O)NC=C Amb24359898 [0,0,1,0,0,0|2,0,0]=3 166 B8R0.1 CCCCC(=O)NCC Amb17787354 [0,0,1,0,0,0|2,0,1]=4 167 B8R0.1 CCCCC(=O)NOC Amb24478571 [0,0,1,0,0,0|3,0,0]=4 168 B8R0.1 CCCCC(=O)OC=C Amb17934207 [0,0,1,0,0,0|1,0,0]=2 169 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,0,1,0,0,0|2,0,0]=3 170 B8R0.1 CCCCC(=O)\C=C\S Amb24695018 [0,0,1,0,0,0|1,1,0]=3 171 B8R0.1 CCCCC(Br)=CC=O Amb24540824 [0,0,1,0,0,0|2,0,0]=3 172 B8R0.1 CCCCC(C)=C=CBr Amb25216939 [0,0,1,0,0,0|3,0,0]=4 173 B8R0.1 CCCCC(C)=CC=O Amb24578506 [0,0,1,0,0,0|2,0,0]=3 174 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,0,1,0,0,0|2,0,1]=4 175 B8R0.1 CCCCC(C)NC=O Amb24562841 [0,0,1,0,0,0|2,0,1]=4 176 B8R0.1 CCCCC(C)OC=O Amb22731654 [0,0,1,0,0,0|1,0,1]=3 177 B8R0.1 CCCC[C@H](C)CC=O Amb25269517 [0,0,1,0,0,0|2,0,1]=4 178 B8R0.1 CCCC\C(\Br)=C/C=O Amb18650691 [0,0,1,0,0,0|2,0,0]=3 179 B8R0.1 CCCC\C(\C)=C/C=O Amb18642453 [0,0,1,0,0,0|2,0,0]=3 180 B8R0.1 CCCC\C(\C)=C\C=O Amb25350233 [0,0,1,0,0,0|2,0,0]=3 181 B8R0.1 CCCC\C(\O)=C\C=O Amb25103320 [0,0,1,0,0,0|1,0,1]=3 182 B8R0.1 CCCNC(=O)NC=C Amb25836812 [0,0,1,0,0,0|3,0,0]=4 183 B8R0.1 CCCNC(=O)NN=O Amb24699757 [0,0,1,0,0,0|3,0,0]=4 184 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,0,1,0,0,0|2,0,1]=4 185 B8R0.1 CCCOC(=O)CC=O Amb24683609 [0,0,1,0,0,0|2,0,0]=3 186 B8R0.1 CCCOC(=O)N=C=O Amb25766484 [0,0,1,0,0,0|2,0,1]=4 187 B8R0.1 CCCOC(=O)OCCl Amb22054704 [0,0,1,0,0,0|2,0,1]=4 188 B8R0.1 CCCOC(=O)OCI Amb25316012 [0,0,1,0,0,0|2,0,1]=4 189 B8R0.1 CCC\C=C(/C)\CC=O Amb25031857 [0,0,1,0,0,0|2,0,1]=4 190 B8R0.1 CCC\C=C(\C)/CC=O Amb24550527 [0,0,1,0,0,0|2,0,1]=4 191 B8R0.1 CCOC(=O)CCCF Amb24649863 [0,0,1,0,0,0|2,0,1]=4 192 B8R0.1 CCOC(=O)CCCI Amb21520420 [0,0,1,0,0,0|2,0,1]=4 193 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,0,1,0,0,0|2,0,1]=4 194 B8R0.1 CCSC\C(\C)=C/C=O Amb24723612 [0,0,1,0,0,0|3,0,0]=4 195 B8R0.1 CCSC\C(\C)=C\C=O Amb24452203 [0,0,1,0,0,0|3,0,0]=4 196 B8R0.1 COCCS(=O)CC=O Amb24439092 [0,0,1,0,0,0|3,0,0]=4 197 B8R0.1 CSCCC(=O)N=C=O Amb24701576 [0,0,1,0,0,0|2,0,1]=4 198 B8R0.1 CSCCC(=O)ONN Amb24478796 [0,0,1,0,0,0|3,0,0]=4 199 B8R0.1 C\C=C\C(=O)CCCBr Amb24479946 [0,0,1,0,0,0|3,0,0]=4 200 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,0,1,0,0,0|2,0,0]=3 201 B8R0.1 C\C=C\C(=O)COCC Amb25779716 [0,0,1,0,0,0|3,0,0]=4 202 B8R0.1 C\C=C\C(=O)OCCC Amb22231396 [0,0,1,0,0,0|3,0,0]=4 203 B8R0.1 ClCCCC(=O)N=C=O Amb17593678 [0,0,1,0,0,0|2,0,1]=4 204 B8R0.1 ClCCCC(=O)OCC Amb1153203 [0,0,1,0,0,0|2,0,1]=4 205 B8R0.5 CC(=C)CC(=O)CCC Amb24377405 [0,0,1,0,0,0|2,0,0]=3 206 B8R0.5 CC(=C)CC(=O)CCN Amb24496397 [0,0,1,0,0,0|3,0,0]=4 207 B8R0.5 CC(=C)CC(=O)COC Amb25142356 [0,0,1,0,0,0|3,0,0]=4 208 B8R0.5 CC(=C)NC(=O)OCC Amb25324994 [0,0,1,0,0,0|3,0,0]=4 209 B8R0.5 CC(=CCBr)OC(C)=O Amb25374954 [0,0,1,0,0,0|2,0,1]=4 210 B8R0.5 CC(=O)C=C(N)CCC Amb25145980 [0,0,1,0,0,0|2,0,0]=3 211 B8R0.5 CC(=O)C=C(N)COC Amb24540259 [0,0,1,0,0,0|3,0,0]=4 212 B8R0.5 CC(=O)C=C(N)OCC Amb24561013 [0,0,1,0,0,0|3,0,0]=4 213 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [0,0,1,0,0,0|3,0,0]=4 214 B8R0.5 CC(=O)CC(=O)CC#N Amb24456593 [0,0,1,0,0,0|2,0,1]=4 215 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [0,0,1,0,0,0|1,0,0]=2 216 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,0,1,0,0,0|2,0,0]=3 217 B8R0.5 CC(=O)CC(=O)NOC Amb24096697 [0,0,1,0,0,0|3,0,0]=4 218 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,0,1,0,0,0|2,0,0]=3 219 B8R0.5 CC(=O)CC(=O)OOC Amb24096083 [0,0,1,0,0,0|3,0,0]=4 220 B8R0.5 CC(=O)CC(=O)\C=C\C Amb25807638 [0,0,1,0,0,0|1,0,2]=4 221 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [0,0,1,0,0,0|2,1,0]=4 222 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,0,1,0,0,0|2,0,1]=4 223 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,0,1,0,0,0|2,0,1]=4 224 B8R0.5 CC(=O)N=C(N)NCC Amb25093054 [0,0,1,0,0,0|3,0,0]=4 225 B8R0.5 CC(=O)NC(=O)CCBr Amb25188997 [0,0,1,0,0,0|2,0,0]=3 226 B8R0.5 CC(=O)NC(=O)CCC Amb25324995 [0,0,1,0,0,0|1,0,0]=2 227 B8R0.5 CC(=O)NC(=O)CNC Amb24593410 [0,0,1,0,0,0|2,0,0]=3 228 B8R0.5 CC(=O)NC(=O)\C=C\C Amb25266462 [0,0,1,0,0,0|1,0,2]=4 229 B8R0.5 CC(=O)NC(=S)NCC Amb24477714 [0,0,1,0,0,0|2,1,0]=4 230 B8R0.5 CC(=O)NC(=S)OCC Amb24356625 [0,0,1,0,0,0|2,1,0]=4 231 B8R0.5 CC(=O)OC(=O)CC#N Amb25676428 [0,0,1,0,0,0|1,0,1]=3 232 B8R0.5 CC(=O)OC(=O)NC#N Amb25772946 [0,0,1,0,0,0|2,0,1]=4 233 B8R0.5 CC(=O)OC(Br)CCCl Amb25771672 [0,0,1,0,0,0|2,0,1]=4 234 B8R0.5 CC(=O)OC(Cl)CCCl Amb25109244 [0,0,1,0,0,0|2,0,1]=4 235 B8R0.5 CC(=O)S\C(\N)=C/CC Amb25341526 [0,0,1,0,0,0|1,1,1]=4 236 B8R0.5 CC(=O)\C=C(/N)\COC Amb24340140 [0,0,1,0,0,0|3,0,0]=4 237 B8R0.5 CC(=O)\C=C(/N)\OCC Amb24451604 [0,0,1,0,0,0|3,0,0]=4 238 B8R0.5 CC(=O)\C=C(/N)\SCC Amb25113924 [0,0,1,0,0,0|3,0,0]=4 239 B8R0.5 CC(=O)\C=C(\C)/CCN Amb20621191 [0,0,1,0,0,0|3,0,0]=4 240 B8R0.5 CC(=O)\C=C(\Cl)/CCC Amb24339441 [0,0,1,0,0,0|2,0,0]=3 241 B8R0.5 CC(=S)NC(=O)CCC Amb25783781 [0,0,1,0,0,0|1,1,0]=3 242 B8R0.5 CC(C)=CC(=O)CCCl Amb24394741 [0,0,1,0,0,0|3,0,0]=4 243 B8R0.5 CC(C)=CC(=O)CCN Amb25789410 [0,0,1,0,0,0|3,0,0]=4 244 B8R0.5 CC(C)=CC(=O)CNC Amb25662228 [0,0,1,0,0,0|3,0,0]=4 245 B8R0.5 CC(C)OC(=O)CCBr Amb24563382 [0,0,1,0,0,0|2,0,1]=4 246 B8R0.5 CC(C)OC(=O)CCN Amb19234917 [0,0,1,0,0,0|2,0,1]=4 247 B8R0.5 CC(C)OC(=O)CCS Amb22229342 [0,0,1,0,0,0|2,0,1]=4 248 B8R0.5 CC(CCBr)OC(C)=O Amb25111237 [0,0,1,0,0,0|2,0,1]=4 249 B8R0.5 CC(Cl)OC(=O)CCCl Amb25111195 [0,0,1,0,0,0|2,0,1]=4 250 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,0,1,0,0,0|3,0,0]=4 251 B8R0.5 CCCC(=O)C=C(Cl)Cl Amb25177470 [0,0,1,0,0,0|3,0,0]=4 252 B8R0.5 CCCC(=O)CC(C)Br Amb25232584 [0,0,1,0,0,0|2,0,1]=4 253 B8R0.5 CCCC(=O)CC(C)O Amb24676902 [0,0,1,0,0,0|1,0,2]=4 254 B8R0.5 CCCC(=O)C[C@@H](C)O Amb24645371 [0,0,1,0,0,0|1,0,2]=4 255 B8R0.5 CCCC(=O)C[C@H](C)O Amb25767694 [0,0,1,0,0,0|1,0,2]=4 256 B8R0.5 CCCC(=O)NC(C)C Amb2222481 [0,0,1,0,0,0|2,0,1]=4 257 B8R0.5 CCCC(=O)NC(N)=N Amb19148006 [0,0,1,0,0,0|3,0,0]=4 258 B8R0.5 CCCC(=O)OC(C)Cl Amb25684760 [0,0,1,0,0,0|1,0,1]=3 259 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,0,1,0,0,0|2,0,1]=4 260 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,0,1,0,0,0|1,0,1]=3 261 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,0,1,0,0,0|1,0,2]=4 262 B8R0.5 CCCC(Cl)OC(=O)Cl Amb24480168 [0,0,1,0,0,0|2,0,1]=4 263 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [0,0,1,0,0,0|2,0,1]=4 264 B8R0.5 CCCC(O)OC(C)=O Amb25245948 [0,0,1,0,0,0|0,0,2]=3 265 B8R0.5 CCCC(O)OC(N)=O Amb24476660 [0,0,1,0,0,0|1,0,2]=4 266 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,0,1,0,0,0|3,0,0]=4 267 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [0,0,1,0,0,0|2,0,1]=4 268 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,0,1,0,0,0|1,0,2]=4 269 B8R0.5 CCC\C(\C)=C/C(C)=O Amb24676836 [0,0,1,0,0,0|2,0,0]=3 270 B8R0.5 CCC\C(\C)=C\C(C)=O Amb25735089 [0,0,1,0,0,0|2,0,0]=3 271 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,0,1,0,0,0|3,0,0]=4 272 B8R0.5 CCC\C(\N)=C\C(N)=O Amb24411410 [0,0,1,0,0,0|3,0,0]=4 273 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,0,1,0,0,0|3,0,0]=4 274 B8R0.5 CCNC(=O)NC(N)=O Amb24120354 [0,0,1,0,0,0|3,0,0]=4 275 B8R0.5 CCN\C(=C\C(=O)C)\C Amb10602727 [0,0,1,0,0,0|3,0,0]=4 276 B8R0.5 CCOC(=O)CC(C)=C Amb17940814 [0,0,1,0,0,0|3,0,0]=4 277 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,0,1,0,0,0|3,0,0]=4 278 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,0,1,0,0,0|2,0,0]=3 279 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [0,0,1,0,0,0|3,0,0]=4 280 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,0,1,0,0,0|2,0,0]=3 281 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,0,1,0,0,0|2,0,0]=3 282 B8R0.5 CCOC(=O)NC(N)=O Amb19884044 [0,0,1,0,0,0|3,0,0]=4 283 B8R0.5 CCOC(=O)OC(C)C Amb24596469 [0,0,1,0,0,0|2,0,1]=4 284 B8R0.5 CCOC(=O)OC(C)F Amb25173938 [0,0,1,0,0,0|2,0,1]=4 285 B8R0.5 CCOC(=O)OC(N)=O Amb25809405 [0,0,1,0,0,0|2,0,0]=3 286 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,0,1,0,0,0|2,0,0]=3 287 B8R0.5 CCOC(Br)OC(C)=O Amb24425527 [0,0,1,0,0,0|2,0,1]=4 288 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,0,1,0,0,0|2,0,1]=4 289 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,0,1,0,0,0|2,0,0]=3 290 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,0,1,0,0,0|3,0,0]=4 291 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,0,1,0,0,0|2,0,0]=3 292 B8R0.5 CCSC(=O)NC(N)=O Amb24444690 [0,0,1,0,0,0|3,0,0]=4 293 B8R0.5 CCSC(=O)OC(C)Cl Amb24415153 [0,0,1,0,0,0|2,0,1]=4 294 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,0,1,0,0,0|2,0,1]=4 295 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,0,1,0,0,0|2,0,1]=4 296 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,0,1,0,0,0|3,0,0]=4 297 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,0,1,0,0,0|2,0,0]=3 298 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,0,1,0,0,0|3,0,0]=4 299 B8R0.5 COCC(=O)CS(C)=O Amb25736407 [0,0,1,0,0,0|3,0,0]=4 300 B8R0.5 COCC(=O)OC(C)C Amb20621999 [0,0,1,0,0,0|2,0,1]=4 301 B8R0.5 CSCC(=O)OC(C)C Amb25689929 [0,0,1,0,0,0|2,0,1]=4 302 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,0,1,0,0,0|2,0,1]=4 303 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,0,1,0,0,0|2,0,0]=3 304 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,0,1,0,0,0|3,0,0]=4 305 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [0,0,1,0,0,0|3,0,0]=4 306 B8R0.5 C\C(=C/C(C)=O)\SCC Amb25031784 [0,0,1,0,0,0|3,0,0]=4 307 B8R0.5 C\C(=C\C(C)=O)\NCC Amb20241597 [0,0,1,0,0,0|3,0,0]=4 308 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [0,0,1,0,0,0|3,0,0]=4 309 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,0,1,0,0,0|3,0,0]=4 310 B8R0.5 C\C(\Cl)=C/C(=O)CCCl Amb24662391 [0,0,1,0,0,0|3,0,0]=4 311 B8R0.5 C\C(\Cl)=C\C(=O)CCC Amb25179508 [0,0,1,0,0,0|2,0,0]=3 312 B8R0.5 C\C(\Cl)=C\C(=O)CCCl Amb25706968 [0,0,1,0,0,0|3,0,0]=4 313 B8R0.5 C\C(\I)=C/C(=O)OCC Amb22503728 [0,0,1,0,0,0|3,0,0]=4 314 B8R0.5 C\C(\I)=C\C(=O)OCC Amb25790655 [0,0,1,0,0,0|3,0,0]=4 315 B8R0.5 C\C(\N)=C/C(=O)NCC Amb25693367 [0,0,1,0,0,0|3,0,0]=4 316 B8R0.5 C\C(\N)=C\C(=O)CCC Amb25059647 [0,0,1,0,0,0|2,0,0]=3 317 B8R0.5 C\C(\N)=C\C(=O)NCC Amb24515615 [0,0,1,0,0,0|3,0,0]=4 318 B8R0.5 C\C(\N)=C\C(=O)SCC Amb24377396 [0,0,1,0,0,0|3,0,0]=4 319 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22053734 [0,0,1,0,0,0|2,0,1]=4 320 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22456709 [0,0,1,0,0,0|2,0,1]=4 321 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22733216 [0,0,1,0,0,0|2,0,1]=4 322 B8R0.5 NC(=O)NC(=O)CCBr Amb24085887 [0,0,1,0,0,0|3,0,0]=4 323 B8R0.5 NC(=O)NC(=O)CCN Amb20623770 [0,0,1,0,0,0|3,0,0]=4 324 B8R0.5 NC(=O)NC(=O)CCN Amb22058738 [0,0,1,0,0,0|3,0,0]=4 325 B8R0.5 NCCC(=O)OC(C)C Amb2371480 [0,0,1,0,0,0|2,0,1]=4 326 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [0,0,1,0,0,0|3,0,0]=4 327 B8R0.7 BrCCCCCC(=O)O Amb2081955 [0,0,1,0,0,0|1,0,1]=3 328 B8R0.7 C#CCCCCC(N)=O Amb25112030 [0,0,1,0,0,0|2,0,1]=4 329 B8R0.7 C=CCCCCB(O)O Amb20171333 [0,0,1,0,0,0|2,0,1]=4 330 B8R0.7 C=CCCCCC(=O)Cl Amb24528269 [0,0,1,0,0,0|2,0,0]=3 331 B8R0.7 C=CCCCCC(N)=N Amb24622060 [0,0,1,0,0,0|3,0,0]=4 332 B8R0.7 C=CCCCNC(N)=O Amb25834820 [0,0,1,0,0,0|3,0,0]=4 333 B8R0.7 C=CCCNCC(N)=O Amb25746697 [0,0,1,0,0,0|3,0,0]=4 334 B8R0.7 C=CCCNCC(O)=O Amb25308652 [0,0,1,0,0,0|2,0,0]=3 335 B8R0.7 C=CCCOCC(N)=O Amb24502598 [0,0,1,0,0,0|3,0,0]=4 336 B8R0.7 C=CCC\C=C\C(O)=O Amb25756053 [0,0,1,0,0,0|1,0,2]=4 337 B8R0.7 C=CCNCCC(N)=O Amb19960043 [0,0,1,0,0,0|3,0,0]=4 338 B8R0.7 C=CCSCCC(N)=O Amb25828040 [0,0,1,0,0,0|3,0,0]=4 339 B8R0.7 C=CC\C=C\CC(O)=O Amb18642408 [0,0,1,0,0,0|1,0,2]=4 340 B8R0.7 C=CNCCCC(O)=O Amb25146209 [0,0,1,0,0,0|2,0,0]=3 341 B8R0.7 CC(=C)CCOCC=O Amb25275299 [0,0,1,0,0,0|3,0,0]=4 342 B8R0.7 CC(=C)COCCC=O Amb18642652 [0,0,1,0,0,0|3,0,0]=4 343 B8R0.7 CC(=O)CCCCC#C Amb25303675 [0,0,1,0,0,0|2,0,1]=4 344 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,0,1,0,0,0|2,0,1]=4 345 B8R0.7 CC(=O)CCCCC=C Amb24546961 [0,0,1,0,0,0|2,0,0]=3 346 B8R0.7 CC(=O)CCCCC=O Amb18642609 [0,0,1,0,0,0|1,0,0]=2 347 B8R0.7 CC(=O)CCCCCF Amb25373197 [0,0,1,0,0,0|2,0,1]=4 348 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,0,1,0,0,0|2,0,1]=4 349 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,0,1,0,0,0|2,0,1]=4 350 B8R0.7 CC(=O)CCNCC=C Amb18642536 [0,0,1,0,0,0|3,0,0]=4 351 B8R0.7 CC(=O)CSCCC=C Amb24481903 [0,0,1,0,0,0|3,0,0]=4 352 B8R0.7 CC(=O)NCCCC=O Amb22896811 [0,0,1,0,0,0|2,0,0]=3 353 B8R0.7 CC(=O)NCCNC=O Amb25707099 [0,0,1,0,0,0|3,0,0]=4 354 B8R0.7 CC(=O)NCCSC=O Amb24670235 [0,0,1,0,0,0|3,0,0]=4 355 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,0,1,0,0,0|2,0,0]=3 356 B8R0.7 CC(=O)\C=C/CCC=O Amb24557160 [0,0,1,0,0,0|1,0,2]=4 357 B8R0.7 CC(=O)\C=C\CCC=O Amb18642401 [0,0,1,0,0,0|1,0,2]=4 358 B8R0.7 CC(Br)=CCCCC=O Amb24541185 [0,0,1,0,0,0|2,0,1]=4 359 B8R0.7 CC(C)=CCCCC=O Amb18642458 [0,0,1,0,0,0|2,0,1]=4 360 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,0,1,0,0,0|2,0,1]=4 361 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,0,1,0,0,0|2,0,1]=4 362 B8R0.7 CC(O)CCCCC=C Amb25724721 [0,0,1,0,0,0|2,0,1]=4 363 B8R0.7 CC(O)CCCCC=O Amb25366189 [0,0,1,0,0,0|1,0,1]=3 364 B8R0.7 CC(O)COCCC=O Amb18642881 [0,0,1,0,0,0|2,0,1]=4 365 B8R0.7 CCCCCCC([O-])=O Amb22729026 [0,0,1,0,0,0|1,0,2]=4 366 B8R0.7 CCCCCCS(O)=O Amb25213753 [0,0,1,0,0,0|2,0,1]=4 367 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,0,1,0,0,0|2,0,1]=4 368 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,0,1,0,0,0|2,0,1]=4 369 B8R0.7 CCCNCCC(O)=O Amb18633174 [0,0,1,0,0,0|2,0,1]=4 370 B8R0.7 CN(C)CCCCC=O Amb25276429 [0,0,1,0,0,0|3,0,0]=4 371 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,0,1,0,0,0|2,0,0]=3 372 B8R0.7 CNCCCCC(C)=O Amb18642717 [0,0,1,0,0,0|3,0,0]=4 373 B8R0.7 CNCCCCC(O)=O Amb24340485 [0,0,1,0,0,0|2,0,0]=3 374 B8R0.7 CNCCNCC(O)=O Amb25211792 [0,0,1,0,0,0|3,0,0]=4 375 B8R0.7 CNCCOCC(O)=O Amb18630741 [0,0,1,0,0,0|3,0,0]=4 376 B8R0.7 COCCNCC(O)=O Amb19514667 [0,0,1,0,0,0|3,0,0]=4 377 B8R0.7 CONCCCC(O)=O Amb24647348 [0,0,1,0,0,0|3,0,0]=4 378 B8R0.7 CS(=O)CCCNC=O Amb24481711 [0,0,1,0,0,0|3,0,0]=4 379 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,0,1,0,0,0|2,0,0]=3 380 B8R0.7 CSCCNCC(O)=O Amb24401934 [0,0,1,0,0,0|3,0,0]=4 381 B8R0.7 CSSCCCC(O)=O Amb25269470 [0,0,1,0,0,0|3,0,0]=4 382 B8R0.7 C[C@@H](O)CCCCC=O Amb22896766 [0,0,1,0,0,0|1,0,1]=3 383 B8R0.7 C\C(\Br)=C/CCCC=O Amb25282714 [0,0,1,0,0,0|2,0,1]=4 384 B8R0.7 C\C(\Cl)=C\CCCC=O Amb24383194 [0,0,1,0,0,0|2,0,1]=4 385 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [0,0,1,0,0,0|1,0,1]=3 386 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,0,1,0,0,0|2,0,1]=4 387 B8R0.7 C\C=C\CCCC(N)=O Amb24358851 [0,0,1,0,0,0|2,0,1]=4 388 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [0,0,1,0,0,0|1,0,1]=3 389 B8R0.7 ClCCCCCC(=O)Cl Amb10844967 [0,0,1,0,0,0|2,0,1]=4 390 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,0,1,0,0,0|1,0,1]=3 391 B8R0.7 N#CCCCCC(=O)[Zn+] Amb24062904 [0,0,1,0,0,0|2,0,1]=4 392 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,0,1,0,0,0|2,0,1]=4 393 B8R0.7 NC(=N)NCCCC=O Amb25367020 [0,0,1,0,0,0|3,0,0]=4 394 B8R0.7 NC(=O)CCCCC#N Amb24108037 [0,0,1,0,0,0|2,0,1]=4 395 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,0,1,0,0,0|1,0,2]=4 396 B8R0.7 NC(=O)CCCNC=O Amb24725181 [0,0,1,0,0,0|2,0,0]=3 397 B8R0.7 NC(=O)CCC\C=C\Br Amb24480015 [0,0,1,0,0,0|2,0,1]=4 398 B8R0.7 NC(=O)CCC\C=C\Cl Amb24409832 [0,0,1,0,0,0|2,0,1]=4 399 B8R0.7 NC(=O)CSCCC=O Amb25784424 [0,0,1,0,0,0|2,0,0]=3 400 B8R0.7 NC(=O)OCCNC=O Amb25219631 [0,0,1,0,0,0|3,0,0]=4 401 B8R0.7 NC(=S)CCCNC=O Amb25256382 [0,0,1,0,0,0|2,1,0]=4 402 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,0,1,0,0,0|2,0,1]=4 403 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,0,1,0,0,0|1,0,1]=3 404 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,0,1,0,0,0|1,0,1]=3 405 B8R0.7 NCCCNCC(O)=O Amb22733138 [0,0,1,0,0,0|2,0,1]=4 406 B8R0.7 NCCCNCC(O)=O Amb25848815 [0,0,1,0,0,0|2,0,1]=4 407 B8R0.7 NCCCOCC(O)=O Amb18111435 [0,0,1,0,0,0|2,0,1]=4 408 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,0,1,0,0,0|2,0,1]=4 409 B8R0.7 NCCNCCC(O)=O Amb20668304 [0,0,1,0,0,0|2,0,1]=4 410 B8R0.7 NCCNCCC(O)=O Amb22058790 [0,0,1,0,0,0|2,0,1]=4 411 B8R0.7 NCCOCCC(O)=O Amb18630461 [0,0,1,0,0,0|2,0,1]=4 412 B8R0.7 NCCSCCC(O)=O Amb21988844 [0,0,1,0,0,0|2,0,1]=4 413 B8R0.7 NOCCCCC(=O)O Amb10975955 [0,0,1,0,0,0|2,0,0]=3 414 B8R0.7 O=CCCCC=C(F)F Amb25827646 [0,0,1,0,0,0|2,0,1]=4 415 B8R0.7 O=CCCCOC(=O)C Amb17593367 [0,0,1,0,0,0|2,0,0]=3 416 B8R0.7 O=COCCCC(=O)C Amb1033032 [0,0,1,0,0,0|2,0,0]=3 417 B8R0.7 OC(=O)C#CCCC=O Amb24549556 [0,0,1,0,0,0|0,0,2]=3 418 B8R0.7 OC(=O)CCCCC=O Amb18642763 [0,0,1,0,0,0|0,0,0]=1 419 B8R0.7 OC(=O)CCCCCCl Amb18796646 [0,0,1,0,0,0|1,0,1]=3 420 B8R0.7 OC(=O)CCCCCI Amb22736492 [0,0,1,0,0,0|1,0,1]=3 421 B8R0.7 OC(=O)CCCCCS Amb18644374 [0,0,1,0,0,0|0,1,1]=3 422 B8R0.7 OC(=O)CCCNC=O Amb18305404 [0,0,1,0,0,0|1,0,0]=2 423 B8R0.7 OC(=O)CCC\C=C\Br Amb24518554 [0,0,1,0,0,0|1,0,1]=3 424 B8R0.7 OC(=O)CCC\C=C\Cl Amb18644381 [0,0,1,0,0,0|1,0,1]=3 425 B8R0.7 OC(=O)CCNCN=O Amb25311838 [0,0,1,0,0,0|2,0,0]=3 426 B8R0.7 OC(=O)CCOCCBr Amb24057757 [0,0,1,0,0,0|2,0,1]=4 427 B8R0.7 OC(=O)CCSCCCl Amb24097450 [0,0,1,0,0,0|2,0,1]=4 428 B8R0.7 OC(=O)CCSCCS Amb18126456 [0,0,1,0,0,0|1,1,1]=4 429 B8R0.7 OC(=O)CC\C=C\C=C Amb10605294 [0,0,1,0,0,0|1,0,2]=4 430 B8R0.7 OC(=O)CNCCCBr Amb25765814 [0,0,1,0,0,0|2,0,1]=4 431 B8R0.7 OC(=O)CNCCCS Amb25268354 [0,0,1,0,0,0|1,1,1]=4 432 B8R0.7 OC(=O)CN\C=C\C=O Amb25223016 [0,0,1,0,0,0|1,0,2]=4 433 B8R0.7 OC(=O)COCCCBr Amb24594816 [0,0,1,0,0,0|2,0,1]=4 434 B8R0.7 OC(=O)COCCCF Amb24481828 [0,0,1,0,0,0|2,0,1]=4 435 B8R0.7 OC(=O)CSCCCBr Amb25771711 [0,0,1,0,0,0|2,0,1]=4 436 B8R0.7 OC(=O)CSCCCCl Amb18126548 [0,0,1,0,0,0|2,0,1]=4 437 B8R0.7 OC(=O)CSCCCF Amb25676986 [0,0,1,0,0,0|2,0,1]=4 438 B8R0.7 OC(=O)CS\C=C\C=O Amb25230965 [0,0,1,0,0,0|1,0,2]=4 439 B8R0.7 OC(=O)C\C=C/CC=O Amb25050861 [0,0,1,0,0,0|0,0,2]=3 440 B8R0.7 OCCNCCC(=O)O Amb1110010 [0,0,1,0,0,0|1,0,2]=4 441 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,0,1,0,0,0|3,0,0]=4 442 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [0,0,1,0,0,0|0,0,3]=4 443 B8R0.19 CC(CC)=CC(=O)CC Amb25683797 [0,0,1,0,0,0|2,0,0]=3 444 B8R0.19 CC(CC)=CC(=O)NC Amb25314412 [0,0,1,0,0,0|3,0,0]=4 445 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,0,1,0,0,0|3,0,0]=4 446 B8R0.19 CCC(=C)CC(=O)CN Amb25329097 [0,0,1,0,0,0|3,0,0]=4 447 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [0,0,1,0,0,0|3,0,0]=4 448 B8R0.19 CCC(=O)C=C(F)CC Amb24550099 [0,0,1,0,0,0|2,0,0]=3 449 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,0,1,0,0,0|3,0,0]=4 450 B8R0.19 CCC(=O)CC(Cl)=CC Amb24617724 [0,0,1,0,0,0|2,0,1]=4 451 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [0,0,1,0,0,0|2,0,1]=4 452 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [0,0,1,0,0,0|1,0,2]=4 453 B8R0.19 CCC(=O)N=C(N)SC Amb24401033 [0,0,1,0,0,0|3,0,0]=4 454 B8R0.19 CCC(=O)NC(=O)CC Amb17940302 [0,0,1,0,0,0|1,0,0]=2 455 B8R0.19 CCC(=O)NC(=O)NN Amb25363467 [0,0,1,0,0,0|3,0,0]=4 456 B8R0.19 CCC(=O)OC(=O)CCl Amb25261522 [0,0,1,0,0,0|1,0,0]=2 457 B8R0.19 CCC(=O)OC(C)CCl Amb25292214 [0,0,1,0,0,0|2,0,1]=4 458 B8R0.19 CCC(=O)OC(C)CO Amb25077934 [0,0,1,0,0,0|2,0,1]=4 459 B8R0.19 CCC(=O)OC(Cl)CCl Amb24724980 [0,0,1,0,0,0|2,0,1]=4 460 B8R0.19 CCC(=O)\C=C(/S)\CC Amb24646505 [0,0,1,0,0,0|1,1,0]=3 461 B8R0.19 CCC(=O)\C=C(\Cl)/CBr Amb25327761 [0,0,1,0,0,0|3,0,0]=4 462 B8R0.19 CCC(C)OC(=O)CN Amb18307959 [0,0,1,0,0,0|2,0,1]=4 463 B8R0.19 CCC(Cl)OC(=O)CCl Amb25772642 [0,0,1,0,0,0|2,0,1]=4 464 B8R0.19 CCC(N)=CC(=O)CC Amb24540773 [0,0,1,0,0,0|2,0,0]=3 465 B8R0.19 CCC(N)=CC(=O)NC Amb25807699 [0,0,1,0,0,0|3,0,0]=4 466 B8R0.19 CCS(=O)CC(=O)CC Amb25361921 [0,0,1,0,0,0|2,0,0]=3 467 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [0,0,1,0,0,0|3,0,0]=4 468 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,0,1,0,0,0|3,0,0]=4 469 B8R0.19 CN(CC)NC(=O)CC Amb24621982 [0,0,1,0,0,0|3,0,0]=4 470 B8R0.19 CNC(=O)CC(=O)CCl Amb25808925 [0,0,1,0,0,0|3,0,0]=4 471 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,0,1,0,0,0|3,0,0]=4 472 B8R0.19 CNC(=O)NC(=O)CI Amb24611633 [0,0,1,0,0,0|3,0,0]=4 473 B8R0.19 CNC(=O)NC(=O)NC Amb24120421 [0,0,1,0,0,0|3,0,0]=4 474 B8R0.19 CNC(=O)NC(=O)OC Amb24540421 [0,0,1,0,0,0|3,0,0]=4 475 B8R0.19 CNC(=O)NC(=O)SC Amb24447001 [0,0,1,0,0,0|3,0,0]=4 476 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [0,0,1,0,0,0|3,0,0]=4 477 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [0,0,1,0,0,0|3,0,0]=4 478 B8R0.19 COC(=O)NC(=O)CF Amb24609035 [0,0,1,0,0,0|3,0,0]=4 479 B8R0.19 COC(=O)NC(=O)CI Amb20668254 [0,0,1,0,0,0|3,0,0]=4 480 B8R0.19 COC(=O)NC(=O)OC Amb25103686 [0,0,1,0,0,0|3,0,0]=4 481 B8R0.19 COC(=O)OC(=O)OC Amb20240544 [0,0,1,0,0,0|2,0,0]=3 482 B8R0.19 CSC(=O)NC(=O)CCl Amb25265267 [0,0,1,0,0,0|3,0,0]=4 483 B8R0.19 C[C@@H](CC(=O)CC)CC Amb24448957 [0,0,1,0,0,0|2,0,1]=4 484 B8R0.19 C[C@H](CC(=O)CC)CC Amb24689490 [0,0,1,0,0,0|2,0,1]=4 485 B8R0.19 C\C(=C/C(=O)CC)\NC Amb25043025 [0,0,1,0,0,0|3,0,0]=4 486 B8R0.19 C\C(=C/C(=O)CC)\OC Amb24646507 [0,0,1,0,0,0|3,0,0]=4 487 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [0,0,1,0,0,0|2,0,1]=4 488 B8R0.19 C\C(\CO)=C/C(=O)CC Amb25319713 [0,0,1,0,0,0|3,0,0]=4 489 B8R0.19 ClCC(=O)NC(=O)NC Amb2370485 [0,0,1,0,0,0|3,0,0]=4 490 B8R0.19 ClCC(=O)NC(=O)OC Amb1152897 [0,0,1,0,0,0|3,0,0]=4 491 B8R0.19 NCC(=O)NC(=O)CN Amb25146149 [0,0,1,0,0,0|3,0,0]=4 492 B8R0.19 NCC(=O)OC(=O)CN Amb22284829 [0,0,1,0,0,0|2,0,0]=3 493 B8R0.19 NCC(=O)OC(=O)CO Amb25063748 [0,0,1,0,0,0|2,0,0]=3 494 B8R0.19 O=C(CBr)OC(=O)CBr Amb20076004 [0,0,1,0,0,0|2,0,0]=3 495 B8R0.19 O=C(CC(=O)CCl)CCl Amb25738744 [0,0,1,0,0,0|3,0,0]=4 496 B8R0.19 O=C(CCl)NC(=O)CBr Amb24502202 [0,0,1,0,0,0|3,0,0]=4 497 B8R0.19 O=C(CCl)SC(=O)CCl Amb24557828 [0,0,1,0,0,0|2,1,0]=4 498 B8R0.19 O=C(CF)OC(=O)CBr Amb24480268 [0,0,1,0,0,0|2,0,0]=3 499 B8R0.19 O=C(CF)OC(=O)CF Amb25324724 [0,0,1,0,0,0|2,0,0]=3 500 B8R0.19 O=C(CS)NC(=O)CS Amb25289222 [0,0,1,0,0,0|3,0,0]=4 501 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,0,1,0,0,0|3,0,0]=4 502 B8R0.19 OCC(=O)NC(=O)CS Amb24563913 [0,0,1,0,0,0|3,0,0]=4 503 B10R2.42 C[C@H]1CC(=O)[C@@H]2CC[C@@H]21 Amb24553567 [0,0,0,1,0,0|2,0,1]=4 504 B10R2.42 N=C1NC(=O)C2CCC12 Amb25213073 [0,0,0,1,0,0|2,0,0]=3 505 B10R2.42 O=C1NC(=O)[C@@H]2[C@H]1CC2 Amb10975596 [0,0,0,1,0,0|1,0,0]=2 506 B10R2.42 O=C1OC(=O)[C@@H]2C=C[C@H]12 Amb24058247 [0,0,0,1,0,0|0,0,2]=3 507 B10R2.42 O=C1OC(=O)[C@@H]2CCN12 Amb25101666 [0,0,0,1,0,0|1,0,0]=2 508 B10R2.42 O=C1OC(=O)[C@@H]2CC[C@H]12 Amb23400905 [0,0,0,1,0,0|0,0,0]=1 509 B10R2.42 O=C1OC(=O)[C@H]2CCN12 Amb24691132 [0,0,0,1,0,0|1,0,0]=2 510 B10R2.42 OC1CC(=O)C2CCC21 Amb24736400 [0,0,0,1,0,0|1,0,2]=4 511 B10R2.42 O[C@H]1CC(=O)[C@@H]2CC[C@@H]21 Amb24612699 [0,0,0,1,0,0|1,0,2]=4 512 B10R2.61 O=C1CC2CC1CCC2 Amb23454519 [0,0,0,1,0,0|2,0,1]=4 513 B10R2.61 O=C1CN2CC1CCC2 Amb25081940 [0,0,0,1,0,0|3,0,0]=4 514 B10R2.61 O=C1C[C@@H]2C[C@@H]1CCC2 Amb24617298 [0,0,0,1,0,0|2,0,1]=4 515 B10R2.61 O=C1NC2CC1CCC2 Amb23596874 [0,0,0,1,0,0|2,0,1]=4 516 B10R2.61 O=C1NC2CCCC1O2 Amb25710030 [0,0,0,1,0,0|1,0,2]=4 517 B10R2.61 O=C1N[C@@H]2C[C@H]1CCC2 Amb23385322 [0,0,0,1,0,0|2,0,1]=4 518 B10R2.61 O=C1N[C@H]2C[C@@H]1CCC2 Amb25304858 [0,0,0,1,0,0|2,0,1]=4 519 B10R2.61 O=C1O[C@@H]2CN1CCC2 Amb24559910 [0,0,0,1,0,0|2,0,1]=4 520 B10R2.61 O=C1O[C@@H]2C[C@H]1NCC2 Amb25291145 [0,0,0,1,0,0|2,0,1]=4 521 B10R2.66 CC1C2C1CCCC2=O Amb25202639 [0,0,0,1,0,0|2,0,1]=4 522 B10R2.69 O=C1CC2OC2CCC1 Amb24723863 [0,0,0,1,0,0|1,0,2]=4 523 B10R2.69 O=C1CCCC2CC2N1 Amb25146163 [0,0,0,1,0,0|2,0,1]=4 524 B10R2.71 O=C1CC2CC(CC2)N1 Amb25738237 [0,0,0,1,0,0|2,0,1]=4 525 B10R2.71 O=C1CC2CCC(C1)C2 Amb17593285 [0,0,0,1,0,0|2,0,1]=4 526 B10R2.71 O=C1CC2CCC(C1)N2 Amb17593299 [0,0,0,1,0,0|2,0,1]=4 527 B10R2.71 O=C1CC2CCC(C1)N2 Amb22491403 [0,0,0,1,0,0|2,0,1]=4 528 B10R2.71 O=C1CC2CCC(C1)O2 Amb23439074 [0,0,0,1,0,0|1,0,2]=4 529 B10R2.71 O=C1C[C@@H]2CC[C@H](C1)N2 Amb16231390 [0,0,0,1,0,0|2,0,1]=4 530 B10R2.71 O=C1C[C@@H]2CC[C@H](C1)S2 Amb24632254 [0,0,0,1,0,0|1,1,1]=4 531 B10R2.71 O=C1C[C@H]2C[C@H](C1)CC2 Amb24602996 [0,0,0,1,0,0|2,0,1]=4 532 B10R2.71 [C@H]12CC[C@H](CC(=O)C1)N2 Amb17672004 [0,0,0,1,0,0|2,0,1]=4 533 B10R2.117 C[C@@]12CCC[C@@H]1C(=O)N2 Amb25256662 [0,0,0,1,0,0|2,0,1]=4 534 B10R2.138 C1CCCc2ccc1[nH]2 Amb24563878 [0,0,0,1,0,0|3,0,0]=4 535 B10R2.174 C=C1CCC2CC(=O)N12 Amb24409221 [0,0,0,1,0,0|2,0,0]=3 536 B10R2.174 CC1=CC2CCC(=O)C12 Amb25767045 [0,0,0,1,0,0|2,0,1]=4 537 B10R2.174 CC1=CC[C@@H]2CC(=O)[C@H]12 Amb24631624 [0,0,0,1,0,0|2,0,1]=4 538 B10R2.174 C[C@H]1C[C@H]2CCC(=O)[C@H]21 Amb24588863 [0,0,0,1,0,0|2,0,1]=4 539 B10R2.174 O=C1CC2CCC(=O)C12 Amb25053007 [0,0,0,1,0,0|1,0,0]=2 540 B10R2.174 O=C1CC2CCC(=O)N12 Amb24078282 [0,0,0,1,0,0|1,0,0]=2 541 B10R2.177 CC12CC1CCC(=O)C2 Amb24724048 [0,0,0,1,0,0|2,0,1]=4 542 B10R2.244 O=C1CCCCC2CC12 Amb24545658 [0,0,0,1,0,0|2,0,1]=4 543 B10R2.244 O=C1CCCC[C@@H]2O[C@H]12 Amb25205785 [0,0,0,1,0,0|1,0,2]=4 544 B10R2.303 CC12CCC1NC(=O)O2 Amb25063636 [0,0,0,1,0,0|2,0,1]=4 545 B10R2.343 CC1CC2CC2C(=O)C1 Amb24582582 [0,0,0,1,0,0|2,0,1]=4 546 B10R2.343 C[C@H]1C[C@@H]2C[C@@H]2C(=O)C1 Amb24714869 [0,0,0,1,0,0|2,0,1]=4 547 B10R2.343 O=C1NC2CC2C(=O)N1 Amb24419758 [0,0,0,1,0,0|2,0,0]=3 548 B10R2.343 O=C1N[C@H]2C[C@H]2C(=O)N1 Amb24551020 [0,0,0,1,0,0|2,0,0]=3 549 B10R2.343 O=C1OC(=O)NC2CC12 Amb18832705 [0,0,0,1,0,0|1,0,0]=2 550 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,0,0,0,1,0|3,0,0]=4 551 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,0,1,0|2,0,0]=3 552 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,0,0,0,1,0|3,0,0]=4 553 B8R1.4 CC1=CC(=O)CCS1 Amb25092957 [0,0,0,0,1,0|3,0,0]=4 554 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,0,0,0,1,0|1,0,1]=3 555 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,0,0,0,1,0|2,0,1]=4 556 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,0,0,0,1,0|2,0,1]=4 557 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,0,0,0,1,0|2,0,1]=4 558 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,0,0,0,1,0|1,0,1]=3 559 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,0,0,0,1,0|3,0,0]=4 560 B8R1.4 CC=1NCCC(=O)N1 Amb24382048 [0,0,0,0,1,0|3,0,0]=4 561 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,0,0,0,1,0|3,0,0]=4 562 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,0,0,0,1,0|3,0,0]=4 563 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,0,0,0,1,0|3,0,0]=4 564 B8R1.4 CS=1CCCC(=O)C1 Amb25318868 [0,0,0,0,1,0|3,0,0]=4 565 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,0,0,0,1,0|2,0,1]=4 566 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,0,0,0,1,0|2,0,1]=4 567 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,0,0,0,1,0|2,0,1]=4 568 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,0,0,0,1,0|2,0,1]=4 569 B8R1.4 N=C1NC(=O)CCS1 Amb24666714 [0,0,0,0,1,0|3,0,0]=4 570 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,0,0,0,1,0|2,0,0]=3 571 B8R1.4 NC1=NC(=O)CCN1 Amb17607753 [0,0,0,0,1,0|3,0,0]=4 572 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,0,0,0,1,0|2,0,1]=4 573 B8R1.4 NC=1CCCC(=N)C1 Amb25757867 [0,0,0,0,1,0|3,0,0]=4 574 B8R1.4 NC=1CCCC(=O)N1 Amb24525241 [0,0,0,0,1,0|2,0,0]=3 575 B8R1.4 NC=1CCNC(=O)C1 Amb22229455 [0,0,0,0,1,0|3,0,0]=4 576 B8R1.4 NC=1CCNC(=O)N1 Amb24481491 [0,0,0,0,1,0|3,0,0]=4 577 B8R1.4 NC=1COCC(=O)C1 Amb25785409 [0,0,0,0,1,0|3,0,0]=4 578 B8R1.4 NC=1NCCC(=O)N1 Amb18641724 [0,0,0,0,1,0|3,0,0]=4 579 B8R1.4 O=C1C=C(Br)CCN1 Amb23400583 [0,0,0,0,1,0|3,0,0]=4 580 B8R1.4 O=C1C=C(Br)CCN1 Amb23402186 [0,0,0,0,1,0|3,0,0]=4 581 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,0,0,0,1,0|3,0,0]=4 582 B8R1.4 O=C1C=CNC(=O)O1 Amb21937546 [0,0,0,0,1,0|1,0,2]=4 583 B8R1.4 O=C1C=NCC(=O)N1 Amb25195978 [0,0,0,0,1,0|2,0,1]=4 584 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,0,0,0,1,0|2,0,1]=4 585 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,0,0,0,1,0|2,0,1]=4 586 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,0,0,0,1,0|1,1,1]=4 587 B8R1.4 O=C1CCCC(=S)N1 Amb25807347 [0,0,0,0,1,0|1,1,0]=3 588 B8R1.4 O=C1CCCC(I)=C1 Amb25706767 [0,0,0,0,1,0|2,0,0]=3 589 B8R1.4 O=C1CCCC(S)=C1 Amb25128260 [0,0,0,0,1,0|1,1,0]=3 590 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,0,0,0,1,0|2,0,0]=3 591 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,0,0,0,1,0|2,0,0]=3 592 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,0,0,0,1,0|1,0,0]=2 593 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,0,0,0,1,0|2,0,0]=3 594 B8R1.4 O=C1CCSC(=O)N1 Amb1150323 [0,0,0,0,1,0|2,0,0]=3 595 B8R1.4 O=C1CCSC(Cl)=C1 Amb25053022 [0,0,0,0,1,0|3,0,0]=4 596 B8R1.4 O=C1CNCC(=O)C1 Amb22755578 [0,0,0,0,1,0|2,0,0]=3 597 B8R1.4 O=C1CNCC(=O)N1 Amb18641768 [0,0,0,0,1,0|2,0,0]=3 598 B8R1.4 O=C1CNCC(=O)N1 Amb19148314 [0,0,0,0,1,0|2,0,0]=3 599 B8R1.4 O=C1CNCC(=O)O1 Amb25834762 [0,0,0,0,1,0|1,0,0]=2 600 B8R1.4 O=C1COCC(=O)C1 Amb22292040 [0,0,0,0,1,0|2,0,0]=3 601 B8R1.4 O=C1COCC(=O)C1 Amb22406411 [0,0,0,0,1,0|2,0,0]=3 602 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,0,0,0,1,0|2,0,0]=3 603 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,0,0,0,1,0|1,0,0]=2 604 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,0,0,0,1,0|2,0,0]=3 605 B8R1.4 O=C1NC(=O)CC=N1 Amb24060969 [0,0,0,0,1,0|2,0,1]=4 606 B8R1.4 O=C1NC(=S)CCN1 Amb25266952 [0,0,0,0,1,0|2,1,0]=4 607 B8R1.4 O=C1NOCC(=O)N1 Amb25270094 [0,0,0,0,1,0|3,0,0]=4 608 B8R1.4 O=C1[CH-]C(=O)COC1 Amb20241003 [0,0,0,0,1,0|2,0,0]=3 609 B8R1.4 O=S1CS(=O)CCC1 Amb22363746 [0,0,0,0,1,0|3,0,0]=4 610 B8R1.4 O=[13C]1CCC[13C](=O)O1 Amb17614796 [0,0,0,0,1,0|0,0,0]=1 611 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,0,0,0,1,0|1,0,0]=2 612 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,0,0,0,1,0|1,0,0]=2 613 B8R1.4 OC1=CC(=O)CCC1 Amb17844413 [0,0,0,0,1,0|1,0,1]=3 614 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,0,0,0,1,0|1,0,2]=4 615 B8R1.4 OC=1CSCC(=O)C1 Amb25773337 [0,0,0,0,1,0|2,0,1]=4 616 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,0,0,0,1,0|1,0,2]=4 617 B8R1.4 S=C1CCCC(=S)N1 Amb24483049 [0,0,0,0,1,0|1,2,0]=4 618 B8R1.4 S=C1CCSC(=O)N1 Amb2470197 [0,0,0,0,1,0|2,1,0]=4 619 B8R1.5 Br[C@@H]1CCCCC1=O Amb16234120 [0,0,0,0,1,0|1,0,1]=3 620 B8R1.5 C=C1CCC=CC1=O Amb25205461 [0,0,0,0,1,0|1,0,2]=4 621 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,0,0,0,1,0|1,0,0]=2 622 B8R1.5 C=C1CCCCC1Br Amb24483250 [0,0,0,0,1,0|2,0,1]=4 623 B8R1.5 C=C1CCCC[C@@H]1Br Amb24552422 [0,0,0,0,1,0|2,0,1]=4 624 B8R1.5 C=C1CCCC[C@@H]1O Amb25220251 [0,0,0,0,1,0|1,0,2]=4 625 B8R1.5 C=C1COCCC1=O Amb18063600 [0,0,0,0,1,0|2,0,0]=3 626 B8R1.5 CC1=CCCNC1=O Amb25127954 [0,0,0,0,1,0|2,0,1]=4 627 B8R1.5 CC1=[N+](C)CCCC1 Amb10552885 [0,0,0,0,1,0|3,0,0]=4 628 B8R1.5 CC1CCCCC1=C Amb25203919 [0,0,0,0,1,0|2,0,1]=4 629 B8R1.5 CC1CCOCC1=O Amb25718285 [0,0,0,0,1,0|2,0,1]=4 630 B8R1.5 CC1CNCCC1=O Amb19888361 [0,0,0,0,1,0|2,0,1]=4 631 B8R1.5 CC1CNCCC1=O Amb22490481 [0,0,0,0,1,0|2,0,1]=4 632 B8R1.5 CC1COCCC1=O Amb21856147 [0,0,0,0,1,0|2,0,1]=4 633 B8R1.5 CC=1CCCC[N+]1[O-] Amb25340684 [0,0,0,0,1,0|2,0,1]=4 634 B8R1.5 CC=1CCNCC1Br Amb25046045 [0,0,0,0,1,0|3,0,0]=4 635 B8R1.5 CC=1CNCCC1C Amb18641667 [0,0,0,0,1,0|3,0,0]=4 636 B8R1.5 CN1CCCCC1=O Amb10573526 [0,0,0,0,1,0|2,0,0]=3 637 B8R1.5 CN1CCCCC1=S Amb24712596 [0,0,0,0,1,0|2,1,0]=4 638 B8R1.5 CN1CCNCC1=O Amb21955857 [0,0,0,0,1,0|3,0,0]=4 639 B8R1.5 CN1CCOCC1=O Amb22301593 [0,0,0,0,1,0|3,0,0]=4 640 B8R1.5 CN1NCCCC1=O Amb18559232 [0,0,0,0,1,0|3,0,0]=4 641 B8R1.5 C[C@@H]1CCCCC1=O Amb25693013 [0,0,0,0,1,0|1,0,1]=3 642 B8R1.5 C[C@@H]1CCCNC1=O Amb25694356 [0,0,0,0,1,0|2,0,1]=4 643 B8R1.5 ClC1CCCCC1=O Amb1154371 [0,0,0,0,1,0|1,0,1]=3 644 B8R1.5 ClC=1CNCCC1Cl Amb24467867 [0,0,0,0,1,0|3,0,0]=4 645 B8R1.5 FC1CCCCC1=O Amb10605769 [0,0,0,0,1,0|1,0,1]=3 646 B8R1.5 N=C1CCCCN1O Amb24524093 [0,0,0,0,1,0|2,0,1]=4 647 B8R1.5 NC1CCCCC1=O Amb17939051 [0,0,0,0,1,0|1,0,1]=3 648 B8R1.5 NC1CCCCC1=O Amb22001819 [0,0,0,0,1,0|1,0,1]=3 649 B8R1.5 NC1COCCC1=O Amb18833021 [0,0,0,0,1,0|2,0,1]=4 650 B8R1.5 NC=1CCCCC1N Amb24673835 [0,0,0,0,1,0|2,0,0]=3 651 B8R1.5 NN1CCCCC1=O Amb13952152 [0,0,0,0,1,0|2,0,0]=3 652 B8R1.5 NN1CCCCC1=O Amb22275946 [0,0,0,0,1,0|2,0,0]=3 653 B8R1.5 NN1CCCNC1=O Amb25343173 [0,0,0,0,1,0|3,0,0]=4 654 B8R1.5 N[C@@H]1CCCCC1=O Amb25727179 [0,0,0,0,1,0|1,0,1]=3 655 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,0,0,0,1,0|2,0,1]=4 656 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,0,0,0,1,0|2,0,1]=4 657 B8R1.5 O=C1C=COCC1=O Amb24100791 [0,0,0,0,1,0|1,0,2]=4 658 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,0,0,0,1,0|1,0,1]=3 659 B8R1.5 O=C1CCCC=C1C Amb15693479 [0,0,0,0,1,0|1,0,1]=3 660 B8R1.5 O=C1CCCC=C1Cl Amb24524498 [0,0,0,0,1,0|1,0,1]=3 661 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,0,0,0,1,0|1,0,1]=3 662 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,0,0,0,1,0|0,0,0]=1 663 B8R1.5 O=C1CCCCC1S Amb25839265 [0,0,0,0,1,0|0,1,1]=3 664 B8R1.5 O=C1CCCC[C@@H]1Br Amb24524273 [0,0,0,0,1,0|1,0,1]=3 665 B8R1.5 O=C1CCCC[C@@H]1Cl Amb24483264 [0,0,0,0,1,0|1,0,1]=3 666 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,0,0,0,1,0|1,0,1]=3 667 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,0,0,0,1,0|1,0,0]=2 668 B8R1.5 O=C1CCNCC1Br Amb20242103 [0,0,0,0,1,0|2,0,1]=4 669 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,0,0,0,1,0|2,0,1]=4 670 B8R1.5 O=C1CCNCC1F Amb13885958 [0,0,0,0,1,0|2,0,1]=4 671 B8R1.5 O=C1CCNCC1F Amb22002662 [0,0,0,0,1,0|2,0,1]=4 672 B8R1.5 O=C1CCNC[C@@H]1F Amb24670514 [0,0,0,0,1,0|2,0,1]=4 673 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,0,0,0,1,0|2,0,1]=4 674 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,0,0,0,1,0|2,0,1]=4 675 B8R1.5 O=C1CCOCC1F Amb19958536 [0,0,0,0,1,0|2,0,1]=4 676 B8R1.5 O=C1CCOC[C@@H]1Cl Amb24723222 [0,0,0,0,1,0|2,0,1]=4 677 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,0,0,0,1,0|2,0,1]=4 678 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,0,0,0,1,0|2,0,1]=4 679 B8R1.5 O=C1CNCCN1C Amb1834069 [0,0,0,0,1,0|3,0,0]=4 680 B8R1.5 O=C1COCCC1=O Amb25712943 [0,0,0,0,1,0|1,0,0]=2 681 B8R1.5 O=C1COCCC1Br Amb24416092 [0,0,0,0,1,0|2,0,1]=4 682 B8R1.5 O=C1NCC=CC1=O Amb25789819 [0,0,0,0,1,0|1,0,2]=4 683 B8R1.5 O=C1NCCC=C1F Amb24377281 [0,0,0,0,1,0|2,0,1]=4 684 B8R1.5 O=C1NCCCC1=O Amb2445649 [0,0,0,0,1,0|1,0,0]=2 685 B8R1.5 O=C1NCCCC1Br Amb20669047 [0,0,0,0,1,0|2,0,1]=4 686 B8R1.5 O=C1NCCCC1Cl Amb24472253 [0,0,0,0,1,0|2,0,1]=4 687 B8R1.5 O=C1NCCCC1F Amb13888988 [0,0,0,0,1,0|2,0,1]=4 688 B8R1.5 O=C1NCCCC1I Amb24355271 [0,0,0,0,1,0|2,0,1]=4 689 B8R1.5 O=C1NCCCC1N Amb1088746 [0,0,0,0,1,0|2,0,1]=4 690 B8R1.5 O=C1NCCCC1O Amb10602315 [0,0,0,0,1,0|1,0,2]=4 691 B8R1.5 O=C1NCCCN1C Amb10608416 [0,0,0,0,1,0|3,0,0]=4 692 B8R1.5 O=C1NCCC[C@@H]1N Amb10603272 [0,0,0,0,1,0|2,0,1]=4 693 B8R1.5 O=C1NNNCC1=O Amb24703029 [0,0,0,0,1,0|3,0,0]=4 694 B8R1.5 O=C1OC=CCC1=O Amb25373353 [0,0,0,0,1,0|1,0,2]=4 695 B8R1.5 O=C1OCC=CC1=O Amb25116554 [0,0,0,0,1,0|1,0,2]=4 696 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,0,0,0,1,0|2,0,1]=4 697 B8R1.5 O=C1OCCCN1N Amb17608306 [0,0,0,0,1,0|3,0,0]=4 698 B8R1.5 O=C1OCCNC1=O Amb24120265 [0,0,0,0,1,0|2,0,0]=3 699 B8R1.5 O=S1CCCC[C@@H]1Cl Amb24415441 [0,0,0,0,1,0|2,0,1]=4 700 B8R1.5 O=S1CCCC[C@H]1Br Amb25756741 [0,0,0,0,1,0|2,0,1]=4 701 B8R1.5 OC1CCCOC1=O Amb19959000 [0,0,0,0,1,0|1,0,2]=4 702 B8R1.5 OC1CNCCC1=O Amb24075970 [0,0,0,0,1,0|1,0,2]=4 703 B8R1.5 OC1OCCCC1=O Amb24645841 [0,0,0,0,1,0|1,0,2]=4 704 B8R1.5 ON1CNCCC1=O Amb24120639 [0,0,0,0,1,0|2,0,1]=4 705 B8R1.5 O[C@@H]1CCCNC1=O Amb22225342 [0,0,0,0,1,0|1,0,2]=4 706 B8R1.5 O[C@@H]1COCCC1=O Amb25086646 [0,0,0,0,1,0|1,0,2]=4 707 B8R1.5 O[C@H]1CCCNC1=O Amb22226682 [0,0,0,0,1,0|1,0,2]=4 708 B10R1.71 CC1CNC(=O)CCCC1 Amb25211773 [0,0,0,0,0,1|2,0,1]=4 709 B10R1.71 C[C@H]1CNC(=O)CCCC1 Amb25239309 [0,0,0,0,0,1|2,0,1]=4 710 B10R1.71 NC1CCC(=O)CCCC1 Amb25709063 [0,0,0,0,0,1|2,0,1]=4 711 B10R1.71 O=C1CCC(=O)NCCN1 Amb22008621 [0,0,0,0,0,1|3,0,0]=4 712 B10R1.71 O=C1CCC(Cl)CCCC1 Amb24482470 [0,0,0,0,0,1|2,0,1]=4 713 B10R1.71 O=C1CCCCC(=O)C=C1 Amb24478182 [0,0,0,0,0,1|1,0,0]=2 714 B10R1.71 O=C1CCCCC(Cl)C=C1 Amb24552937 [0,0,0,0,0,1|2,0,1]=4 715 B10R1.71 O=C1CCCNC(=O)CO1 Amb24504877 [0,0,0,0,0,1|1,0,0]=2 716 B10R1.71 O=C1CNC(=O)CCCN1 Amb25324415 [0,0,0,0,0,1|2,0,0]=3 717 B10R1.71 O[C@H]1CCCCC(=O)C=C1 Amb25116428 [0,0,0,0,0,1|1,0,2]=4 718 B10R1.77 C=C1CC(=O)CCCCC1 Amb24478348 [0,0,0,0,0,1|2,0,0]=3 719 B10R1.77 CC1=CC(=O)COCCS1 Amb25713075 [0,0,0,0,0,1|3,0,0]=4 720 B10R1.77 CC1=CC(=O)CSCCS1 Amb24456635 [0,0,0,0,0,1|3,0,0]=4 721 B10R1.77 CC1CC(=O)CCCCC1 Amb24631575 [0,0,0,0,0,1|2,0,1]=4 722 B10R1.77 CC1CC(=O)NCCCC1 Amb24743149 [0,0,0,0,0,1|2,0,1]=4 723 B10R1.77 CC=1CC(=O)CCCCC1 Amb25146549 [0,0,0,0,0,1|2,0,0]=3 724 B10R1.77 CC=1CCCC=CC(=O)C1 Amb25052096 [0,0,0,0,0,1|2,0,1]=4 725 B10R1.77 CC=1CCCCCC(=O)C1 Amb25162774 [0,0,0,0,0,1|2,0,0]=3 726 B10R1.77 C[C@H]1CC(=O)NCCCC1 Amb24478975 [0,0,0,0,0,1|2,0,1]=4 727 B10R1.77 O=C1CC(=O)CCCCC1 Amb22497156 [0,0,0,0,0,1|1,0,0]=2 728 B10R1.77 O=C1CC(=O)NCCCN1 Amb24479110 [0,0,0,0,0,1|2,0,0]=3 729 B10R1.77 OC1CC(=O)CCCCC1 Amb24662265 [0,0,0,0,0,1|1,0,2]=4 730 B7R0.1 C#CCCCCC=O Amb25743704 [1,0,1,0,0,0|1,0,1]=4 731 B7R0.1 C=CCCCNC=O Amb25228418 [1,0,1,0,0,0|2,0,0]=4 732 B7R0.1 C=CCSCCC=O Amb18642815 [1,0,1,0,0,0|2,0,0]=4 733 B7R0.1 CCCCC#CC=O Amb17593134 [1,0,1,0,0,0|1,0,1]=4 734 B7R0.1 CCCCC=C=CBr Amb24650210 [1,0,1,0,0,0|2,0,0]=4 735 B7R0.1 CCCCCNC=O Amb22360637 [1,0,1,0,0,0|1,0,1]=4 736 B7R0.1 CCCCCON=O Amb17939401 [1,0,1,0,0,0|1,0,1]=4 737 B7R0.1 CCCC\C=C/C=O Amb25278292 [1,0,1,0,0,0|1,0,0]=3 738 B7R0.1 CCCC\C=C\C=C Amb22729011 [1,0,1,0,0,0|2,0,0]=4 739 B7R0.1 CCCO\C=C\C=O Amb25300597 [1,0,1,0,0,0|2,0,0]=4 740 B7R0.1 CCC\C=C/CC=O Amb24481514 [1,0,1,0,0,0|1,0,1]=4 741 B7R0.1 CCC\C=C\CC=O Amb24356718 [1,0,1,0,0,0|1,0,1]=4 742 B7R0.1 CCOC\C=C\C=O Amb24743396 [1,0,1,0,0,0|2,0,0]=4 743 B7R0.1 CNCCCOC=O Amb24505269 [1,0,1,0,0,0|1,0,1]=4 744 B7R0.1 CSCCCCC=O Amb25760866 [1,0,1,0,0,0|2,0,0]=4 745 B7R0.1 CSCC\C=C\C=O Amb25093794 [1,0,1,0,0,0|2,0,0]=4 746 B7R0.1 C\C=C/CCCC=O Amb24483048 [1,0,1,0,0,0|1,0,1]=4 747 B7R0.1 C\C=C\CCCC=O Amb18641700 [1,0,1,0,0,0|1,0,1]=4 748 B7R0.1 ClCCCCCC=O Amb16185781 [1,0,1,0,0,0|1,0,1]=4 749 B7R0.1 NCCCCCC=O Amb25680164 [1,0,1,0,0,0|1,0,1]=4 750 B7R0.1 O=CCCCCC#N Amb17593149 [1,0,1,0,0,0|1,0,1]=4 751 B7R0.1 O=CCCCCC=O Amb17593185 [1,0,1,0,0,0|0,0,0]=2 752 B7R0.1 O=CCCCCCBr Amb18127461 [1,0,1,0,0,0|1,0,1]=4 753 B7R0.1 O=CCCCCCF Amb24533888 [1,0,1,0,0,0|1,0,1]=4 754 B7R0.1 O=CCCCNC=O Amb25247142 [1,0,1,0,0,0|1,0,0]=3 755 B7R0.1 O=CCC\C=C/C=O Amb24453308 [1,0,1,0,0,0|0,0,2]=4 756 B7R0.1 O=CCC\C=C\C=O Amb18124241 [1,0,1,0,0,0|0,0,2]=4 757 B7R0.1 O=CNCCNC=O Amb1043861 [1,0,1,0,0,0|2,0,0]=4 758 B7R0.1 O=COCCCCCl Amb24599108 [1,0,1,0,0,0|1,0,1]=4 759 B7R0.1 O=COCOCC=O Amb24736176 [1,0,1,0,0,0|2,0,0]=4 760 B7R0.1 O=C\C=C\CCCBr Amb24358710 [1,0,1,0,0,0|2,0,0]=4 761 B7R0.1 OCCCCCC=O Amb18641885 [1,0,1,0,0,0|0,0,1]=3 762 B7R0.1 OCCCCOC=O Amb25244169 [1,0,1,0,0,0|1,0,1]=4 763 B7R0.1 OCCC\C=C\C=O Amb25734444 [1,0,1,0,0,0|2,0,0]=4 764 B7R0.1 OCCOCCC=O Amb18641946 [1,0,1,0,0,0|1,0,1]=4 765 B7R0.1 OCCSCCC=O Amb25077144 [1,0,1,0,0,0|1,0,1]=4 766 B7R0.1 ON=CCCCC=O Amb25303136 [1,0,1,0,0,0|1,0,1]=4 767 B7R0.1 O\N=C\CCCC=O Amb24663073 [1,0,1,0,0,0|1,0,1]=4 768 B7R0.1 [C-]#[N+]CCCCC=O Amb25713544 [1,0,1,0,0,0|2,0,0]=4 769 B7R0.3 C=CC(=O)CCCBr Amb24726349 [1,0,1,0,0,0|2,0,0]=4 770 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,0,1,0,0,0|2,0,0]=4 771 B7R0.3 C=CC(=O)CCCN Amb25662517 [1,0,1,0,0,0|2,0,0]=4 772 B7R0.3 C=CC(=O)CCCO Amb25284731 [1,0,1,0,0,0|2,0,0]=4 773 B7R0.3 CC(C=O)CCCC Amb17593191 [1,0,1,0,0,0|1,0,1]=4 774 B7R0.3 CCC(=O)CNCC Amb25032080 [1,0,1,0,0,0|2,0,0]=4 775 B7R0.3 CCC(=O)CSCC Amb24715230 [1,0,1,0,0,0|2,0,0]=4 776 B7R0.3 CCC(=O)NOCC Amb24481448 [1,0,1,0,0,0|2,0,0]=4 777 B7R0.3 CCC(=O)\C=C/CC Amb25128986 [1,0,1,0,0,0|1,0,0]=3 778 B7R0.3 CCC(=O)\C=C/NC Amb24689535 [1,0,1,0,0,0|2,0,0]=4 779 B7R0.3 CCC(=O)\C=C\CC Amb25283354 [1,0,1,0,0,0|1,0,0]=3 780 B7R0.3 CCC(=O)\C=C\CO Amb24550059 [1,0,1,0,0,0|2,0,0]=4 781 B7R0.3 CCC(=O)\C=C\NC Amb24461610 [1,0,1,0,0,0|2,0,0]=4 782 B7R0.3 CCC(=O)\C=C\OC Amb24333414 [1,0,1,0,0,0|2,0,0]=4 783 B7R0.3 CCCCC(=N)OC Amb17617956 [1,0,1,0,0,0|1,0,1]=4 784 B7R0.3 CCCCC(=N)OC Amb25353357 [1,0,1,0,0,0|1,0,1]=4 785 B7R0.3 CCCCC(=O)C#N Amb22729179 [1,0,1,0,0,0|1,0,1]=4 786 B7R0.3 CCCCC(=O)C=C Amb25062494 [1,0,1,0,0,0|1,0,0]=3 787 B7R0.3 CCCCC(=O)C=O Amb18124252 [1,0,1,0,0,0|0,0,0]=2 788 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,0,1,0,0,0|1,0,1]=4 789 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,0,1,0,0,0|1,0,1]=4 790 B7R0.3 CCCCC(=O)CF Amb24483296 [1,0,1,0,0,0|1,0,1]=4 791 B7R0.3 CCCCC(=O)CN Amb24473062 [1,0,1,0,0,0|1,0,1]=4 792 B7R0.3 CCCCC(=O)SC Amb25225724 [1,0,1,0,0,0|0,1,1]=4 793 B7R0.3 CCCCC(C)=CC Amb22229367 [1,0,1,0,0,0|2,0,0]=4 794 B7R0.3 CCCCC(C=O)Br Amb17594581 [1,0,1,0,0,0|1,0,1]=4 795 B7R0.3 CCCCC(Cl)=CBr Amb24552431 [1,0,1,0,0,0|2,0,0]=4 796 B7R0.3 CCCCC(Cl)=CCl Amb24512078 [1,0,1,0,0,0|2,0,0]=4 797 B7R0.3 CCCCC(Cl)C=O Amb18642973 [1,0,1,0,0,0|1,0,1]=4 798 B7R0.3 CCCCC(F)=CBr Amb24483089 [1,0,1,0,0,0|2,0,0]=4 799 B7R0.3 CCCC[14C](=O)O[Na] Amb22734535 [1,0,1,0,0,0|1,0,0]=3 800 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [1,0,1,0,0,0|0,0,2]=4 801 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [1,0,1,0,0,0|1,0,1]=4 802 B7R0.3 CCCC\C(\Br)=C/Cl Amb25663235 [1,0,1,0,0,0|2,0,0]=4 803 B7R0.3 CCCC\C(\C)=C/Cl Amb24627150 [1,0,1,0,0,0|2,0,0]=4 804 B7R0.3 CCCC\C(\Cl)=C/Cl Amb25745924 [1,0,1,0,0,0|2,0,0]=4 805 B7R0.3 CCCNC(=O)OC Amb17797997 [1,0,1,0,0,0|1,0,1]=4 806 B7R0.3 CCCOC(=C)C=O Amb24483012 [1,0,1,0,0,0|2,0,0]=4 807 B7R0.3 CCCOC(=O)C=C Amb22045218 [1,0,1,0,0,0|2,0,0]=4 808 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,0,1,0,0,0|1,0,0]=3 809 B7R0.3 CCC\C=C(/C)\C=O Amb25194656 [1,0,1,0,0,0|1,0,1]=4 810 B7R0.3 CCC\C=C(/F)\C=O Amb24653634 [1,0,1,0,0,0|1,0,1]=4 811 B7R0.3 CCC\C=C(\C)/C=O Amb18641699 [1,0,1,0,0,0|1,0,1]=4 812 B7R0.3 CCC\C=C(\Cl)/C=O Amb18124371 [1,0,1,0,0,0|1,0,1]=4 813 B7R0.3 CCC\C=C(\F)/C=O Amb18641881 [1,0,1,0,0,0|1,0,1]=4 814 B7R0.3 CCNCC(=O)OC Amb19514718 [1,0,1,0,0,0|1,0,1]=4 815 B7R0.3 CCSCC(=C)C=O Amb18642813 [1,0,1,0,0,0|2,0,0]=4 816 B7R0.3 CCSCC(=O)C=O Amb24741839 [1,0,1,0,0,0|1,0,0]=3 817 B7R0.3 CC\C=C/C(=O)OC Amb10071549 [1,0,1,0,0,0|2,0,0]=4 818 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [1,0,1,0,0,0|2,0,0]=4 819 B7R0.3 CC\C=C\C(=O)NC Amb25345934 [1,0,1,0,0,0|2,0,0]=4 820 B7R0.3 CNCCC(=O)OC Amb22168213 [1,0,1,0,0,0|1,0,1]=4 821 B7R0.3 COC(=O)CCCS Amb19373761 [1,0,1,0,0,0|1,0,1]=4 822 B7R0.3 COCCC(=O)C=C Amb24744935 [1,0,1,0,0,0|2,0,0]=4 823 B7R0.3 COCCC(=O)C=O Amb24722152 [1,0,1,0,0,0|1,0,0]=3 824 B7R0.3 CSCCC(=O)C=C Amb25334636 [1,0,1,0,0,0|2,0,0]=4 825 B7R0.3 C\C(\CCCC)=C/C Amb22731328 [1,0,1,0,0,0|2,0,0]=4 826 B7R0.3 C\C=C/CC(=O)CC Amb25357896 [1,0,1,0,0,0|1,0,1]=4 827 B7R0.3 C\C=C\CC(=O)CC Amb24590969 [1,0,1,0,0,0|1,0,1]=4 828 B7R0.3 O=CC(=O)CCCCl Amb24385284 [1,0,1,0,0,0|1,0,0]=3 829 B7R0.3 O=CC(=O)OCCCl Amb24515849 [1,0,1,0,0,0|2,0,0]=4 830 B7R0.3 O=CCCC(=O)C=O Amb25024665 [1,0,1,0,0,0|1,0,1]=4 831 B7R0.7 C=COC(=O)CCI Amb17934195 [1,0,1,0,0,0|1,0,1]=4 832 B7R0.7 C=COC(=O)CCO Amb24591909 [1,0,1,0,0,0|1,0,1]=4 833 B7R0.7 CCCC(=O)C#CC Amb17593135 [1,0,1,0,0,0|1,0,1]=4 834 B7R0.7 CCCC(=O)CSC Amb24429589 [1,0,1,0,0,0|2,0,0]=4 835 B7R0.7 CCCC(=O)N=C=O Amb17231812 [1,0,1,0,0,0|1,0,1]=4 836 B7R0.7 CCCC(=O)NC=C Amb24680969 [1,0,1,0,0,0|1,0,1]=4 837 B7R0.7 CCCC(=O)NC=O Amb25662604 [1,0,1,0,0,0|1,0,0]=3 838 B7R0.7 CCCC(=O)OCI Amb24395963 [1,0,1,0,0,0|1,0,1]=4 839 B7R0.7 CCCC(=O)OCN Amb24426649 [1,0,1,0,0,0|1,0,1]=4 840 B7R0.7 CCCC(=O)\C=C\Cl Amb17593395 [1,0,1,0,0,0|2,0,0]=4 841 B7R0.7 CCCC(=O)\C=C\N Amb17593176 [1,0,1,0,0,0|2,0,0]=4 842 B7R0.7 CCCC(=O)\C=C\O Amb25162790 [1,0,1,0,0,0|1,0,1]=4 843 B7R0.7 CCCC(Br)=CC=O Amb24513209 [1,0,1,0,0,0|2,0,0]=4 844 B7R0.7 CCCC(O)=CC=O Amb25745986 [1,0,1,0,0,0|1,0,1]=4 845 B7R0.7 CCCS(=O)CC=O Amb24483295 [1,0,1,0,0,0|2,0,0]=4 846 B7R0.7 CCC\C(\C)=C/C=O Amb25039965 [1,0,1,0,0,0|2,0,0]=4 847 B7R0.7 CCC\C(\O)=C\C=O Amb24481551 [1,0,1,0,0,0|1,0,1]=4 848 B7R0.7 CCOC(=N)CCC Amb20672875 [1,0,1,0,0,0|1,0,1]=4 849 B7R0.7 CCOC(=N)CCC Amb25070806 [1,0,1,0,0,0|1,0,1]=4 850 B7R0.7 CCOC(=O)CCF Amb22492835 [1,0,1,0,0,0|1,0,1]=4 851 B7R0.7 CCOC(=O)CCI Amb19957952 [1,0,1,0,0,0|1,0,1]=4 852 B7R0.7 CCOC(=O)CCS Amb20620159 [1,0,1,0,0,0|1,0,1]=4 853 B7R0.7 CCOC(=O)CC[NH3+] Amb24113699 [1,0,1,0,0,0|1,0,1]=4 854 B7R0.7 CCOC(=O)OC=C Amb25746316 [1,0,1,0,0,0|1,0,1]=4 855 B7R0.7 CCOC(=S)CCC Amb22168045 [1,0,1,0,0,0|0,1,1]=4 856 B7R0.7 C\C=C\C(=O)CCC Amb25717214 [1,0,1,0,0,0|1,0,0]=3 857 B7R0.7 C\C=C\C(=O)CCO Amb25373363 [1,0,1,0,0,0|2,0,0]=4 858 B7R0.7 C\C=C\C(=O)NCC Amb25757656 [1,0,1,0,0,0|2,0,0]=4 859 B7R0.7 [13CH3][13CH2]O[13C](=O)O[13CH2][13CH3] Amb22354006 [1,0,1,0,0,0|1,0,1]=4 860 B7R0.2 CC(=C)OC(=O)CCl Amb24599988 [1,0,1,0,0,0|2,0,0]=4 861 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [1,0,1,0,0,0|2,0,0]=4 862 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [1,0,1,0,0,0|2,0,0]=4 863 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [1,0,1,0,0,0|2,0,0]=4 864 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [1,0,1,0,0,0|2,0,0]=4 865 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [1,0,1,0,0,0|2,0,0]=4 866 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [1,0,1,0,0,0|1,1,0]=4 867 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [1,0,1,0,0,0|2,0,0]=4 868 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [1,0,1,0,0,0|2,0,0]=4 869 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [1,0,1,0,0,0|2,0,0]=4 870 B7R0.2 CC(=O)NC(=O)CS Amb24483055 [1,0,1,0,0,0|2,0,0]=4 871 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [1,0,1,0,0,0|2,0,0]=4 872 B7R0.2 CC(=O)NC(=O)SC Amb24481559 [1,0,1,0,0,0|2,0,0]=4 873 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [1,0,1,0,0,0|1,1,0]=4 874 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [1,0,1,0,0,0|1,0,0]=3 875 B7R0.2 CC(=O)OC(=C)CCl Amb25378300 [1,0,1,0,0,0|2,0,0]=4 876 B7R0.2 CC(=O)OC(=O)C=C Amb25770477 [1,0,1,0,0,0|0,0,2]=4 877 B7R0.2 CC(=O)OC(=O)CBr Amb24524284 [1,0,1,0,0,0|1,0,0]=3 878 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [1,0,1,0,0,0|0,0,0]=2 879 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [1,0,1,0,0,0|2,0,0]=4 880 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [1,0,1,0,0,0|2,0,0]=4 881 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [1,0,1,0,0,0|1,0,1]=4 882 B7R0.2 CC(C)=CC(=O)CC Amb25715052 [1,0,1,0,0,0|2,0,0]=4 883 B7R0.2 CC([O-])=CC(=O)CC Amb22474100 [1,0,1,0,0,0|1,0,1]=4 884 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [1,0,1,0,0,0|2,0,0]=4 885 B7R0.2 CCC(=O)OC(C)O Amb25234635 [1,0,1,0,0,0|0,0,2]=4 886 B7R0.2 C\C(\Br)=C\C(=O)CC Amb24356848 [1,0,1,0,0,0|2,0,0]=4 887 B7R0.2 C\C(\Cl)=C/C(=O)CC Amb24434564 [1,0,1,0,0,0|2,0,0]=4 888 B7R0.4 BrCCCCC(=O)C Amb16234126 [1,0,1,0,0,0|2,0,0]=4 889 B7R0.4 C=C(Br)CCCC=O Amb24390485 [1,0,1,0,0,0|2,0,0]=4 890 B7R0.4 C=CCCCC(=O)C Amb17593171 [1,0,1,0,0,0|1,0,1]=4 891 B7R0.4 C=CCCCC(N)=O Amb24579642 [1,0,1,0,0,0|1,0,1]=4 892 B7R0.4 C=CCSCC(=O)O Amb1110888 [1,0,1,0,0,0|1,0,1]=4 893 B7R0.4 CC(=C)CCCC=O Amb18641705 [1,0,1,0,0,0|2,0,0]=4 894 B7R0.4 CC(=O)CCCC=O Amb18641775 [1,0,1,0,0,0|1,0,0]=3 895 B7R0.4 CC(=O)CCNC=O Amb25075578 [1,0,1,0,0,0|2,0,0]=4 896 B7R0.4 CC(=O)CCOC=O Amb24408302 [1,0,1,0,0,0|2,0,0]=4 897 B7R0.4 CC(=O)COCC=O Amb18641868 [1,0,1,0,0,0|2,0,0]=4 898 B7R0.4 CC(=O)OCCC=O Amb18641862 [1,0,1,0,0,0|2,0,0]=4 899 B7R0.4 CC(=O)OCCCF Amb22008199 [1,0,1,0,0,0|1,0,1]=4 900 B7R0.4 CC(=O)OCCCI Amb24532815 [1,0,1,0,0,0|1,0,1]=4 901 B7R0.4 CC(=O)OCCCN Amb18641920 [1,0,1,0,0,0|1,0,1]=4 902 B7R0.4 CC(=O)OCCCO Amb25854267 [1,0,1,0,0,0|1,0,1]=4 903 B7R0.4 CC(=O)OOCCBr Amb22233446 [1,0,1,0,0,0|2,0,0]=4 904 B7R0.4 CC(=O)O\C=C\CBr Amb25053906 [1,0,1,0,0,0|1,0,1]=4 905 B7R0.4 CC(=O)O\C=C\CCl Amb24671285 [1,0,1,0,0,0|1,0,1]=4 906 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,0,1,0,0,0|2,0,0]=4 907 B7R0.4 CC(=O)\C=C\CCCl Amb25806173 [1,0,1,0,0,0|2,0,0]=4 908 B7R0.4 CC(O)CCCC=O Amb18641887 [1,0,1,0,0,0|1,0,1]=4 909 B7R0.4 CCCC=NC(N)=O Amb24411468 [1,0,1,0,0,0|2,0,0]=4 910 B7R0.4 CCCCCC([O-])=O Amb22337624 [1,0,1,0,0,0|0,0,2]=4 911 B7R0.4 CCCCCC([O-])=O Amb22525161 [1,0,1,0,0,0|0,0,2]=4 912 B7R0.4 CCCCCC([O-])=O Amb22730527 [1,0,1,0,0,0|0,0,2]=4 913 B7R0.4 CCCCCC([O-])=O Amb22731343 [1,0,1,0,0,0|0,0,2]=4 914 B7R0.4 CCCCC[13C](O)=O Amb22353417 [1,0,1,0,0,0|0,0,1]=3 915 B7R0.4 CCCCOC(=O)F Amb24710483 [1,0,1,0,0,0|1,0,1]=4 916 B7R0.4 CCCCOC(C)=S Amb22230357 [1,0,1,0,0,0|0,1,1]=4 917 B7R0.4 CCCCSC(=O)C Amb10552685 [1,0,1,0,0,0|0,1,1]=4 918 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [1,0,1,0,0,0|0,0,1]=3 919 B7R0.4 CCCNCC(=O)O Amb10609640 [1,0,1,0,0,0|1,0,1]=4 920 B7R0.4 CCCNCC(=O)O Amb1110628 [1,0,1,0,0,0|1,0,1]=4 921 B7R0.4 CCCSCC(=O)O Amb1137113 [1,0,1,0,0,0|1,0,1]=4 922 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [1,0,1,0,0,0|1,0,0]=3 923 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,0,1,0,0,0|1,0,0]=3 924 B7R0.4 CCN\C=C\C(C)=O Amb24761435 [1,0,1,0,0,0|2,0,0]=4 925 B7R0.4 CCOCOC(C)=O Amb25191864 [1,0,1,0,0,0|1,0,1]=4 926 B7R0.4 CCO\C=C/C(C)=O Amb24379536 [1,0,1,0,0,0|2,0,0]=4 927 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [1,0,1,0,0,0|2,0,0]=4 928 B7R0.4 CCS\C=C\C(C)=O Amb25328935 [1,0,1,0,0,0|2,0,0]=4 929 B7R0.4 CC\C=C\OC(C)=O Amb25219263 [1,0,1,0,0,0|0,0,1]=3 930 B7R0.4 CNCCCC(=O)O Amb1153115 [1,0,1,0,0,0|1,0,1]=4 931 B7R0.4 CNCCOC(C)=O Amb18124262 [1,0,1,0,0,0|1,0,1]=4 932 B7R0.4 COC\C=C\C(C)=O Amb25066961 [1,0,1,0,0,0|2,0,0]=4 933 B7R0.4 CSCCCC(=O)O Amb17503622 [1,0,1,0,0,0|1,0,1]=4 934 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [1,0,1,0,0,0|2,0,0]=4 935 B7R0.4 CSC\C=C\C(C)=O Amb24515276 [1,0,1,0,0,0|2,0,0]=4 936 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [1,0,1,0,0,0|1,0,1]=4 937 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [1,0,1,0,0,0|1,0,1]=4 938 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [1,0,1,0,0,0|1,0,1]=4 939 B7R0.4 N#CCCCC(O)=O Amb18560874 [1,0,1,0,0,0|1,0,1]=4 940 B7R0.4 NC(=O)CCCCI Amb25788033 [1,0,1,0,0,0|2,0,0]=4 941 B7R0.4 NC(=O)CCNC=O Amb24630476 [1,0,1,0,0,0|2,0,0]=4 942 B7R0.4 NC(=O)CSCC=O Amb25806671 [1,0,1,0,0,0|2,0,0]=4 943 B7R0.4 NCCCCC(N)=O Amb18641897 [1,0,1,0,0,0|2,0,0]=4 944 B7R0.4 NCCCCC([O-])=O Amb22753853 [1,0,1,0,0,0|1,0,1]=4 945 B7R0.4 NCCCCP(O)=O Amb24520720 [1,0,1,0,0,0|2,0,0]=4 946 B7R0.4 NCCCNC(O)=O Amb24093884 [1,0,1,0,0,0|2,0,0]=4 947 B7R0.4 NCCNCC(=O)O Amb17608063 [1,0,1,0,0,0|2,0,0]=4 948 B7R0.4 NCCNCC(O)=O Amb19958818 [1,0,1,0,0,0|2,0,0]=4 949 B7R0.4 NCCOCC(O)=O Amb18630146 [1,0,1,0,0,0|2,0,0]=4 950 B7R0.4 NCCOCC(O)=O Amb22751540 [1,0,1,0,0,0|2,0,0]=4 951 B7R0.4 NCCSCC(=O)O Amb17500446 [1,0,1,0,0,0|2,0,0]=4 952 B7R0.4 NCCSCC(O)=O Amb20622325 [1,0,1,0,0,0|2,0,0]=4 953 B7R0.4 NNCCCC(O)=O Amb24455803 [1,0,1,0,0,0|2,0,0]=4 954 B7R0.4 NOCCCC(=O)O Amb10975956 [1,0,1,0,0,0|2,0,0]=4 955 B7R0.4 NOCCCC(O)=O Amb22011795 [1,0,1,0,0,0|2,0,0]=4 956 B7R0.4 O=C(F)CCCCCl Amb24472276 [1,0,1,0,0,0|2,0,0]=4 957 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,0,1,0,0,0|0,0,0]=2 958 B7R0.4 O=CCCNC(=O)C Amb17102165 [1,0,1,0,0,0|2,0,0]=4 959 B7R0.4 OC(=O)CCC=C=C Amb10605299 [1,0,1,0,0,0|0,0,2]=4 960 B7R0.4 OC(=O)CCNC=O Amb18290434 [1,0,1,0,0,0|1,0,0]=3 961 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [1,0,1,0,0,0|1,0,1]=4 962 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [1,0,1,0,0,0|1,0,1]=4 963 B7R0.4 OC(=O)CNCCS Amb18124468 [1,0,1,0,0,0|1,1,0]=4 964 B7R0.4 OC(=O)COCCBr Amb24057760 [1,0,1,0,0,0|2,0,0]=4 965 B7R0.4 OC(=O)COCCCl Amb21857870 [1,0,1,0,0,0|2,0,0]=4 966 B7R0.4 OC(=O)CSCC=O Amb24628311 [1,0,1,0,0,0|1,0,0]=3 967 B7R0.4 OC(=O)CSCCCl Amb18644703 [1,0,1,0,0,0|2,0,0]=4 968 B7R0.4 OC(=O)CSCCS Amb24711400 [1,0,1,0,0,0|1,1,0]=4 969 B7R0.4 OC(=O)C\C=C\C=O Amb24437944 [1,0,1,0,0,0|0,0,2]=4 970 B7R0.4 OCCCCC(=O)C Amb10603864 [1,0,1,0,0,0|1,0,1]=4 971 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [1,0,1,0,0,0|0,0,2]=4 972 B7R0.4 OCCCCC(O)=O Amb22351244 [1,0,1,0,0,0|0,0,1]=3 973 B7R0.4 OCCSCC(=O)O Amb1110090 [1,0,1,0,0,0|1,0,1]=4 974 B7R0.4 SCCCCC(=O)O Amb17503767 [1,0,1,0,0,0|0,1,0]=3 975 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [1,0,1,0,0,0|0,0,2]=4 976 B7R1.24 C1CC=COC=C1 Amb25745349 [2,0,0,0,0,0|0,0,2]=4 977 B7R1.24 C1CCC=CC=C1 Amb22002708 [2,0,0,0,0,0|1,0,1]=4 978 B7R1.24 C1CCCCCO1 Amb22045221 [2,0,0,0,0,0|0,0,2]=4 979 B7R1.24 C1CCCCON1 Amb25025475 [2,0,0,0,0,0|1,0,1]=4 980 B9R0.4 CC(=C)CC(=O)CCCC Amb25303713 [0,1,1,0,0,0|2,0,0]=4 981 B9R0.4 CC(=N)CC(=O)CCCC Amb25090358 [0,1,1,0,0,0|2,0,0]=4 982 B9R0.4 CC(=O)CC(=O)CCCBr Amb24477432 [0,1,1,0,0,0|2,0,0]=4 983 B9R0.4 CC(=O)CC(=O)CCCC Amb22347234 [0,1,1,0,0,0|1,0,0]=3 984 B9R0.4 CC(=O)CC(=O)CCOC Amb25760850 [0,1,1,0,0,0|2,0,0]=4 985 B9R0.4 CC(=O)CC(=O)COCC Amb23482990 [0,1,1,0,0,0|2,0,0]=4 986 B9R0.4 CC(=O)NC(=O)CNCC Amb25710685 [0,1,1,0,0,0|2,0,0]=4 987 B9R0.4 CC(=O)NC(=O)NCCC Amb24684678 [0,1,1,0,0,0|2,0,0]=4 988 B9R0.4 CC(=O)\C=C(/Cl)\CCCC Amb25712728 [0,1,1,0,0,0|2,0,0]=4 989 B9R0.4 CC(=O)\C=C(/N)\CCCC Amb25317904 [0,1,1,0,0,0|2,0,0]=4 990 B9R0.4 CC(=S)NC(=O)CCCC Amb24435382 [0,1,1,0,0,0|1,1,0]=4 991 B9R0.4 CC(CCCC)=CC(N)=O Amb25840047 [0,1,1,0,0,0|2,0,0]=4 992 B9R0.4 CC(CCCC)=NC(N)=O Amb24695360 [0,1,1,0,0,0|2,0,0]=4 993 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [0,1,1,0,0,0|2,0,0]=4 994 B9R0.4 CCCCC(=O)OC(C)C Amb22733766 [0,1,1,0,0,0|1,0,1]=4 995 B9R0.4 CCCCC(=O)OC(C)Cl Amb24692707 [0,1,1,0,0,0|1,0,1]=4 996 B9R0.4 CCCCC(Cl)=CC(O)=O Amb25179107 [0,1,1,0,0,0|2,0,0]=4 997 B9R0.4 CCCCC(Cl)OC(=O)Cl Amb24571701 [0,1,1,0,0,0|1,0,1]=4 998 B9R0.4 CCCCC(Cl)OC(C)=O Amb24724411 [0,1,1,0,0,0|1,0,1]=4 999 B9R0.4 CCCCC(F)=CC(O)=O Amb24568324 [0,1,1,0,0,0|2,0,0]=4 1000 B9R0.4 CCCCS(=O)CC(C)=O Amb25139843 [0,1,1,0,0,0|2,0,0]=4 1001 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [0,1,1,0,0,0|2,0,0]=4 1002 B9R0.4 CCCC\C(\C)=C\C(C)=O Amb24698890 [0,1,1,0,0,0|2,0,0]=4 1003 B9R0.4 CCCC\C(\Cl)=C/C(O)=O Amb25279577 [0,1,1,0,0,0|2,0,0]=4 1004 B9R0.4 CCCC\C(\F)=C/C(O)=O Amb18124779 [0,1,1,0,0,0|2,0,0]=4 1005 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [0,1,1,0,0,0|2,0,0]=4 1006 B9R0.4 CCCNC(=O)CC(N)=O Amb25355941 [0,1,1,0,0,0|2,0,0]=4 1007 B9R0.4 CCCNC(=O)NC(N)=O Amb25738585 [0,1,1,0,0,0|2,0,0]=4 1008 B9R0.4 CCCNC(=O)OC(=C)F Amb25375334 [0,1,1,0,0,0|2,0,0]=4 1009 B9R0.4 CCCOC(=O)CC(=O)C Amb17593619 [0,1,1,0,0,0|2,0,0]=4 1010 B9R0.4 CCCOC(=O)NC(N)=O Amb25371946 [0,1,1,0,0,0|2,0,0]=4 1011 B9R0.4 CCCSC(=O)NC(N)=O Amb24415236 [0,1,1,0,0,0|2,0,0]=4 1012 B9R0.4 CC[ClH]CC(=O)CC([O-])=O Amb22274860 [0,1,1,0,0,0|2,0,0]=4 1013 B9R0.4 CSCCC(=O)NC(N)=O Amb24632728 [0,1,1,0,0,0|2,0,0]=4 1014 B9R0.4 C\C(\N)=C\C(=O)CCCC Amb24608603 [0,1,1,0,0,0|2,0,0]=4 1015 B9R0.4 C\C(\O)=C/C(=O)CCCC Amb25146869 [0,1,1,0,0,0|1,0,1]=4 1016 B9R0.4 C\C(\O)=C\C(=O)CCCC Amb25729180 [0,1,1,0,0,0|1,0,1]=4 1017 B9R0.4 NC(=O)NC(=O)CCCCl Amb10610473 [0,1,1,0,0,0|2,0,0]=4 1018 B9R0.4 NC(=O)NC(=O)CCCN Amb18251281 [0,1,1,0,0,0|2,0,0]=4 1019 B9R0.4 NC(=O)NC(=O)CCCN Amb20669155 [0,1,1,0,0,0|2,0,0]=4 1020 B9R0.5 C=CCC(=O)CCCCBr Amb24477431 [0,1,1,0,0,0|2,0,0]=4 1021 B9R0.5 C=CCC(=O)CCCCF Amb25357850 [0,1,1,0,0,0|2,0,0]=4 1022 B9R0.5 C=CCC(=O)CCCCO Amb25319991 [0,1,1,0,0,0|2,0,0]=4 1023 B9R0.5 C=COC(=O)NCCCO Amb24673925 [0,1,1,0,0,0|2,0,0]=4 1024 B9R0.5 CCCCCC(=O)C=C=O Amb24478254 [0,1,1,0,0,0|1,0,1]=4 1025 B9R0.5 CCCCCC(=O)CC=N Amb25146702 [0,1,1,0,0,0|2,0,0]=4 1026 B9R0.5 CCCCCC(=O)CC=O Amb25365648 [0,1,1,0,0,0|1,0,0]=3 1027 B9R0.5 CCCCCC(=O)N=C=O Amb24392136 [0,1,1,0,0,0|1,0,1]=4 1028 B9R0.5 CCCCCC(=O)OC=C Amb17938956 [0,1,1,0,0,0|1,0,0]=3 1029 B9R0.5 CCCCCC(=O)OCCl Amb24568887 [0,1,1,0,0,0|1,0,1]=4 1030 B9R0.5 CCCCCC(=O)\C=C/N Amb24408490 [0,1,1,0,0,0|2,0,0]=4 1031 B9R0.5 CCCCCC(O)=CC=O Amb25224445 [0,1,1,0,0,0|1,0,1]=4 1032 B9R0.5 CCCCC\C(\C)=C\C=O Amb18643627 [0,1,1,0,0,0|2,0,0]=4 1033 B9R0.5 CCCCC\C(\O)=C\C=O Amb25326080 [0,1,1,0,0,0|1,0,1]=4 1034 B9R0.5 CCCCNC(=O)CC=C Amb24472259 [0,1,1,0,0,0|2,0,0]=4 1035 B9R0.5 CCCCNC(=O)OCC Amb10552892 [0,1,1,0,0,0|1,0,1]=4 1036 B9R0.5 CCCCNC(=O)OCCl Amb25703550 [0,1,1,0,0,0|1,0,1]=4 1037 B9R0.5 CCCCNC(=O)OCF Amb24681120 [0,1,1,0,0,0|1,0,1]=4 1038 B9R0.5 CCCCOC(=O)/C=C/C Amb17940289 [0,1,1,0,0,0|2,0,0]=4 1039 B9R0.5 CCCCOC(=O)CC=O Amb24722099 [0,1,1,0,0,0|1,0,0]=3 1040 B9R0.5 CCCCOC(=O)\C=C\N Amb24446980 [0,1,1,0,0,0|2,0,0]=4 1041 B9R0.5 CCCCSC(=O)OCCl Amb24482256 [0,1,1,0,0,0|1,0,1]=4 1042 B9R0.5 CCCOCC(=O)N=C=O Amb24480861 [0,1,1,0,0,0|1,0,1]=4 1043 B9R0.5 CCOC(=O)CCCCCl Amb24445064 [0,1,1,0,0,0|1,0,1]=4 1044 B9R0.5 CCOC(=O)CCCCN Amb19957938 [0,1,1,0,0,0|1,0,1]=4 1045 B9R0.5 CCOC(=O)CCCCS Amb25246862 [0,1,1,0,0,0|1,0,1]=4 1046 B9R0.5 CCOC(=O)CCCSC Amb25058939 [0,1,1,0,0,0|1,0,1]=4 1047 B9R0.5 CCOCCC(=O)CC=C Amb25092467 [0,1,1,0,0,0|2,0,0]=4 1048 B9R0.5 CCOCCC(=O)\C=C\Cl Amb24383480 [0,1,1,0,0,0|2,0,0]=4 1049 B9R0.5 COCCCC(=O)N=C=O Amb25361935 [0,1,1,0,0,0|1,0,1]=4 1050 B9R0.5 C\C(\CCCCO)=C/C=O Amb25262253 [0,1,1,0,0,0|2,0,0]=4 1051 B9R0.5 C\C=C/C(=O)CCCCC Amb25086296 [0,1,1,0,0,0|2,0,0]=4 1052 B9R0.5 C\C=C\C(=O)CCCCBr Amb25381449 [0,1,1,0,0,0|2,0,0]=4 1053 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [0,1,1,0,0,0|2,0,0]=4 1054 B9R0.5 C\C=C\C(=O)CCCCCl Amb24548775 [0,1,1,0,0,0|2,0,0]=4 1055 B9R0.5 C\C=C\C(=O)CCOCC Amb24676741 [0,1,1,0,0,0|2,0,0]=4 1056 B9R0.5 NCCCCC(=O)OCC Amb10807401 [0,1,1,0,0,0|1,0,1]=4 1057 B9R0.5 O=C(CCCCCl)OCCl Amb24692453 [0,1,1,0,0,0|1,0,1]=4 1058 B9R0.5 OCCCCC(=O)OCC Amb17593658 [0,1,1,0,0,0|1,0,1]=4 1059 B9R0.8 CC(=CC)C(=O)CCCC Amb25265828 [0,1,1,0,0,0|2,0,0]=4 1060 B9R0.8 CCCCC(=C)C(C)C=O Amb18643640 [0,1,1,0,0,0|2,0,0]=4 1061 B9R0.8 CCCCC(=O)C(C)C=C Amb25830470 [0,1,1,0,0,0|2,0,0]=4 1062 B9R0.8 CCCCC(=O)C(Cl)=CC Amb25328885 [0,1,1,0,0,0|2,0,0]=4 1063 B9R0.8 CCCCC(=O)C(Cl)C=C Amb25275016 [0,1,1,0,0,0|2,0,0]=4 1064 B9R0.8 CCCCC(=O)C(F)=CF Amb24610142 [0,1,1,0,0,0|2,0,0]=4 1065 B9R0.8 CCCCC(=O)\C(\Cl)=C\C Amb25713487 [0,1,1,0,0,0|2,0,0]=4 1066 B9R0.8 CCCCC(=O)\C(\F)=C\F Amb24478394 [0,1,1,0,0,0|2,0,0]=4 1067 B9R0.18 C=CCOC(=O)CCCBr Amb22049553 [0,1,1,0,0,0|2,0,0]=4 1068 B9R0.18 C=CCOC(=O)CCCCl Amb19960006 [0,1,1,0,0,0|2,0,0]=4 1069 B9R0.18 C=CCOC(=O)CCCN Amb24452753 [0,1,1,0,0,0|2,0,0]=4 1070 B9R0.18 C=CCOC(=O)CCCO Amb25297452 [0,1,1,0,0,0|2,0,0]=4 1071 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [0,1,1,0,0,0|2,0,0]=4 1072 B9R0.18 CCCCC(=O)CCC=O Amb24440961 [0,1,1,0,0,0|1,0,0]=3 1073 B9R0.18 CCCCC(=O)CON=C Amb25205215 [0,1,1,0,0,0|2,0,0]=4 1074 B9R0.18 CCCCC(=O)NCC=O Amb17102058 [0,1,1,0,0,0|1,0,0]=3 1075 B9R0.18 CCCCC(=O)NNC=O Amb24718146 [0,1,1,0,0,0|1,0,0]=3 1076 B9R0.18 CCCCC(=O)NOCC Amb10572674 [0,1,1,0,0,0|1,0,1]=4 1077 B9R0.18 CCCCC(=O)OCC#N Amb25168860 [0,1,1,0,0,0|1,0,1]=4 1078 B9R0.18 CCCCC(=O)OCC=C Amb22732606 [0,1,1,0,0,0|1,0,0]=3 1079 B9R0.18 CCCCC(=O)OCC=O Amb25729160 [0,1,1,0,0,0|0,0,0]=2 1080 B9R0.18 CCCCC(=O)OCCBr Amb24709719 [0,1,1,0,0,0|1,0,1]=4 1081 B9R0.18 CCCCC(=O)OCCCl Amb25292212 [0,1,1,0,0,0|1,0,1]=4 1082 B9R0.18 CCCCC(=O)OCCF Amb24447526 [0,1,1,0,0,0|1,0,1]=4 1083 B9R0.18 CCCCC(=O)\C=C/C=O Amb25299416 [0,1,1,0,0,0|1,0,0]=3 1084 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [0,1,1,0,0,0|2,0,0]=4 1085 B9R0.18 CCCCC(=O)\C=C\CBr Amb25255318 [0,1,1,0,0,0|2,0,0]=4 1086 B9R0.18 CCCCC(=O)\C=C\CC Amb25219828 [0,1,1,0,0,0|2,0,0]=4 1087 B9R0.18 CCCCC(=O)\C=C\CCl Amb24688759 [0,1,1,0,0,0|2,0,0]=4 1088 B9R0.18 CCCCC(=O)\C=C\CO Amb25735097 [0,1,1,0,0,0|1,0,1]=4 1089 B9R0.18 CCCCC(Cl)COC=O Amb25336582 [0,1,1,0,0,0|1,0,1]=4 1090 B9R0.18 CCCNC(=O)CNC=O Amb25323138 [0,1,1,0,0,0|2,0,0]=4 1091 B9R0.18 CCCNC(=O)ON=CC Amb25219884 [0,1,1,0,0,0|2,0,0]=4 1092 B9R0.18 CCCOC(=O)OCC=C Amb25185097 [0,1,1,0,0,0|2,0,0]=4 1093 B9R0.18 CCCOC(=O)\C=C\C=O Amb24478353 [0,1,1,0,0,0|2,0,0]=4 1094 B9R0.18 COCCC(=O)OCC=C Amb25130992 [0,1,1,0,0,0|2,0,0]=4 1095 B9R0.18 COCCC(=O)\C=C/C=O Amb25103311 [0,1,1,0,0,0|2,0,0]=4 1096 B9R0.18 CSCCC(=O)NNC=O Amb25074382 [0,1,1,0,0,0|2,0,0]=4 1097 B9R0.34 CCC(Br)CC(=O)OCC Amb24695293 [0,1,1,0,0,0|1,0,1]=4 1098 B9R0.34 CCC(C)CC(=O)CC=C Amb25737376 [0,1,1,0,0,0|2,0,0]=4 1099 B9R0.34 CCC(C)CC(=O)N=C=O Amb24524441 [0,1,1,0,0,0|1,0,1]=4 1100 B9R0.34 CCC(C)CC(=O)\C=C\Cl Amb24741086 [0,1,1,0,0,0|2,0,0]=4 1101 B9R0.34 CCC(C)CS(=O)CC=O Amb25846516 [0,1,1,0,0,0|2,0,0]=4 1102 B9R0.34 CCC(N)CC(=O)CC=C Amb24569297 [0,1,1,0,0,0|2,0,0]=4 1103 B9R0.34 CCC(N)CC(=O)OCC Amb18644203 [0,1,1,0,0,0|1,0,1]=4 1104 B9R0.34 CCC(O)CC(=O)OCC Amb24476858 [0,1,1,0,0,0|1,0,1]=4 1105 B9R0.34 CCOC(=O)CC(CC)C Amb10807395 [0,1,1,0,0,0|1,0,1]=4 1106 B9R0.34 CC[C@@H](N)CC(=O)OCC Amb24351614 [0,1,1,0,0,0|1,0,1]=4 1107 B9R0.34 CC[C@@H](O)CC(=O)OCC Amb20241603 [0,1,1,0,0,0|1,0,1]=4 1108 B9R0.34 CC[C@H](C)CC(=O)\C=C\Cl Amb24482164 [0,1,1,0,0,0|2,0,0]=4 1109 B9R0.34 C\C=C\C(=O)CC(Cl)CC Amb25101667 [0,1,1,0,0,0|2,0,0]=4 1110 B9R0.34 C\C=C\C(=O)CC(O)CC Amb24647753 [0,1,1,0,0,0|2,0,0]=4 1111 B9R0.34 C\C=C\C(=O)C[C@@H](O)CC Amb24362834 [0,1,1,0,0,0|2,0,0]=4 1112 B9R0.35 CCCC(C)C(=O)CC=C Amb24412856 [0,1,1,0,0,0|2,0,0]=4 1113 B9R0.35 CCC[C@@H](C(=O)OCC)N Amb16233901 [0,1,1,0,0,0|1,0,1]=4 1114 B9R0.35 CCOC(=O)C(Cl)CCC Amb18800860 [0,1,1,0,0,0|1,0,1]=4 1115 B9R0.35 CCOC(=O)C(O)CCC Amb22350176 [0,1,1,0,0,0|1,0,1]=4 1116 B9R0.35 CCOC(=O)C(S)CCC Amb24613784 [0,1,1,0,0,0|1,0,1]=4 1117 B9R0.35 CCOC(=O)[C@@H](Br)CCC Amb25857084 [0,1,1,0,0,0|1,0,1]=4 1118 B9R0.35 CCOC(=O)[C@@H](N)CCC Amb22747761 [0,1,1,0,0,0|1,0,1]=4 1119 B9R0.35 CCOC(=O)[C@H](Br)CCC Amb25857397 [0,1,1,0,0,0|1,0,1]=4 1120 B9R0.35 CCOC(=O)[C@H](O)CCC Amb22225395 [0,1,1,0,0,0|1,0,1]=4 1121 B9R0.35 C\C=C\C(=O)C(C)CCC Amb25851161 [0,1,1,0,0,0|2,0,0]=4 1122 B9R0.35 C\C=C\C(=O)C(O)CCC Amb25179149 [0,1,1,0,0,0|2,0,0]=4 1123 B9R0.40 CCCCC(CBr)OC=O Amb24442778 [0,1,1,0,0,0|1,0,1]=4 1124 B9R0.40 CCCCC(CC=O)=C=C Amb25859244 [0,1,1,0,0,0|2,0,0]=4 1125 B9R0.40 CCCCC(CCl)OC=O Amb24460798 [0,1,1,0,0,0|1,0,1]=4 1126 B9R0.40 CCCCN(CC=O)N=O Amb25124921 [0,1,1,0,0,0|2,0,0]=4 1127 B9R0.40 CCCC\C(=C\C=O)\CC Amb10563470 [0,1,1,0,0,0|2,0,0]=4 1128 B9R0.48 CC(=O)CCC(=O)OC=C Amb24633305 [0,1,1,0,0,0|1,0,1]=4 1129 B9R0.48 CC(C)CCC(=O)CC=C Amb25850789 [0,1,1,0,0,0|2,0,0]=4 1130 B9R0.48 CC(C)CCC(=O)CC=O Amb24640237 [0,1,1,0,0,0|1,0,0]=3 1131 B9R0.48 CC(C)CCC(=O)N=C=O Amb25202030 [0,1,1,0,0,0|1,0,1]=4 1132 B9R0.48 CC(C)CCC(=O)OCCl Amb24480678 [0,1,1,0,0,0|1,0,1]=4 1133 B9R0.48 CC(C)CCS(=O)CC=O Amb24387124 [0,1,1,0,0,0|2,0,0]=4 1134 B9R0.48 CC(C)COC(=O)CC=O Amb24730671 [0,1,1,0,0,0|2,0,0]=4 1135 B9R0.48 CC(N)CCC(=O)CC=C Amb24655721 [0,1,1,0,0,0|2,0,0]=4 1136 B9R0.48 CCOC(=O)CCC(C)Br Amb20618752 [0,1,1,0,0,0|1,0,1]=4 1137 B9R0.48 CCOC(=O)CCC(C)Cl Amb22229742 [0,1,1,0,0,0|1,0,1]=4 1138 B9R0.48 CCOC(=O)CCC(C)N Amb25690130 [0,1,1,0,0,0|1,0,1]=4 1139 B9R0.48 CCOC(=O)CC[C@@H](C)N Amb24505134 [0,1,1,0,0,0|1,0,1]=4 1140 B9R0.48 C\C=C\C(=O)CCC(C)C Amb25713700 [0,1,1,0,0,0|2,0,0]=4 1141 B9R0.48 Cl\C=C\C(=O)CCC(C)C Amb17594013 [0,1,1,0,0,0|2,0,0]=4 1142 B9R0.66 CCCCS(=O)(=O)CC=O Amb24678036 [0,1,1,0,0,0|2,0,0]=4 1143 B9R0.6 CC(=O)C(=C)C(=O)OCC Amb24707498 [0,1,1,0,0,0|2,0,0]=4 1144 B9R0.6 CC(=O)C(=N)C(=O)OCC Amb24527856 [0,1,1,0,0,0|2,0,0]=4 1145 B9R0.6 CC(=O)C(=S)C(=O)OCC Amb25202747 [0,1,1,0,0,0|2,0,0]=4 1146 B9R0.6 CC(=O)C(Br)C(=O)OCC Amb22232107 [0,1,1,0,0,0|2,0,0]=4 1147 B9R0.6 CC(=O)C(C)C(=O)NCC Amb24096571 [0,1,1,0,0,0|2,0,0]=4 1148 B9R0.6 CC(=O)C(N)C(=O)OCC Amb18124722 [0,1,1,0,0,0|2,0,0]=4 1149 B9R0.6 CC(=O)C(O)C(=O)CCC Amb25686201 [0,1,1,0,0,0|1,0,0]=3 1150 B9R0.6 CC(=O)[C@@H](O)C(=O)CCC Amb25317546 [0,1,1,0,0,0|1,0,0]=3 1151 B9R0.6 CC(=O)[C@H](C)C(=O)OCC Amb24524695 [0,1,1,0,0,0|2,0,0]=4 1152 B9R0.6 CC(=O)[C@H](O)C(=O)CCC Amb25682412 [0,1,1,0,0,0|1,0,0]=3 1153 B9R0.6 CC(N)=C(Br)C(=O)CCC Amb24574007 [0,1,1,0,0,0|2,0,0]=4 1154 B9R0.6 CCCC(=O)C(C(=O)C)C Amb17593599 [0,1,1,0,0,0|1,0,0]=3 1155 B9R0.6 CCC\C(\C)=C(/C)\C(C)=O Amb25318975 [0,1,1,0,0,0|2,0,0]=4 1156 B9R0.6 CCOC(=O)C(=O)C(=O)C Amb17593616 [0,1,1,0,0,0|2,0,0]=4 1157 B9R0.6 CCOC(=O)C(C(=O)C)O Amb17593653 [0,1,1,0,0,0|2,0,0]=4 1158 B9R0.6 C\C(\N)=C(/Br)\C(=O)CCC Amb25727770 [0,1,1,0,0,0|2,0,0]=4 1159 B9R0.14 CC(=O)NC(CCC)=NC Amb24741054 [0,1,1,0,0,0|2,0,0]=4 1160 B9R0.14 CC(=O)O\C(\C=O)=C/CC Amb18643839 [0,1,1,0,0,0|0,0,1]=3 1161 B9R0.14 CC(=O)O\C(\C=O)=C\CC Amb25216216 [0,1,1,0,0,0|0,0,1]=3 1162 B9R0.14 CC(=O)O\C(\CBr)=C/CC Amb24549604 [0,1,1,0,0,0|1,0,1]=4 1163 B9R0.14 CC(=O)\C=C(\CCC)/OC Amb24504940 [0,1,1,0,0,0|1,0,1]=4 1164 B9R0.14 CCCC(C=C)OC(C)=O Amb22227963 [0,1,1,0,0,0|1,0,1]=4 1165 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [0,1,1,0,0,0|0,0,1]=3 1166 B9R0.14 CCCC(CBr)OC(C)=O Amb24399943 [0,1,1,0,0,0|1,0,1]=4 1167 B9R0.14 CCCC(CCl)OC(C)=O Amb24480605 [0,1,1,0,0,0|1,0,1]=4 1168 B9R0.14 CCC[C@@H](CO)OC(C)=O Amb25307611 [0,1,1,0,0,0|0,0,2]=4 1169 B9R0.23 CC(=C)CC(=O)C(O)CC Amb25255917 [0,1,1,0,0,0|2,0,0]=4 1170 B9R0.23 CC(=O)CC(=O)C(C)CC Amb24544654 [0,1,1,0,0,0|1,0,0]=3 1171 B9R0.23 CC(=O)CC(=O)N(O)CC Amb24560535 [0,1,1,0,0,0|2,0,0]=4 1172 B9R0.23 CC(=O)NC(=O)C(C)CCl Amb18798253 [0,1,1,0,0,0|2,0,0]=4 1173 B9R0.23 CC(=O)NC(=O)N(C)CC Amb24073325 [0,1,1,0,0,0|2,0,0]=4 1174 B9R0.23 CC(=O)OC(=C)C(Br)CC Amb25790345 [0,1,1,0,0,0|1,0,0]=3 1175 B9R0.23 CC(=O)OC(=O)C(N)CO Amb25682987 [0,1,1,0,0,0|1,0,0]=3 1176 B9R0.23 CC(=O)OC(=O)[C@@H](N)CO Amb24376639 [0,1,1,0,0,0|1,0,0]=3 1177 B9R0.23 CC(C)=CC(=O)C(C)CC Amb24340512 [0,1,1,0,0,0|2,0,0]=4 1178 B9R0.23 CC(C)OC(=O)C(Br)CC Amb18090814 [0,1,1,0,0,0|1,0,1]=4 1179 B9R0.23 CC(C)OC(=O)C(C)CC Amb22353278 [0,1,1,0,0,0|1,0,1]=4 1180 B9R0.23 CC(C)OC(=O)C(F)CC Amb24401229 [0,1,1,0,0,0|1,0,1]=4 1181 B9R0.23 CC(C)OC(=O)C(S)CC Amb25027033 [0,1,1,0,0,0|1,0,1]=4 1182 B9R0.23 CC(C)OC(=O)[C@@H](O)CC Amb24362817 [0,1,1,0,0,0|1,0,1]=4 1183 B9R0.23 CC(CC)C(Cl)OC(C)=O Amb24509719 [0,1,1,0,0,0|1,0,1]=4 1184 B9R0.23 CC(OC(C)=O)C(O)CC Amb25225668 [0,1,1,0,0,0|1,0,1]=4 1185 B9R0.23 CCC(Br)C(=O)NC(N)=O Amb25239793 [0,1,1,0,0,0|2,0,0]=4 1186 B9R0.23 CCC(O)C(=O)NC(N)=O Amb24679845 [0,1,1,0,0,0|2,0,0]=4 1187 B9R0.23 CC[C@H](N)C(=O)NC(N)=O Amb24513573 [0,1,1,0,0,0|2,0,0]=4 1188 B9R0.23 C[C@H](OC(C)=O)[C@@H](Cl)CC Amb24634242 [0,1,1,0,0,0|1,0,1]=4 1189 B9R0.23 C\C(=C/C(C)=O)\C(C)CC Amb25142682 [0,1,1,0,0,0|2,0,0]=4 1190 B9R0.23 C\C(=C\C(C)=O)\C(C)CC Amb25718396 [0,1,1,0,0,0|2,0,0]=4 1191 B9R0.23 C\C(\S)=C\C(=O)C(C)CC Amb24583622 [0,1,1,0,0,0|1,1,0]=4 1192 B9R0.44 CCCC(=O)CS(C)(=O)=O Amb18800832 [0,1,1,0,0,0|2,0,0]=4 1193 B9R0.44 CCCC(=O)NS(C)(=O)=O Amb24403490 [0,1,1,0,0,0|2,0,0]=4 1194 B9R0.44 CCCC(=O)OP([O-])([O-])=O Amb22054609 [0,1,1,0,0,0|2,0,0]=4 1195 B9R0.53 CC(=C)CC(=O)CC(C)C Amb25827965 [0,1,1,0,0,0|2,0,0]=4 1196 B9R0.53 CC(=C)CC(=O)CC(C)N Amb25329079 [0,1,1,0,0,0|2,0,0]=4 1197 B9R0.53 CC(=O)CC(=N)CC(C)C Amb24706662 [0,1,1,0,0,0|2,0,0]=4 1198 B9R0.53 CC(=O)CC(=O)CN(C)C Amb25358908 [0,1,1,0,0,0|2,0,0]=4 1199 B9R0.53 CC(=O)CC(=O)NC(=O)C Amb2410281 [0,1,1,0,0,0|1,0,1]=4 1200 B9R0.53 CC(=O)CC(=O)OC(C)Cl Amb24509721 [0,1,1,0,0,0|2,0,0]=4 1201 B9R0.53 CC(=O)NC(=O)CC(C)C Amb24333719 [0,1,1,0,0,0|1,0,0]=3 1202 B9R0.53 CC(=O)NC(=O)NC(C)C Amb25848852 [0,1,1,0,0,0|2,0,0]=4 1203 B9R0.53 CC(=O)\C=C(/O)\CC(C)C Amb24524653 [0,1,1,0,0,0|1,0,1]=4 1204 B9R0.53 CC(C)=CC(=O)CC(C)C Amb24581834 [0,1,1,0,0,0|2,0,0]=4 1205 B9R0.53 CC(C)=CC(=O)CC(C)O Amb24478185 [0,1,1,0,0,0|2,0,0]=4 1206 B9R0.53 CC(C)CC(=O)CS(C)=O Amb24676845 [0,1,1,0,0,0|2,0,0]=4 1207 B9R0.53 CC(C)CC(=O)NC(N)=O Amb25352091 [0,1,1,0,0,0|2,0,0]=4 1208 B9R0.53 CC(C)CC(C)OC(C)=O Amb22733405 [0,1,1,0,0,0|1,0,1]=4 1209 B9R0.53 CC(C)CC(Cl)OC(C)=O Amb24424956 [0,1,1,0,0,0|1,0,1]=4 1210 B9R0.53 CC(C)CS(=O)CC(C)=O Amb25052491 [0,1,1,0,0,0|2,0,0]=4 1211 B9R0.53 CC(C)OC(=O)CC(C)C Amb22731225 [0,1,1,0,0,0|1,0,1]=4 1212 B9R0.53 CC(C)OC(=O)C[C@H](C)O Amb25080104 [0,1,1,0,0,0|1,0,1]=4 1213 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,1,1,0,0,0|1,0,1]=4 1214 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,1,1,0,0,0|1,0,1]=4 1215 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,1,1,0,0,0|1,0,1]=4 1216 B9R0.53 C\C(=C\C(C)C)\OC(C)=O Amb24667150 [0,1,1,0,0,0|1,0,1]=4 1217 B9R0.53 C\C(\N)=C\C(=O)CC(C)O Amb25685573 [0,1,1,0,0,0|2,0,0]=4 1218 B9R0.53 C\C(\O)=C/C(=O)CC(C)C Amb25146560 [0,1,1,0,0,0|1,0,1]=4 1219 B9R0.53 C\C(\O)=C\C(=O)CC(C)C Amb25146659 [0,1,1,0,0,0|1,0,1]=4 1220 B9R0.53 C\C(\S)=C\C(=O)CC(C)C Amb24588773 [0,1,1,0,0,0|1,1,0]=4 1221 B9R0.58 CCCS(=O)(=O)NC(C)=O Amb25320333 [0,1,1,0,0,0|2,0,0]=4 1222 B9R0.1 C#CC(F)CCCC(O)=O Amb25340465 [0,1,1,0,0,0|1,0,1]=4 1223 B9R0.1 C#C[C@H](F)CCCC(O)=O Amb25113496 [0,1,1,0,0,0|1,0,1]=4 1224 B9R0.1 C=CC(O)CCCC(O)=O Amb25137244 [0,1,1,0,0,0|1,0,0]=3 1225 B9R0.1 C=CC(O)CSCC(O)=O Amb25092349 [0,1,1,0,0,0|2,0,0]=4 1226 B9R0.1 C=C[C@@H](O)CCCC(O)=O Amb24352126 [0,1,1,0,0,0|1,0,0]=3 1227 B9R0.1 C=C[C@H](O)CSCC(O)=O Amb24482220 [0,1,1,0,0,0|2,0,0]=4 1228 B9R0.1 CC(=O)CCCC(Cl)C=O Amb24653770 [0,1,1,0,0,0|1,0,0]=3 1229 B9R0.1 CC(=O)CCCN(C)C=O Amb24631603 [0,1,1,0,0,0|2,0,0]=4 1230 B9R0.1 CC(=O)CCC[C@H](Cl)C=O Amb25101587 [0,1,1,0,0,0|1,0,0]=3 1231 B9R0.1 CC(=O)OCCC(Br)C=O Amb25293178 [0,1,1,0,0,0|2,0,0]=4 1232 B9R0.1 CC(C=C)NCCC(O)=O Amb24662882 [0,1,1,0,0,0|2,0,0]=4 1233 B9R0.1 CC(C=C)SCCC(O)=O Amb18182545 [0,1,1,0,0,0|2,0,0]=4 1234 B9R0.1 CC(CCCC(C)=C)C=O Amb25712471 [0,1,1,0,0,0|2,0,0]=4 1235 B9R0.1 CC(CCCC(C)=O)C=O Amb24453385 [0,1,1,0,0,0|1,0,0]=3 1236 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,1,1,0,0,0|1,0,1]=4 1237 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,1,1,0,0,0|1,0,0]=3 1238 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,1,1,0,0,0|0,0,2]=4 1239 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,1,1,0,0,0|1,0,1]=4 1240 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,1,1,0,0,0|1,0,1]=4 1241 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,1,1,0,0,0|1,0,1]=4 1242 B9R0.1 CN(CCCC(O)=O)C=O Amb19010086 [0,1,1,0,0,0|1,0,0]=3 1243 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,1,1,0,0,0|2,0,0]=4 1244 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,1,1,0,0,0|2,0,0]=4 1245 B9R0.1 C[C@@H](CCCC(C)=O)C=C Amb24379305 [0,1,1,0,0,0|2,0,0]=4 1246 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,1,1,0,0,0|1,0,0]=3 1247 B9R0.1 C[C@H](CCCC(C)=O)C=O Amb25119261 [0,1,1,0,0,0|1,0,0]=3 1248 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,1,1,0,0,0|1,0,0]=3 1249 B9R0.1 C\C(\CCCC(O)=O)=C\C Amb25063828 [0,1,1,0,0,0|1,0,1]=4 1250 B9R0.1 NC(CCCC(O)=O)C=O Amb25075707 [0,1,1,0,0,0|0,0,0]=2 1251 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,1,1,0,0,0|0,1,1]=4 1252 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,1,1,0,0,0|1,0,1]=4 1253 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,1,1,0,0,0|1,0,1]=4 1254 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,1,1,0,0,0|0,1,1]=4 1255 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,1,1,0,0,0|0,1,1]=4 1256 B9R0.1 O=NN(CCCC(=O)O)C Amb17618588 [0,1,1,0,0,0|2,0,0]=4 1257 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,1,1,0,0,0|1,0,1]=4 1258 B9R0.1 OC(=O)CCCN(O)C=O Amb25320259 [0,1,1,0,0,0|1,0,0]=3 1259 B9R0.1 OC(=O)CNCC(S)C=O Amb24482295 [0,1,1,0,0,0|1,0,0]=3 1260 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [0,1,1,0,0,0|1,0,1]=4 1261 B9R0.2 C#CCCCCCC(O)=O Amb22232010 [0,1,1,0,0,0|1,0,1]=4 1262 B9R0.2 C#CCCCNCC(O)=O Amb25284826 [0,1,1,0,0,0|1,0,1]=4 1263 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [0,1,1,0,0,0|1,0,1]=4 1264 B9R0.2 C=CCCCC#CC(O)=O Amb25770578 [0,1,1,0,0,0|1,0,1]=4 1265 B9R0.2 C=CCCCCCC(N)=O Amb25113258 [0,1,1,0,0,0|2,0,0]=4 1266 B9R0.2 C=CCCCCNC(N)=O Amb25309766 [0,1,1,0,0,0|2,0,0]=4 1267 B9R0.2 C=CCCCCOC(=O)C Amb10842183 [0,1,1,0,0,0|2,0,0]=4 1268 B9R0.2 C=CCCCOCC(N)=O Amb25825853 [0,1,1,0,0,0|2,0,0]=4 1269 B9R0.2 C=CCCNCCC(N)=O Amb25672230 [0,1,1,0,0,0|2,0,0]=4 1270 B9R0.2 C=CCC\C=C\CC(O)=O Amb18643551 [0,1,1,0,0,0|1,0,1]=4 1271 B9R0.2 C=CCNCCCC(N)=O Amb25224261 [0,1,1,0,0,0|2,0,0]=4 1272 B9R0.2 C=CC\C=C\CCC(O)=O Amb18643540 [0,1,1,0,0,0|1,0,1]=4 1273 B9R0.2 C=C\C=C\CCCC(O)=O Amb25085778 [0,1,1,0,0,0|1,0,1]=4 1274 B9R0.2 C=NCCCCCC(O)=O Amb25111950 [0,1,1,0,0,0|1,0,1]=4 1275 B9R0.2 CC(=C)CCOCCC=O Amb24354701 [0,1,1,0,0,0|2,0,0]=4 1276 B9R0.2 CC(=O)CCCC#CC=O Amb24480487 [0,1,1,0,0,0|1,0,1]=4 1277 B9R0.2 CC(=O)CCCCC=C=C Amb25296928 [0,1,1,0,0,0|2,0,0]=4 1278 B9R0.2 CC(=O)CCCCCC=C Amb24117120 [0,1,1,0,0,0|2,0,0]=4 1279 B9R0.2 CC(=O)CCCCCC=O Amb25290329 [0,1,1,0,0,0|1,0,0]=3 1280 B9R0.2 CC(=O)CCCC\C=C\Cl Amb24380821 [0,1,1,0,0,0|2,0,0]=4 1281 B9R0.2 CC(=O)CCC\C=C\C=O Amb18124580 [0,1,1,0,0,0|1,0,1]=4 1282 B9R0.2 CC(=O)CNCCCC=O Amb24664343 [0,1,1,0,0,0|1,0,0]=3 1283 B9R0.2 CC(=O)CSCCCC=C Amb25256553 [0,1,1,0,0,0|2,0,0]=4 1284 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [0,1,1,0,0,0|1,0,0]=3 1285 B9R0.2 CC(=O)NCCCOC=O Amb25340400 [0,1,1,0,0,0|2,0,0]=4 1286 B9R0.2 CC(=O)\C=C\CCCC=O Amb24476998 [0,1,1,0,0,0|1,0,1]=4 1287 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [0,1,1,0,0,0|2,0,0]=4 1288 B9R0.2 CC(O)CCCCCC=O Amb24611207 [0,1,1,0,0,0|1,0,1]=4 1289 B9R0.2 CCCCCCCC(O)=O Amb22352272 [0,1,1,0,0,0|1,0,1]=4 1290 B9R0.2 CCCCCCCC(O)=O Amb22353407 [0,1,1,0,0,0|1,0,1]=4 1291 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [0,1,1,0,0,0|1,0,1]=4 1292 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [0,1,1,0,0,0|1,0,1]=4 1293 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [0,1,1,0,0,0|1,0,1]=4 1294 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,1,1,0,0,0|1,0,1]=4 1295 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [0,1,1,0,0,0|1,0,1]=4 1296 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,1,1,0,0,0|1,0,1]=4 1297 B9R0.2 CCNCCCCC(O)=O Amb24385094 [0,1,1,0,0,0|1,0,1]=4 1298 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [0,1,1,0,0,0|1,0,1]=4 1299 B9R0.2 CNCCCCCC(O)=O Amb25704769 [0,1,1,0,0,0|1,0,1]=4 1300 B9R0.2 CNCCCNCC(O)=O Amb25292252 [0,1,1,0,0,0|2,0,0]=4 1301 B9R0.2 CNCCOCCC(O)=O Amb18111840 [0,1,1,0,0,0|2,0,0]=4 1302 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,1,1,0,0,0|0,0,2]=4 1303 B9R0.2 COCCCOCC(O)=O Amb25304314 [0,1,1,0,0,0|2,0,0]=4 1304 B9R0.2 COCCCSCC(O)=O Amb18798347 [0,1,1,0,0,0|2,0,0]=4 1305 B9R0.2 CONCCCCC(O)=O Amb25694999 [0,1,1,0,0,0|1,0,1]=4 1306 B9R0.2 CO\C=C\CCCC(O)=O Amb25083414 [0,1,1,0,0,0|0,0,2]=4 1307 B9R0.2 CSCCNCCC(O)=O Amb25055507 [0,1,1,0,0,0|2,0,0]=4 1308 B9R0.2 CSCCOCCC(O)=O Amb25173504 [0,1,1,0,0,0|2,0,0]=4 1309 B9R0.2 CSCCSCCC(O)=O Amb25798868 [0,1,1,0,0,0|2,0,0]=4 1310 B9R0.2 CSSCCCCC(O)=O Amb24429106 [0,1,1,0,0,0|1,1,0]=4 1311 B9R0.2 CS\C=C\CCCC(O)=O Amb25848561 [0,1,1,0,0,0|0,1,1]=4 1312 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [0,1,1,0,0,0|1,0,1]=4 1313 B9R0.2 C\C=C/CCCCC(C)=O Amb25129045 [0,1,1,0,0,0|2,0,0]=4 1314 B9R0.2 C\C=C/COCCC(O)=O Amb24377336 [0,1,1,0,0,0|1,0,1]=4 1315 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [0,1,1,0,0,0|2,0,0]=4 1316 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [0,1,1,0,0,0|1,0,0]=3 1317 B9R0.2 C\C=C\COCCC(O)=O Amb24478110 [0,1,1,0,0,0|1,0,1]=4 1318 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [0,1,1,0,0,0|1,0,1]=4 1319 B9R0.2 N#CCCCCCC(O)=O Amb18643705 [0,1,1,0,0,0|1,0,1]=4 1320 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,1,1,0,0,0|1,0,1]=4 1321 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [0,1,1,0,0,0|1,0,1]=4 1322 B9R0.2 N#CCCOCCC(O)=O Amb24409319 [0,1,1,0,0,0|1,0,1]=4 1323 B9R0.2 N#CCCSCCC(O)=O Amb18927741 [0,1,1,0,0,0|1,0,1]=4 1324 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [0,1,1,0,0,0|1,0,1]=4 1325 B9R0.2 N#C\C=C\CCCC(O)=O Amb25343311 [0,1,1,0,0,0|1,0,1]=4 1326 B9R0.2 NC(=O)CCCCC=NO Amb24624690 [0,1,1,0,0,0|1,0,1]=4 1327 B9R0.2 NC(=O)CCCC\C=C\Br Amb24760295 [0,1,1,0,0,0|2,0,0]=4 1328 B9R0.2 NC(=O)CCCC\C=C\Cl Amb24523165 [0,1,1,0,0,0|2,0,0]=4 1329 B9R0.2 NC(=O)COCCNC=O Amb25192208 [0,1,1,0,0,0|2,0,0]=4 1330 B9R0.2 NC(=O)NCCCCN=O Amb22231336 [0,1,1,0,0,0|2,0,0]=4 1331 B9R0.2 NC(=S)CCCCNC=O Amb25280595 [0,1,1,0,0,0|1,1,0]=4 1332 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,1,1,0,0,0|1,0,1]=4 1333 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,1,1,0,0,0|1,0,1]=4 1334 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,1,1,0,0,0|1,0,1]=4 1335 B9R0.2 NCCCOCCC(O)=O Amb18111494 [0,1,1,0,0,0|1,0,1]=4 1336 B9R0.2 NCCCSCCC(O)=O Amb24496605 [0,1,1,0,0,0|1,0,1]=4 1337 B9R0.2 NCCOCCCC(O)=O Amb18111467 [0,1,1,0,0,0|1,0,1]=4 1338 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,1,1,0,0,0|1,0,1]=4 1339 B9R0.2 NOCCCCCC(=O)O Amb10975958 [0,1,1,0,0,0|0,0,2]=4 1340 B9R0.2 O=C=NCCCCC(=O)Cl Amb25695423 [0,1,1,0,0,0|1,0,1]=4 1341 B9R0.2 OC(=O)CCCCC#CBr Amb25758884 [0,1,1,0,0,0|1,0,1]=4 1342 B9R0.2 OC(=O)CCCCCCF Amb25132501 [0,1,1,0,0,0|1,0,1]=4 1343 B9R0.2 OC(=O)CCCCCCS Amb24710334 [0,1,1,0,0,0|0,1,1]=4 1344 B9R0.2 OC(=O)CCCCN=C=O Amb24505309 [0,1,1,0,0,0|0,0,1]=3 1345 B9R0.2 OC(=O)CCCCN=C=S Amb25685363 [0,1,1,0,0,0|0,1,1]=4 1346 B9R0.2 OC(=O)CCCNCCF Amb25312142 [0,1,1,0,0,0|1,0,1]=4 1347 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [0,1,1,0,0,0|1,0,1]=4 1348 B9R0.2 OC(=O)CCOCCCF Amb25794478 [0,1,1,0,0,0|1,0,1]=4 1349 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [0,1,1,0,0,0|1,0,1]=4 1350 B9R0.2 OC(=O)CNCCCCF Amb24588093 [0,1,1,0,0,0|1,0,1]=4 1351 B9R0.2 OC(=O)C\C=C/CCC=O Amb24480684 [0,1,1,0,0,0|0,0,1]=3 1352 B9R0.2 OC(=O)C\C=C\CCC=O Amb18643818 [0,1,1,0,0,0|0,0,1]=3 1353 B9R0.2 OC(=O)\C=C\CCCC=O Amb25253849 [0,1,1,0,0,0|0,0,1]=3 1354 B9R0.2 OCCCCSCC(O)=O Amb18798269 [0,1,1,0,0,0|0,0,2]=4 1355 B9R0.2 OCCCOCCC(O)=O Amb24476864 [0,1,1,0,0,0|0,0,2]=4 1356 B9R0.2 OC\C=C\CCCC(O)=O Amb24568323 [0,1,1,0,0,0|0,0,2]=4 1357 B9R0.2 ON=CCCCCC(O)=O Amb24480769 [0,1,1,0,0,0|0,0,1]=3 1358 B9R0.2 ONCCCCCC(O)=O Amb25354224 [0,1,1,0,0,0|0,0,2]=4 1359 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [0,1,1,0,0,0|1,0,1]=4 1360 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [0,1,1,0,0,0|1,0,1]=4 1361 B9R0.2 [N-]=[N+]=NCCCCC(O)=O Amb19516609 [0,1,1,0,0,0|2,0,0]=4 1362 B9R0.38 CS(=O)(=O)CCCCC=O Amb24447263 [0,1,1,0,0,0|1,0,1]=4 1363 B9R0.38 OP(O)(=O)CCCCC=O Amb25100269 [0,1,1,0,0,0|1,0,0]=3 1364 B9R0.46 C=CC(=C)CCCCC=O Amb24364446 [0,1,1,0,0,0|2,0,0]=4 1365 B9R0.46 C=CCCCCC(=C)CO Amb25788970 [0,1,1,0,0,0|2,0,0]=4 1366 B9R0.46 C=CCCCCC(=O)C=C Amb25373427 [0,1,1,0,0,0|2,0,0]=4 1367 B9R0.46 C=CCCCCC(=O)CBr Amb25187234 [0,1,1,0,0,0|2,0,0]=4 1368 B9R0.46 C=CCCCCC(=O)CCl Amb24480553 [0,1,1,0,0,0|2,0,0]=4 1369 B9R0.46 C=CCCCCC(=O)CO Amb24708283 [0,1,1,0,0,0|1,0,0]=3 1370 B9R0.46 C=CCCCCC(=O)NN Amb24479057 [0,1,1,0,0,0|2,0,0]=4 1371 B9R0.46 C=CCCCNC(=O)CO Amb25699293 [0,1,1,0,0,0|2,0,0]=4 1372 B9R0.46 CCC(=O)CCCCC=O Amb25243006 [0,1,1,0,0,0|1,0,0]=3 1373 B9R0.46 CCC(=O)OCCCC=O Amb25270047 [0,1,1,0,0,0|2,0,0]=4 1374 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,1,1,0,0,0|1,0,1]=4 1375 B9R0.46 CN(CCCCC=O)C=O Amb24722873 [0,1,1,0,0,0|2,0,0]=4 1376 B9R0.46 CNC(=O)CCCCC=C Amb25368070 [0,1,1,0,0,0|2,0,0]=4 1377 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [0,1,1,0,0,0|1,0,0]=3 1378 B9R0.46 CNC(=O)CCSCC=O Amb24657588 [0,1,1,0,0,0|2,0,0]=4 1379 B9R0.46 CNCCCCC(=O)OC Amb25725637 [0,1,1,0,0,0|2,0,0]=4 1380 B9R0.46 COC(=O)CCCCC#C Amb18636156 [0,1,1,0,0,0|1,0,1]=4 1381 B9R0.46 COC(=O)CCCCC#N Amb18643702 [0,1,1,0,0,0|1,0,1]=4 1382 B9R0.46 COC(=O)CCCCCCl Amb25703167 [0,1,1,0,0,0|1,0,1]=4 1383 B9R0.46 COC(=O)CCCCCI Amb24429888 [0,1,1,0,0,0|1,0,1]=4 1384 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,1,1,0,0,0|0,0,2]=4 1385 B9R0.46 COC(=O)CCCC[Zn]Br Amb22898092 [0,1,1,0,0,0|2,0,0]=4 1386 B9R0.46 COC(=O)CCSCC=O Amb18183492 [0,1,1,0,0,0|1,0,0]=3 1387 B9R0.46 COC(=O)CC\C=C/C=O Amb24536495 [0,1,1,0,0,0|0,0,2]=4 1388 B9R0.46 COC(=O)CC\C=C\C=O Amb18643849 [0,1,1,0,0,0|0,0,2]=4 1389 B9R0.46 COC(=O)CSCCC=C Amb25143714 [0,1,1,0,0,0|2,0,0]=4 1390 B9R0.46 COC(=O)CSCCC=O Amb18788129 [0,1,1,0,0,0|1,0,0]=3 1391 B9R0.46 COC(=O)\C=C/CCC=O Amb25857445 [0,1,1,0,0,0|0,0,2]=4 1392 B9R0.46 COC(=O)\C=C\CCC=O Amb18643851 [0,1,1,0,0,0|0,0,2]=4 1393 B9R0.46 COCCCCC(=O)NO Amb24431421 [0,1,1,0,0,0|2,0,0]=4 1394 B9R0.46 COCCCCC(=O)OC Amb25136902 [0,1,1,0,0,0|2,0,0]=4 1395 B9R0.46 C\C=C(/C)\CCCCC=O Amb25101803 [0,1,1,0,0,0|2,0,0]=4 1396 B9R0.46 C\C=C(\C)/CCCCC=O Amb25366484 [0,1,1,0,0,0|2,0,0]=4 1397 B9R0.46 C\C=C\CCCC(=O)OC Amb24356360 [0,1,1,0,0,0|1,0,1]=4 1398 B9R0.46 NCCCCCC(=O)NO Amb25146421 [0,1,1,0,0,0|1,0,1]=4 1399 B9R0.46 NCCCCCC(=O)OC Amb1152885 [0,1,1,0,0,0|1,0,1]=4 1400 B9R0.46 NCCCCCC(=O)OC Amb16203805 [0,1,1,0,0,0|1,0,1]=4 1401 B9R0.46 NCCCCCC(=O)OC Amb1935045 [0,1,1,0,0,0|1,0,1]=4 1402 B9R0.46 O=CCCCCC(=O)OC Amb16233585 [0,1,1,0,0,0|0,0,0]=2 1403 B9R0.46 ONC(=O)CCCCC=O Amb24382910 [0,1,1,0,0,0|0,0,0]=2 1404 B9R0.47 C#CCCCC(O)C(O)=O Amb25221599 [0,1,1,0,0,0|1,0,1]=4 1405 B9R0.47 C#CCCC[C@@H](N)C(O)=O Amb24077358 [0,1,1,0,0,0|1,0,1]=4 1406 B9R0.47 C#CCCC[C@H](N)C(O)=O Amb24088878 [0,1,1,0,0,0|1,0,1]=4 1407 B9R0.47 C=C(CCCC=C)C(O)=O Amb24585641 [0,1,1,0,0,0|1,0,1]=4 1408 B9R0.47 C=CCCCC(=O)C(O)=O Amb24459619 [0,1,1,0,0,0|1,0,1]=4 1409 B9R0.47 C=CCCCC(Cl)C(=O)Cl Amb24509720 [0,1,1,0,0,0|2,0,0]=4 1410 B9R0.47 C=CCCCC(Cl)C(O)=O Amb18645742 [0,1,1,0,0,0|1,0,0]=3 1411 B9R0.47 C=CCCCC(N)C(O)=O Amb22002149 [0,1,1,0,0,0|1,0,0]=3 1412 B9R0.47 C=CCCC[C@@H](N)C(N)=O Amb25824644 [0,1,1,0,0,0|2,0,0]=4 1413 B9R0.47 C=CCCC[C@@H](N)C(O)=O Amb22831130 [0,1,1,0,0,0|1,0,0]=3 1414 B9R0.47 C=CCCC[C@@H](O)C(O)=O Amb24714998 [0,1,1,0,0,0|1,0,0]=3 1415 B9R0.47 C=CCCC[C@H](O)C(O)=O Amb24763769 [0,1,1,0,0,0|1,0,0]=3 1416 B9R0.47 C=CCCOC(F)C(O)=O Amb25683023 [0,1,1,0,0,0|2,0,0]=4 1417 B9R0.47 C=CCNCC(O)C(O)=O Amb25344930 [0,1,1,0,0,0|2,0,0]=4 1418 B9R0.47 C=CCOCC(Cl)C(O)=O Amb24589021 [0,1,1,0,0,0|2,0,0]=4 1419 B9R0.47 C=CCOCC(O)C(O)=O Amb24655623 [0,1,1,0,0,0|2,0,0]=4 1420 B9R0.47 C=CCOC[C@H](N)C(O)=O Amb24713287 [0,1,1,0,0,0|2,0,0]=4 1421 B9R0.47 C=CCSC[C@@H](N)C(O)=O Amb22745979 [0,1,1,0,0,0|2,0,0]=4 1422 B9R0.47 C=CCSC[C@H](N)C(O)=O Amb22231426 [0,1,1,0,0,0|2,0,0]=4 1423 B9R0.47 C=CCSC[C@H](N)C(O)=O Amb22231427 [0,1,1,0,0,0|2,0,0]=4 1424 B9R0.47 CC(=O)C(O)CCCC=C Amb24577858 [0,1,1,0,0,0|2,0,0]=4 1425 B9R0.47 CC(CCCC#C)C(O)=O Amb25824201 [0,1,1,0,0,0|1,0,1]=4 1426 B9R0.47 CC(CCCC=C)C(O)=O Amb18643893 [0,1,1,0,0,0|1,0,0]=3 1427 B9R0.47 CC(CCCC=O)C(=O)Cl Amb24448943 [0,1,1,0,0,0|1,0,0]=3 1428 B9R0.47 CC(CCCC=O)C(C)=O Amb24478226 [0,1,1,0,0,0|1,0,0]=3 1429 B9R0.47 CC(CCCCF)C(O)=O Amb24370978 [0,1,1,0,0,0|1,0,1]=4 1430 B9R0.47 CC(CCCCN)C(O)=O Amb18644200 [0,1,1,0,0,0|1,0,1]=4 1431 B9R0.47 CC(CCOC=O)C(O)=O Amb18644245 [0,1,1,0,0,0|1,0,0]=3 1432 B9R0.47 CC(NCCC=C)C(O)=O Amb25309133 [0,1,1,0,0,0|2,0,0]=4 1433 B9R0.47 CC(O)C(O)CCCC=O Amb24598279 [0,1,1,0,0,0|1,0,1]=4 1434 B9R0.47 CCCCCC(Br)C(O)=O Amb18130346 [0,1,1,0,0,0|1,0,1]=4 1435 B9R0.47 CCCCCC(C(=O)O)F Amb17593693 [0,1,1,0,0,0|1,0,1]=4 1436 B9R0.47 CCCCCC(Cl)C(O)=O Amb18646187 [0,1,1,0,0,0|1,0,1]=4 1437 B9R0.47 CCCCCC(O)C(O)=O Amb17778103 [0,1,1,0,0,0|1,0,1]=4 1438 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [0,1,1,0,0,0|1,0,1]=4 1439 B9R0.47 CCCCC[C@@H](N)C(O)=O Amb22745982 [0,1,1,0,0,0|1,0,1]=4 1440 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [0,1,1,0,0,0|1,0,1]=4 1441 B9R0.47 CCCCC[C@H](N)C(O)=O Amb17943098 [0,1,1,0,0,0|1,0,1]=4 1442 B9R0.47 CCCCC[C@H](O)C(O)=O Amb25728353 [0,1,1,0,0,0|1,0,1]=4 1443 B9R0.47 CNCCCC(C)C(O)=O Amb25313872 [0,1,1,0,0,0|2,0,0]=4 1444 B9R0.47 CNCCCC(N)C(O)=O Amb18644279 [0,1,1,0,0,0|2,0,0]=4 1445 B9R0.47 CNCCC[C@H](N)C(O)=O Amb24377155 [0,1,1,0,0,0|2,0,0]=4 1446 B9R0.47 COCCCC(N)C(O)=O Amb20628315 [0,1,1,0,0,0|2,0,0]=4 1447 B9R0.47 COCCCC(N)C(O)=O Amb22058809 [0,1,1,0,0,0|2,0,0]=4 1448 B9R0.47 COCCC[C@@H](N)C(O)=O Amb25081508 [0,1,1,0,0,0|2,0,0]=4 1449 B9R0.47 COCCC[C@H](N)C(O)=O Amb25378737 [0,1,1,0,0,0|2,0,0]=4 1450 B9R0.47 CSCCCC(C(=O)O)N Amb17594057 [0,1,1,0,0,0|2,0,0]=4 1451 B9R0.47 CSCCCC(O)C(O)=O Amb25169340 [0,1,1,0,0,0|2,0,0]=4 1452 B9R0.47 C[C@@H](NCCC=C)C(O)=O Amb25702627 [0,1,1,0,0,0|2,0,0]=4 1453 B9R0.47 N#CCCCC(C(=O)O)Cl Amb17594023 [0,1,1,0,0,0|1,0,1]=4 1454 B9R0.47 NC(CCCC#N)C(O)=O Amb25242567 [0,1,1,0,0,0|1,0,1]=4 1455 B9R0.47 NC(CCCCCl)C(O)=O Amb25141944 [0,1,1,0,0,0|1,0,1]=4 1456 B9R0.47 NC(CCCCS)C(O)=O Amb25363159 [0,1,1,0,0,0|0,1,1]=4 1457 B9R0.47 NC(CCCNO)C(O)=O Amb24722710 [0,1,1,0,0,0|1,0,1]=4 1458 B9R0.47 NC(CCC[13CH2][15NH2])C(O)=O Amb22351283 [0,1,1,0,0,0|1,0,1]=4 1459 B9R0.47 NC(CCNC=O)C(O)=O Amb24355941 [0,1,1,0,0,0|1,0,0]=3 1460 B9R0.47 NCCCCC(Cl)C(O)=O Amb24540314 [0,1,1,0,0,0|1,0,1]=4 1461 B9R0.47 NCCCCC(F)C(O)=O Amb25147460 [0,1,1,0,0,0|1,0,1]=4 1462 B9R0.47 NCCCCC(N)C(O)=O Amb22349470 [0,1,1,0,0,0|1,0,1]=4 1463 B9R0.47 NCCCCC(N)C(O)=O Amb22489521 [0,1,1,0,0,0|1,0,1]=4 1464 B9R0.47 NCCCCC(N)[13C](O)=O Amb22338743 [0,1,1,0,0,0|1,0,1]=4 1465 B9R0.47 NCCCCC(O)C(O)=O Amb18644320 [0,1,1,0,0,0|1,0,1]=4 1466 B9R0.47 NCCCCC(S)C(O)=O Amb24652524 [0,1,1,0,0,0|1,0,1]=4 1467 B9R0.47 NCCCCC([15NH2])C(O)=O Amb22351358 [0,1,1,0,0,0|1,0,1]=4 1468 B9R0.47 NCCCC[13CH](N)C(O)=O Amb22351886 [0,1,1,0,0,0|1,0,1]=4 1469 B9R0.47 NCCCC[13CH](N)[13C](O)=O Amb22336528 [0,1,1,0,0,0|1,0,1]=4 1470 B9R0.47 NCCCC[C@@H](C(=O)O)C Amb10844513 [0,1,1,0,0,0|1,0,1]=4 1471 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22744766 [0,1,1,0,0,0|1,0,1]=4 1472 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22746247 [0,1,1,0,0,0|1,0,1]=4 1473 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22750565 [0,1,1,0,0,0|1,0,1]=4 1474 B9R0.47 NCCCC[C@H](C(=O)O)N Amb10072417 [0,1,1,0,0,0|1,0,1]=4 1475 B9R0.47 NCCCC[C@H](O)C(O)=O Amb25303562 [0,1,1,0,0,0|1,0,1]=4 1476 B9R0.47 NCCCC[C@H]([15NH2])C(O)=O Amb22354049 [0,1,1,0,0,0|1,0,1]=4 1477 B9R0.47 NNCCCC(N)C(O)=O Amb24378076 [0,1,1,0,0,0|2,0,0]=4 1478 B9R0.47 NNCCC[C@H](N)C(O)=O Amb24623157 [0,1,1,0,0,0|2,0,0]=4 1479 B9R0.47 NOCCCC(N)C(O)=O Amb24117962 [0,1,1,0,0,0|2,0,0]=4 1480 B9R0.47 N[13CH2]CCCC(N)C(O)=O Amb22367560 [0,1,1,0,0,0|1,0,1]=4 1481 B9R0.47 N[13CH2][13CH2][13CH2][13CH2][13C@H](N)[13C](O)=O Amb22337497 [0,1,1,0,0,0|1,0,1]=4 1482 B9R0.47 N[14CH2][14CH2][14CH2][14CH2][14CH](N)[14C](O)=O Amb22349598 [0,1,1,0,0,0|1,0,1]=4 1483 B9R0.47 N[C@@H](C(=O)O)CSCC=C Amb10843878 [0,1,1,0,0,0|2,0,0]=4 1484 B9R0.47 N[C@@H](CCCCO)C(O)=O Amb22900800 [0,1,1,0,0,0|0,0,2]=4 1485 B9R0.47 N[C@@H](CCCCS)C(O)=O Amb25729289 [0,1,1,0,0,0|0,1,1]=4 1486 B9R0.47 N[C@@H](CCCC[NH3+])C(O)=O Amb22801419 [0,1,1,0,0,0|1,0,1]=4 1487 B9R0.47 N[C@@H](CCCNO)C(O)=O Amb25075377 [0,1,1,0,0,0|1,0,1]=4 1488 B9R0.47 N[C@@H](CCNC=O)C(O)=O Amb24692356 [0,1,1,0,0,0|1,0,0]=3 1489 B9R0.47 N[C@@H](CCSN=O)C(O)=O Amb24665147 [0,1,1,0,0,0|2,0,0]=4 1490 B9R0.47 O=CCCCC(C(=O)O)N Amb17619026 [0,1,1,0,0,0|0,0,0]=2 1491 B9R0.47 OC(=O)C(=O)CCCC=O Amb25789953 [0,1,1,0,0,0|0,0,1]=3 1492 B9R0.47 OC(=O)C(Br)CCCCBr Amb21964537 [0,1,1,0,0,0|1,0,1]=4 1493 B9R0.47 OC(=O)C(Cl)CCCCCl Amb24442431 [0,1,1,0,0,0|1,0,1]=4 1494 B9R0.47 OC(=O)C(F)CCCCF Amb24482414 [0,1,1,0,0,0|1,0,1]=4 1495 B9R0.47 OC(CCNC=O)C(O)=O Amb24480985 [0,1,1,0,0,0|1,0,0]=3 1496 B9R0.47 OCCCCC(O)C(O)=O Amb18644356 [0,1,1,0,0,0|0,0,2]=4 1497 B9R0.47 OCCCC[C@H](O)C(O)=O Amb24480682 [0,1,1,0,0,0|0,0,2]=4 1498 B9R0.47 O[C@@H](CCNC=O)C(O)=O Amb24481075 [0,1,1,0,0,0|1,0,0]=3 1499 B9R0.47 [15NH2]CCCCC([15NH2])C(O)=O Amb22363194 [0,1,1,0,0,0|1,0,1]=4 1500 B9R0.47 [15NH2]CCCC[C@H]([15NH2])C(O)=O Amb22353587 [0,1,1,0,0,0|1,0,1]=4 1501 B9R0.55 C=C(Cl)CCCCC(N)=O Amb24358043 [0,1,1,0,0,0|2,0,0]=4 1502 B9R0.55 CC(=C)CCCCC(N)=O Amb24695037 [0,1,1,0,0,0|2,0,0]=4 1503 B9R0.55 CC(=C)CCOCC(O)=O Amb18644114 [0,1,1,0,0,0|2,0,0]=4 1504 B9R0.55 CC(=O)CCCC=C(C)O Amb24627452 [0,1,1,0,0,0|1,0,1]=4 1505 B9R0.55 CC(=O)CCCCC(=O)C Amb17593600 [0,1,1,0,0,0|1,0,0]=3 1506 B9R0.55 CC(=O)CCCCC(C)=C Amb24553457 [0,1,1,0,0,0|2,0,0]=4 1507 B9R0.55 CC(=O)CCCCC(N)=O Amb24505160 [0,1,1,0,0,0|1,0,0]=3 1508 B9R0.55 CC(=O)CCCNC(N)=O Amb24333544 [0,1,1,0,0,0|2,0,0]=4 1509 B9R0.55 CC(=O)CCCOC(=O)C Amb1033031 [0,1,1,0,0,0|2,0,0]=4 1510 B9R0.55 CC(=O)CCCOC(=O)Cl Amb25146796 [0,1,1,0,0,0|2,0,0]=4 1511 B9R0.55 CC(=O)CCCSC(C)=O Amb24662493 [0,1,1,0,0,0|2,0,0]=4 1512 B9R0.55 CC(=O)CCC\C=C(\C)/O Amb24546380 [0,1,1,0,0,0|1,0,1]=4 1513 B9R0.55 CC(=O)CCSCC(N)=O Amb24733496 [0,1,1,0,0,0|2,0,0]=4 1514 B9R0.55 CC(=O)CCSCC(O)=O Amb24443138 [0,1,1,0,0,0|1,0,0]=3 1515 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,1,1,0,0,0|0,0,2]=4 1516 B9R0.55 CC(=O)CSCCC(C)=O Amb24361719 [0,1,1,0,0,0|2,0,0]=4 1517 B9R0.55 CC(=O)OCCCC(=O)Cl Amb25174238 [0,1,1,0,0,0|2,0,0]=4 1518 B9R0.55 CC(=O)OCCCC(N)=O Amb25333292 [0,1,1,0,0,0|2,0,0]=4 1519 B9R0.55 CC(=O)OCCCC(O)=O Amb24480808 [0,1,1,0,0,0|1,0,0]=3 1520 B9R0.55 CC(Br)=CCCCC(O)=O Amb25289201 [0,1,1,0,0,0|1,0,1]=4 1521 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [0,1,1,0,0,0|1,0,1]=4 1522 B9R0.55 CC(C)=CCCCC(O)=O Amb18643939 [0,1,1,0,0,0|1,0,1]=4 1523 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [0,1,1,0,0,0|1,0,1]=4 1524 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [0,1,1,0,0,0|1,0,1]=4 1525 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [0,1,1,0,0,0|1,0,1]=4 1526 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [0,1,1,0,0,0|1,0,1]=4 1527 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [0,1,1,0,0,0|0,0,2]=4 1528 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [0,1,1,0,0,0|2,0,0]=4 1529 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [0,1,1,0,0,0|1,0,0]=3 1530 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [0,1,1,0,0,0|1,0,0]=3 1531 B9R0.55 CS(=O)CCNCC(O)=O Amb24396496 [0,1,1,0,0,0|2,0,0]=4 1532 B9R0.55 CS(=O)CCOCC(O)=O Amb24600087 [0,1,1,0,0,0|2,0,0]=4 1533 B9R0.55 CS(=O)NCCCC(O)=O Amb24753135 [0,1,1,0,0,0|2,0,0]=4 1534 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [0,1,1,0,0,0|1,0,1]=4 1535 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [0,1,1,0,0,0|0,0,2]=4 1536 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [0,1,1,0,0,0|1,0,1]=4 1537 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [0,1,1,0,0,0|0,0,2]=4 1538 B9R0.55 NC(=N)CCCCC(O)=O Amb25147486 [0,1,1,0,0,0|1,0,0]=3 1539 B9R0.55 NC(=N)CNCCC(O)=O Amb24394430 [0,1,1,0,0,0|2,0,0]=4 1540 B9R0.55 NC(=O)CCCNC(N)=O Amb24705966 [0,1,1,0,0,0|2,0,0]=4 1541 B9R0.55 NC(=O)CCCOP(O)=O Amb25078195 [0,1,1,0,0,0|2,0,0]=4 1542 B9R0.55 NC(=O)CCOCC(O)=O Amb25146949 [0,1,1,0,0,0|1,0,0]=3 1543 B9R0.55 NC(=O)COCCC(N)=O Amb25063003 [0,1,1,0,0,0|2,0,0]=4 1544 B9R0.55 NC(=O)\C=C\CCC(O)=O Amb25146295 [0,1,1,0,0,0|0,0,2]=4 1545 B9R0.55 OC(=O)CCC=CC(O)=O Amb20622952 [0,1,1,0,0,0|0,0,2]=4 1546 B9R0.55 OC(=O)CCCC=C(Cl)Cl Amb24441631 [0,1,1,0,0,0|1,0,1]=4 1547 B9R0.55 OC(=O)CCCCC(Cl)Cl Amb24482330 [0,1,1,0,0,0|1,0,1]=4 1548 B9R0.55 OC(=O)CCCCC(O)=O Amb22043229 [0,1,1,0,0,0|0,0,0]=2 1549 B9R0.55 OC(=O)CCCCC(O)=O Amb22167453 [0,1,1,0,0,0|0,0,0]=2 1550 B9R0.55 OC(=O)CCCCC(O)=O Amb22336279 [0,1,1,0,0,0|0,0,0]=2 1551 B9R0.55 OC(=O)CCCCC(O)=O Amb22338188 [0,1,1,0,0,0|0,0,0]=2 1552 B9R0.55 OC(=O)CCCCC(O)=O Amb22351345 [0,1,1,0,0,0|0,0,0]=2 1553 B9R0.55 OC(=O)CCCCC(O)=O Amb22351401 [0,1,1,0,0,0|0,0,0]=2 1554 B9R0.55 OC(=O)CCCCC(O)=O Amb22351452 [0,1,1,0,0,0|0,0,0]=2 1555 B9R0.55 OC(=O)CCCCC(O)=O Amb22351586 [0,1,1,0,0,0|0,0,0]=2 1556 B9R0.55 OC(=O)CCCCC(O)=O Amb22353360 [0,1,1,0,0,0|0,0,0]=2 1557 B9R0.55 OC(=O)CCCCC(O)=O Amb22363211 [0,1,1,0,0,0|0,0,0]=2 1558 B9R0.55 OC(=O)CCCNC(=O)N Amb1104859 [0,1,1,0,0,0|1,0,0]=3 1559 B9R0.55 OC(=O)CCCNC(S)=S Amb24482221 [0,1,1,0,0,0|1,1,0]=4 1560 B9R0.55 OC(=O)CC\C=C\C(O)=O Amb24117843 [0,1,1,0,0,0|0,0,2]=4 1561 B9R0.55 OC(=O)CNCCC(O)=O Amb18098292 [0,1,1,0,0,0|1,0,0]=3 1562 B9R0.55 OC(=O)CNCCS(=O)=O Amb25249489 [0,1,1,0,0,0|2,0,0]=4 1563 B9R0.55 OC(=O)CNNCC(O)=O Amb23438062 [0,1,1,0,0,0|2,0,0]=4 1564 B9R0.55 OC(=O)COCCC(O)=O Amb25046530 [0,1,1,0,0,0|1,0,0]=3 1565 B9R0.55 OC(=O)CSCCC(=O)O Amb17594067 [0,1,1,0,0,0|1,0,0]=3 1566 B9R0.55 OC(=O)CSCCC(=S)N Amb17503232 [0,1,1,0,0,0|1,1,0]=4 1567 B9R0.55 OC(=O)C\C=C/CC(O)=O Amb25132103 [0,1,1,0,0,0|0,0,2]=4 1568 B9R0.55 O[13C](=O)CCCC[13C](O)=O Amb22338172 [0,1,1,0,0,0|0,0,0]=2 1569 B9R0.55 [O-]C(=O)CCCCC(O)=O Amb21934396 [0,1,1,0,0,0|0,0,0]=2 1570 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22168121 [0,1,1,0,0,0|0,0,1]=3 1571 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22230380 [0,1,1,0,0,0|0,0,1]=3 1572 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22732848 [0,1,1,0,0,0|0,0,1]=3 1573 B9R0.55 [O-][N+](=O)CCCCC(O)=O Amb24596293 [0,1,1,0,0,0|1,0,0]=3 1574 B9R0.26 CCC(=O)CC(CC)=CC Amb24721699 [0,1,1,0,0,0|2,0,0]=4 1575 B9R0.26 CCC(=O)CC(CC)C=O Amb24381498 [0,1,1,0,0,0|1,0,1]=4 1576 B9R0.26 CCC(=O)OC(CC)C#C Amb24404075 [0,1,1,0,0,0|1,0,1]=4 1577 B9R0.26 CCC(=O)OC(CC)C#N Amb24482949 [0,1,1,0,0,0|1,0,1]=4 1578 B9R0.26 CCC(=O)OC(CC)C=C Amb24430616 [0,1,1,0,0,0|1,0,1]=4 1579 B9R0.26 CCC(=O)\C=C(\CC)/OC Amb24582482 [0,1,1,0,0,0|1,0,1]=4 1580 B9R0.26 CC\C(=C\C(=O)OC)\C=O Amb18643837 [0,1,1,0,0,0|2,0,0]=4 1581 B9R0.27 CC(C(=O)CC)=C(O)CC Amb25327909 [0,1,1,0,0,0|1,0,1]=4 1582 B9R0.27 CC(C(=O)CC)S(=O)CC Amb25806895 [0,1,1,0,0,0|2,0,0]=4 1583 B9R0.27 CCC(=C)C(C)C(=O)CC Amb24690483 [0,1,1,0,0,0|2,0,0]=4 1584 B9R0.27 CCC(=O)C(=O)C(=O)OC Amb25807589 [0,1,1,0,0,0|2,0,0]=4 1585 B9R0.27 CCC(=O)C(Br)C(=O)OC Amb25214433 [0,1,1,0,0,0|2,0,0]=4 1586 B9R0.27 CCC(=O)C(Cl)C(=O)CC Amb24079128 [0,1,1,0,0,0|1,0,0]=3 1587 B9R0.27 CCC(=O)C(Cl)C(=O)OC Amb18368799 [0,1,1,0,0,0|2,0,0]=4 1588 B9R0.27 CCC(=O)C(F)C(=O)CC Amb25146529 [0,1,1,0,0,0|1,0,0]=3 1589 B9R0.27 CCC(=O)C(N)C(=O)OC Amb18124723 [0,1,1,0,0,0|2,0,0]=4 1590 B9R0.27 CCC(=O)\C(\Cl)=C(/O)\CC Amb24629816 [0,1,1,0,0,0|1,0,1]=4 1591 B9R0.27 CCC(=O)\C(\F)=C(/O)\CC Amb24361687 [0,1,1,0,0,0|1,0,1]=4 1592 B9R0.27 C\C(\CC)=C(\C)/C(=O)CC Amb25767920 [0,1,1,0,0,0|2,0,0]=4 1593 B9R0.42 CC(=C)C(=O)OC(=O)NC Amb24479113 [0,1,1,0,0,0|1,0,1]=4 1594 B9R0.42 CC(=O)C(=O)CC(=O)CC Amb25110491 [0,1,1,0,0,0|1,0,1]=4 1595 B9R0.42 CC(=O)C(=O)OC(=O)CCl Amb25367326 [0,1,1,0,0,0|1,0,1]=4 1596 B9R0.42 CC(C)C(=O)OC(=C)CCl Amb24379549 [0,1,1,0,0,0|2,0,0]=4 1597 B9R0.42 CC(C)C(=O)OC(=O)CCl Amb24476229 [0,1,1,0,0,0|1,0,0]=3 1598 B9R0.42 CC(C)C(C)OC(=O)CC Amb25057592 [0,1,1,0,0,0|1,0,1]=4 1599 B9R0.42 CC(CC)=CC(=O)C(C)C Amb24570186 [0,1,1,0,0,0|2,0,0]=4 1600 B9R0.42 CC(CC)OC(=O)C(C)Br Amb18090827 [0,1,1,0,0,0|1,0,1]=4 1601 B9R0.42 CC(CC)OC(=O)C(C)N Amb19009631 [0,1,1,0,0,0|1,0,1]=4 1602 B9R0.42 CC(CC)OC(=O)C(C)O Amb24672514 [0,1,1,0,0,0|1,0,1]=4 1603 B9R0.42 CC(CC)OC(=O)C(C)S Amb25198141 [0,1,1,0,0,0|1,0,1]=4 1604 B9R0.42 CC(CC)OC(=O)[C@@H](C)O Amb25306882 [0,1,1,0,0,0|1,0,1]=4 1605 B9R0.42 CC(OC(=O)CC)C(C)O Amb25320390 [0,1,1,0,0,0|1,0,1]=4 1606 B9R0.42 CCC(=C)CC(=O)C(C)O Amb25283535 [0,1,1,0,0,0|2,0,0]=4 1607 B9R0.42 CCC(=O)CC(=O)N(C)C Amb25714362 [0,1,1,0,0,0|2,0,0]=4 1608 B9R0.42 CCC(=O)OC(=O)C(C)C Amb15692551 [0,1,1,0,0,0|0,0,0]=2 1609 B9R0.42 CCC(=S)CC(=O)C(C)C Amb25093728 [0,1,1,0,0,0|1,1,0]=4 1610 B9R0.42 CNC(=O)NC(=O)C(C)Br Amb25131354 [0,1,1,0,0,0|2,0,0]=4 1611 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,1,1,0,0,0|2,0,0]=4 1612 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,1,1,0,0,0|2,0,0]=4 1613 B9R0.42 COC(=O)NC(=O)C(C)Br Amb25365162 [0,1,1,0,0,0|2,0,0]=4 1614 B9R0.42 COC(=O)NC(=O)C(C)N Amb24459198 [0,1,1,0,0,0|2,0,0]=4 1615 B9R0.42 C\C(\CC)=C/C(=O)C(C)C Amb24502394 [0,1,1,0,0,0|2,0,0]=4 1616 B9R0.42 C\C(\CC)=C\C(=O)C(C)C Amb24478151 [0,1,1,0,0,0|2,0,0]=4 1617 B9R0.42 ClCC(=O)NC(=O)C(C)C Amb1107207 [0,1,1,0,0,0|2,0,0]=4 1618 B9R1.5 C=C1CCCCCC1=O Amb24706942 [1,1,0,0,0,0|1,0,1]=4 1619 B9R1.5 CC1=CNCCCC1=O Amb24477793 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.5 CC1OCCCCC1=O Amb25825779 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.5 C[C@@H]1CCCCCC1=O Amb25032177 [1,1,0,0,0,0|1,0,1]=4 1622 B9R1.5 C[C@H]1CCCCCC1=O Amb24475484 [1,1,0,0,0,0|1,0,1]=4 1623 B9R1.5 ClN1CCCCCC1=O Amb10572732 [1,1,0,0,0,0|1,0,1]=4 1624 B9R1.5 NC1CCCCCC1=O Amb18276126 [1,1,0,0,0,0|1,0,1]=4 1625 B9R1.5 NC1CCCCNC1=O Amb19958477 [1,1,0,0,0,0|1,0,1]=4 1626 B9R1.5 NN1CCCCCC1=O Amb22494978 [1,1,0,0,0,0|1,0,1]=4 1627 B9R1.5 NN1CCCCCC1=O Amb22495331 [1,1,0,0,0,0|1,0,1]=4 1628 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [1,1,0,0,0,0|1,0,1]=4 1629 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [1,1,0,0,0,0|1,0,1]=4 1630 B9R1.5 O=C1CCCCC=C1Cl Amb24631236 [1,1,0,0,0,0|1,0,0]=3 1631 B9R1.5 O=C1CCCCC=C1I Amb24478804 [1,1,0,0,0,0|1,0,0]=3 1632 B9R1.5 O=C1CCCCCC1=O Amb17593310 [1,1,0,0,0,0|1,0,1]=4 1633 B9R1.5 O=C1CCCCCC1Br Amb18325296 [1,1,0,0,0,0|1,0,1]=4 1634 B9R1.5 O=C1CCCCCC1F Amb21965071 [1,1,0,0,0,0|1,0,1]=4 1635 B9R1.5 O=C1CCCCC[C@H]1F Amb25318902 [1,1,0,0,0,0|1,0,1]=4 1636 B9R1.5 O=C1CCCCNC1=O Amb24056373 [1,1,0,0,0,0|2,0,0]=4 1637 B9R1.5 O=C1CNCCCC1F Amb22886238 [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.5 O=C1CNCCCC1F Amb25222674 [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.5 O=C1NCCCC[C@H]1N Amb10608775 [1,1,0,0,0,0|1,0,1]=4 1640 B9R1.5 O=C1OCCCCC1Br Amb24725884 [1,1,0,0,0,0|0,0,1]=3 1641 B9R1.5 OC1CCCCCC1=O Amb25284997 [1,1,0,0,0,0|1,0,1]=4 1642 B9R1.49 CC1CCC(=O)CC=C1 Amb24340212 [1,1,0,0,0,0|1,0,1]=4 1643 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [1,1,0,0,0,0|0,0,1]=3 1644 B9R1.49 CC1COC(=O)NCC1 Amb24393355 [1,1,0,0,0,0|1,0,1]=4 1645 B9R1.49 CN1CCCC(=O)C=C1 Amb25233711 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.49 CN1CCOC(=O)CC1 Amb25376750 [1,1,0,0,0,0|1,0,1]=4 1647 B9R1.49 C[C@H]1CCCC(=O)C=C1 Amb24513554 [1,1,0,0,0,0|1,0,0]=3 1648 B9R1.49 C[C@H]1CCNC(=O)CC1 Amb25146079 [1,1,0,0,0,0|1,0,1]=4 1649 B9R1.49 NC1CCCC(=O)CC1 Amb25259225 [1,1,0,0,0,0|1,0,1]=4 1650 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [1,1,0,0,0,0|1,0,1]=4 1651 B9R1.49 NC1CCOC(=O)CC1 Amb23598291 [1,1,0,0,0,0|0,0,1]=3 1652 B9R1.49 NC1CNC(=O)CCC1 Amb22230053 [1,1,0,0,0,0|1,0,1]=4 1653 B9R1.49 O=C1CC=CC(=O)CC1 Amb25229531 [1,1,0,0,0,0|1,0,1]=4 1654 B9R1.49 O=C1CCC(=O)OCC1 Amb25723209 [1,1,0,0,0,0|0,0,2]=4 1655 B9R1.49 O=C1CCC(Br)CCO1 Amb25188931 [1,1,0,0,0,0|0,0,1]=3 1656 B9R1.49 O=C1CCC(Cl)CCO1 Amb24480302 [1,1,0,0,0,0|0,0,1]=3 1657 B9R1.49 O=C1CCCC(Br)C=C1 Amb25772717 [1,1,0,0,0,0|1,0,0]=3 1658 B9R1.49 O=C1CC[C@@H](Cl)CCO1 Amb24518083 [1,1,0,0,0,0|0,0,1]=3 1659 B9R1.49 O=C1CC[C@H](Cl)CCO1 Amb25123845 [1,1,0,0,0,0|0,0,1]=3 1660 B9R1.49 OC1CCCC(=O)C=C1 Amb25128891 [1,1,0,0,0,0|1,0,0]=3 1661 B9R1.49 OC1CCOC(=O)CC1 Amb23598292 [1,1,0,0,0,0|0,0,1]=3 1662 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [1,1,0,0,0,0|1,0,1]=4 1663 B9R1.49 O[C@@H]1CCCC(=O)C=C1 Amb25319020 [1,1,0,0,0,0|1,0,0]=3 1664 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [1,1,0,0,0,0|1,0,1]=4 1665 B9R1.89 O=C=C1CCCCCC1 Amb24412602 [1,1,0,0,0,0|1,0,1]=4 1666 B9R1.89 O=CC=1C=CCCCC1 Amb25827154 [1,1,0,0,0,0|1,0,1]=4 1667 B9R1.2 C=CC1CCCC(=O)O1 Amb25687134 [0,1,0,0,1,0|1,0,1]=4 1668 B9R1.2 C=CC=1CCCC(=O)C1 Amb25134896 [0,1,0,0,1,0|2,0,0]=4 1669 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [0,1,0,0,1,0|2,0,0]=4 1670 B9R1.2 COC=1CCCC(=O)C1 Amb19930192 [0,1,0,0,1,0|1,0,1]=4 1671 B9R1.2 CSC=1CCCC(=O)C1 Amb25735167 [0,1,0,0,1,0|1,1,0]=4 1672 B9R1.2 N#CC=1CCCC(=O)C1 Amb18641996 [0,1,0,0,1,0|2,0,0]=4 1673 B9R1.2 O=C1CCC=C(CCl)O1 Amb25032240 [0,1,0,0,1,0|1,0,1]=4 1674 B9R1.2 O=C1CCCC(=C1)C=O Amb18642169 [0,1,0,0,1,0|1,0,0]=3 1675 B9R1.2 O=C1CCCC(CI)O1 Amb24675480 [0,1,0,0,1,0|1,0,1]=4 1676 B9R1.2 O=C1CCC[C@@H](CCl)O1 Amb24408738 [0,1,0,0,1,0|1,0,1]=4 1677 B9R1.2 O=C1CCC\C(=C\Br)\O1 Amb24519194 [0,1,0,0,1,0|1,0,0]=3 1678 B9R1.2 O=C1C\C(\CCC1)=C/Cl Amb24524211 [0,1,0,0,1,0|2,0,0]=4 1679 B9R1.2 O=CC1CC(=O)CCC1 Amb18642402 [0,1,0,0,1,0|1,0,1]=4 1680 B9R1.2 OC[C@@H]1CCCC(=O)O1 Amb25045754 [0,1,0,0,1,0|0,0,2]=4 1681 B9R1.2 O\N=C/1\CCCC(=O)C1 Amb25319163 [0,1,0,0,1,0|1,0,1]=4 1682 B9R1.2 [N-]=[N+]=C1CCCC(=O)C1 Amb17593275 [0,1,0,0,1,0|2,0,0]=4 1683 B9R1.3 C=C1CCCC(=O)N1N Amb25697068 [0,1,0,0,1,0|2,0,0]=4 1684 B9R1.3 CC1=C(C)CCCC1=O Amb17593288 [0,1,0,0,1,0|2,0,0]=4 1685 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [0,1,0,0,1,0|1,0,1]=4 1686 B9R1.3 CC1C(=O)CCCS1=O Amb25802270 [0,1,0,0,1,0|2,0,0]=4 1687 B9R1.3 CC1C(=O)COCC1=O Amb24621297 [0,1,0,0,1,0|2,0,0]=4 1688 B9R1.3 CC1C(=O)NCCC1=O Amb25220145 [0,1,0,0,1,0|2,0,0]=4 1689 B9R1.3 CC=1CCCC(=O)C1N Amb25710421 [0,1,0,0,1,0|2,0,0]=4 1690 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [0,1,0,0,1,0|1,0,0]=3 1691 B9R1.3 CN1C(=O)CNCC1=O Amb17334097 [0,1,0,0,1,0|2,0,0]=4 1692 B9R1.3 CN1C(=O)CSCC1=O Amb24612532 [0,1,0,0,1,0|2,0,0]=4 1693 B9R1.3 CN1C(=O)SCCC1=O Amb25212420 [0,1,0,0,1,0|2,0,0]=4 1694 B9R1.3 C[C@@H]1C(=O)CCCS1=O Amb25319756 [0,1,0,0,1,0|2,0,0]=4 1695 B9R1.3 NC1C(=O)CCCC1=O Amb24682149 [0,1,0,0,1,0|1,0,0]=3 1696 B9R1.3 NN1C(=O)CCCC1=O Amb25130901 [0,1,0,0,1,0|1,0,0]=3 1697 B9R1.3 NN1C(=O)COCC1=O Amb25767934 [0,1,0,0,1,0|2,0,0]=4 1698 B9R1.3 NN1C(=O)CSCC1=O Amb25250492 [0,1,0,0,1,0|2,0,0]=4 1699 B9R1.3 O=C1C(=O)COCC1=O Amb25233585 [0,1,0,0,1,0|2,0,0]=4 1700 B9R1.3 O=C1CCCC(=O)C1Br Amb2459664 [0,1,0,0,1,0|1,0,0]=3 1701 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [0,1,0,0,1,0|1,0,0]=3 1702 B9R1.3 O=C1CCCC(=O)C1F Amb25143046 [0,1,0,0,1,0|1,0,0]=3 1703 B9R1.3 O=C1CCCC(Cl)=C1Cl Amb24736273 [0,1,0,0,1,0|2,0,0]=4 1704 B9R1.3 O=C1COCC(=O)C1[Na] Amb24605327 [0,1,0,0,1,0|2,0,0]=4 1705 B9R1.3 OC=1C(=O)CCCC1S Amb24529062 [0,1,0,0,1,0|1,1,0]=4 1706 B9R1.3 OC=1CCCC(=O)C1S Amb25792989 [0,1,0,0,1,0|1,0,1]=4 1707 B9R1.3 ON1C(=O)NCCC1=O Amb25146169 [0,1,0,0,1,0|2,0,0]=4 1708 B9R1.34 CC1=CC(=O)OC(=O)C1 Amb17673901 [0,1,0,0,1,0|0,0,2]=4 1709 B9R1.34 CC1CC(=O)CC(=O)N1 Amb22750293 [0,1,0,0,1,0|2,0,0]=4 1710 B9R1.34 CC1CC(=O)CC(=O)O1 Amb24422515 [0,1,0,0,1,0|2,0,0]=4 1711 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,1,0,0,1,0|1,0,0]=3 1712 B9R1.34 CC1CC(=O)NC(=O)N1 Amb2196506 [0,1,0,0,1,0|2,0,0]=4 1713 B9R1.34 CC1CC(O)CC(=O)O1 Amb23455145 [0,1,0,0,1,0|1,0,1]=4 1714 B9R1.34 CC=1C[C@@H](C)CC(=O)C1 Amb25044278 [0,1,0,0,1,0|2,0,0]=4 1715 B9R1.34 CC=1C[C@H](C)CC(=O)C1 Amb24631557 [0,1,0,0,1,0|2,0,0]=4 1716 B9R1.34 CN1CC(=O)CC(=O)C1 Amb22802168 [0,1,0,0,1,0|2,0,0]=4 1717 B9R1.34 CN1CC(=O)OC(=O)C1 Amb24673917 [0,1,0,0,1,0|1,0,0]=3 1718 B9R1.34 C[C@@H]1CC(=O)CC(=O)N1 Amb22750988 [0,1,0,0,1,0|2,0,0]=4 1719 B9R1.34 C[C@@H]1C[C@H](O)CC(=O)O1 Amb25246833 [0,1,0,0,1,0|1,0,1]=4 1720 B9R1.34 C[C@H]1CC(=O)C=C(N)C1 Amb25162761 [0,1,0,0,1,0|2,0,0]=4 1721 B9R1.34 C[C@H]1CC(=O)OC(=O)N1 Amb24551060 [0,1,0,0,1,0|1,0,0]=3 1722 B9R1.34 C[C@H]1CC(O)CC(=O)O1 Amb24541561 [0,1,0,0,1,0|1,0,1]=4 1723 B9R1.34 C[C@H]1C[C@@H](O)CC(=O)O1 Amb25220495 [0,1,0,0,1,0|1,0,1]=4 1724 B9R1.34 C[C@H]1C[C@H](O)CC(=O)O1 Amb25176759 [0,1,0,0,1,0|1,0,1]=4 1725 B9R1.34 NC1CC(=O)NC(=O)N1 Amb24545303 [0,1,0,0,1,0|2,0,0]=4 1726 B9R1.34 NC1CC(=O)OC(=O)C1 Amb24477706 [0,1,0,0,1,0|0,0,0]=2 1727 B9R1.34 O=C1CC(=O)NC(=O)C1 Amb18832704 [0,1,0,0,1,0|1,0,1]=4 1728 B9R1.34 O=C1CC(=O)OC(=O)C1 Amb10070246 [0,1,0,0,1,0|0,0,1]=3 1729 B9R1.34 O=C1CC(=O)[N-]C(=O)C1 Amb22056073 [0,1,0,0,1,0|1,0,1]=4 1730 B9R1.34 O=C1CC(O)C=C(O1)C Amb16231305 [0,1,0,0,1,0|1,0,1]=4 1731 B9R1.34 O=C1NC(F)CC(=O)N1 Amb24476702 [0,1,0,0,1,0|2,0,0]=4 1732 B9R1.34 O=C1NC(I)CC(=O)N1 Amb25662770 [0,1,0,0,1,0|2,0,0]=4 1733 B9R1.34 OC1CC(=O)CC(=O)N1 Amb24568891 [0,1,0,0,1,0|2,0,0]=4 1734 B9R1.34 OC1CC(=O)NC(=O)N1 Amb25177269 [0,1,0,0,1,0|2,0,0]=4 1735 B9R1.34 OC1CC(=O)OC(=O)C1 Amb24457409 [0,1,0,0,1,0|0,0,0]=2 1736 B9R1.34 OC=1CC(=O)OC(=O)C1 Amb25689610 [0,1,0,0,1,0|0,0,2]=4 1737 B9R1.66 O=C1CCCS(=O)(=O)C1 Amb13953230 [0,1,0,0,1,0|2,0,0]=4 1738 B9R1.66 O=C1CCCS(=O)(=O)N1 Amb10070303 [0,1,0,0,1,0|2,0,0]=4 1739 B9R1.69 BrC1CNC(=O)NC1=O Amb1156185 [0,1,0,0,1,0|2,0,0]=4 1740 B9R1.69 C=C1CC[C@@H](N)C(=O)O1 Amb24426847 [0,1,0,0,1,0|1,0,0]=3 1741 B9R1.69 C=C1CNC(=O)OC1=O Amb25757433 [0,1,0,0,1,0|1,0,1]=4 1742 B9R1.69 CC1=CC(=O)CCC1C Amb25128835 [0,1,0,0,1,0|2,0,0]=4 1743 B9R1.69 CC1=CC(=O)CCC1O Amb24519337 [0,1,0,0,1,0|2,0,0]=4 1744 B9R1.69 CC1=NC(=O)CCC1C Amb24070883 [0,1,0,0,1,0|2,0,0]=4 1745 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,0,1,0|1,0,0]=3 1746 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,1,0,0,1,0|1,0,0]=3 1747 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,0,1,0|0,0,0]=2 1748 B9R1.69 CC1CCC(N)C(=O)O1 Amb24563967 [0,1,0,0,1,0|1,0,1]=4 1749 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,1,0,0,1,0|1,0,1]=4 1750 B9R1.69 CC1CCC(O)OC1=O Amb25306421 [0,1,0,0,1,0|0,0,2]=4 1751 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,0,1,0|2,0,0]=4 1752 B9R1.69 CC1CNC(=O)NC1=O Amb1152691 [0,1,0,0,1,0|2,0,0]=4 1753 B9R1.69 CC1CSC(=O)NC1=O Amb24478738 [0,1,0,0,1,0|2,0,0]=4 1754 B9R1.69 CC1OC(=O)CCC1O Amb24524239 [0,1,0,0,1,0|1,0,1]=4 1755 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,1,0,0,1,0|1,0,0]=3 1756 B9R1.69 CC=1CCC(Cl)C(=O)C1 Amb25059200 [0,1,0,0,1,0|2,0,0]=4 1757 B9R1.69 CC=1CC[C@@H](O)C(=O)C1 Amb24422729 [0,1,0,0,1,0|2,0,0]=4 1758 B9R1.69 CN1CCC(=O)NC1=O Amb2389875 [0,1,0,0,1,0|2,0,0]=4 1759 B9R1.69 C[C@@H]1NCC(=O)NC1=O Amb25146037 [0,1,0,0,1,0|2,0,0]=4 1760 B9R1.69 C[C@H]1CCC(=O)CS1=O Amb25782562 [0,1,0,0,1,0|2,0,0]=4 1761 B9R1.69 C[C@H]1CCC(=O)NC1=O Amb24478802 [0,1,0,0,1,0|1,0,0]=3 1762 B9R1.69 C[C@H]1NCC(=O)NC1=O Amb24532839 [0,1,0,0,1,0|2,0,0]=4 1763 B9R1.69 C[C@H]1OC(=O)CC[C@@H]1O Amb25350343 [0,1,0,0,1,0|1,0,1]=4 1764 B9R1.69 ClC1CNC(=O)NC1=O Amb2099523 [0,1,0,0,1,0|2,0,0]=4 1765 B9R1.69 FC1CNC(=O)NC1=O Amb17614408 [0,1,0,0,1,0|2,0,0]=4 1766 B9R1.69 FC1C[15NH][13C](=O)[15NH]C1=O Amb17614409 [0,1,0,0,1,0|2,0,0]=4 1767 B9R1.69 NC1CCC(=O)NC1=O Amb16233835 [0,1,0,0,1,0|1,0,0]=3 1768 B9R1.69 NC1CCC(=O)NC1=O Amb20620338 [0,1,0,0,1,0|1,0,0]=3 1769 B9R1.69 NC1CCC(=O)NC1=O Amb22640986 [0,1,0,0,1,0|1,0,0]=3 1770 B9R1.69 NC1CSC(=O)NC1=O Amb24477717 [0,1,0,0,1,0|2,0,0]=4 1771 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb18536900 [0,1,0,0,1,0|1,0,0]=3 1772 B9R1.69 N[C@H]1CCC(=O)NC1=O Amb17134710 [0,1,0,0,1,0|1,0,0]=3 1773 B9R1.69 N[C@H]1CCC(=O)OC1=O Amb24680533 [0,1,0,0,1,0|0,0,0]=2 1774 B9R1.69 O=C1CC(=O)C(Br)CC1 Amb25234901 [0,1,0,0,1,0|1,0,0]=3 1775 B9R1.69 O=C1CCC(=O)OC1=O Amb24620117 [0,1,0,0,1,0|0,0,1]=3 1776 B9R1.69 O=C1CCC(Br)C(=O)N1 Amb22735973 [0,1,0,0,1,0|1,0,0]=3 1777 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,1,0,0,1,0|0,0,0]=2 1778 B9R1.69 O=C1CCC(Cl)C(=O)O1 Amb25060552 [0,1,0,0,1,0|0,0,0]=2 1779 B9R1.69 O=C1CCC(F)C(=O)N1 Amb24478812 [0,1,0,0,1,0|1,0,0]=3 1780 B9R1.69 O=C1NCC(I)C(=O)N1 Amb25805174 [0,1,0,0,1,0|2,0,0]=4 1781 B9R1.69 OC1CCC(=O)OC1=O Amb25728114 [0,1,0,0,1,0|0,0,0]=2 1782 B9R1.69 OC1CCC(Br)=CC1=O Amb24543452 [0,1,0,0,1,0|2,0,0]=4 1783 B9R1.69 OC1CNC(=O)NC1=O Amb20001684 [0,1,0,0,1,0|2,0,0]=4 1784 B9R1.15 C#CC1CCCCC1=O Amb25730250 [0,1,0,0,1,0|1,0,1]=4 1785 B9R1.15 C=C1CCCCC1C=O Amb18642243 [0,1,0,0,1,0|1,0,1]=4 1786 B9R1.15 CC=1CCCCC1C#N Amb18642014 [0,1,0,0,1,0|2,0,0]=4 1787 B9R1.15 CC=1CCCCC1C=O Amb18642216 [0,1,0,0,1,0|1,0,0]=3 1788 B9R1.15 CCC1=NCCCC1=O Amb24478584 [0,1,0,0,1,0|2,0,0]=4 1789 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,0,1,0|1,0,1]=4 1790 B9R1.15 CCN1CCCCC1=O Amb22394930 [0,1,0,0,1,0|2,0,0]=4 1791 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,0,1,0|1,0,1]=4 1792 B9R1.15 CC[C@H]1CCCCC1=O Amb25093777 [0,1,0,0,1,0|1,0,1]=4 1793 B9R1.15 CNC1=CCCCC1=O Amb25743372 [0,1,0,0,1,0|1,0,1]=4 1794 B9R1.15 COC1=CCCCC1=O Amb22755964 [0,1,0,0,1,0|0,0,2]=4 1795 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [0,1,0,0,1,0|0,0,2]=4 1796 B9R1.15 CSC1CCCCC1=O Amb19267090 [0,1,0,0,1,0|0,1,1]=4 1797 B9R1.15 C\C=C/1\CCCCC1=O Amb24571944 [0,1,0,0,1,0|1,0,0]=3 1798 B9R1.15 C\C=C/1\CCOCC1=O Amb24722942 [0,1,0,0,1,0|2,0,0]=4 1799 B9R1.15 C\C=C\1/CCCCC1=O Amb10558348 [0,1,0,0,1,0|1,0,0]=3 1800 B9R1.15 N#CC=1CCCCC1Cl Amb19337274 [0,1,0,0,1,0|2,0,0]=4 1801 B9R1.15 N#CC=1CCCCC1O Amb22057806 [0,1,0,0,1,0|1,0,1]=4 1802 B9R1.15 N#CN1CCCCC1=O Amb25227184 [0,1,0,0,1,0|2,0,0]=4 1803 B9R1.15 NC=1CCCCC1C#N Amb18278062 [0,1,0,0,1,0|2,0,0]=4 1804 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,1,0,0,1,0|1,0,1]=4 1805 B9R1.15 NCC=1CCCCC1Cl Amb18251295 [0,1,0,0,1,0|2,0,0]=4 1806 B9R1.15 NCC=1CCCCC1Cl Amb22364512 [0,1,0,0,1,0|2,0,0]=4 1807 B9R1.15 NCN1CCCCC1=O Amb24477757 [0,1,0,0,1,0|2,0,0]=4 1808 B9R1.15 N\C=C/1\CCCCC1=O Amb25146068 [0,1,0,0,1,0|1,0,0]=3 1809 B9R1.15 N\N=C/1\CCCCC1=O Amb24737465 [0,1,0,0,1,0|1,0,0]=3 1810 B9R1.15 O=C/1CCCC\C1=C/Cl Amb25725028 [0,1,0,0,1,0|1,0,0]=3 1811 B9R1.15 O=C1CCCC=C1C=O Amb18642171 [0,1,0,0,1,0|0,0,1]=3 1812 B9R1.15 O=C1CCCCC1=C=O Amb24467734 [0,1,0,0,1,0|0,0,0]=2 1813 B9R1.15 O=C1CCCCC1CI Amb24667741 [0,1,0,0,1,0|1,0,1]=4 1814 B9R1.15 O=CC1CCCCC1=O Amb19651323 [0,1,0,0,1,0|0,0,1]=3 1815 B9R1.15 O=CC=1CCCCC1Br Amb18522186 [0,1,0,0,1,0|1,0,0]=3 1816 B9R1.15 O=CN1CCCNC1=O Amb25146136 [0,1,0,0,1,0|2,0,0]=4 1817 B9R1.15 O=NC1CCCCC1=O Amb24662337 [0,1,0,0,1,0|0,0,1]=3 1818 B9R1.15 O=NN1CCCCC1=O Amb25114189 [0,1,0,0,1,0|1,0,0]=3 1819 B9R1.15 OCC1=CCCCC1=O Amb24453147 [0,1,0,0,1,0|0,0,2]=4 1820 B9R1.15 OCC1CCCCC1=O Amb16231080 [0,1,0,0,1,0|0,0,2]=4 1821 B9R1.15 ON=C1CCCCC1=O Amb24740156 [0,1,0,0,1,0|0,0,1]=3 1822 B9R1.15 O\C=C/1\CSCCC1=O Amb24736136 [0,1,0,0,1,0|1,0,1]=4 1823 B9R1.15 O\N=C/1\CSCCC1=O Amb25723315 [0,1,0,0,1,0|1,0,1]=4 1824 B9R1.15 O\N=C\1/CCCCC1=O Amb24360571 [0,1,0,0,1,0|0,0,1]=3 1825 B9R1.15 O\N=C\1/CCCNC1=O Amb24426726 [0,1,0,0,1,0|1,0,1]=4 1826 B9R1.15 [C-]#[N+]C1CCCCC1=O Amb25735183 [0,1,0,0,1,0|1,0,1]=4 1827 B9R1.15 [N-]=[N+]=C1CCCCC1=O Amb25074525 [0,1,0,0,1,0|1,0,0]=3 1828 B9R1.15 [N-]=[N+]=C1CCCNC1=O Amb15693097 [0,1,0,0,1,0|2,0,0]=4 1829 B9R1.15 [O-]C=C1CCCCC1=O Amb19329219 [0,1,0,0,1,0|0,0,1]=3 1830 B9R1.15 [O-]\C=C/1\COCCC1=O Amb25740627 [0,1,0,0,1,0|1,0,1]=4 1831 B9R1.40 CC1(C)CCCCC1=O Amb17673753 [0,1,0,0,1,0|1,0,1]=4 1832 B9R1.40 CC1(N)CCCCC1=O Amb25219565 [0,1,0,0,1,0|1,0,1]=4 1833 B9R1.40 CC1(S)CCCCC1=O Amb25202624 [0,1,0,0,1,0|0,1,1]=4 1834 B9R1.40 C[C@@]1(Cl)CCCCC1=O Amb25261118 [0,1,0,0,1,0|1,0,1]=4 1835 B9R1.40 C[C@@]1(O)CCCCC1=O Amb25059602 [0,1,0,0,1,0|0,0,2]=4 1836 B9R1.40 O=C1CCCCC1(C)Br Amb17594983 [0,1,0,0,1,0|1,0,1]=4 1837 B9R1.40 O=C1CCCCC1(C)Cl Amb15693404 [0,1,0,0,1,0|1,0,1]=4 1838 B9R1.40 O=C1CCCCC1(F)F Amb24117922 [0,1,0,0,1,0|1,0,1]=4 1839 B11R1.546 O=C1CCS(=O)(=O)CCCC1 Amb24486168 [0,1,0,0,0,1|2,0,0]=4 1840 B11R1.245 COC=1CCCCCC(=O)C1 Amb25373326 [0,1,0,0,0,1|1,0,1]=4 1841 B11R1.245 N#CC=1CCCCCC(=O)C1 Amb24528917 [0,1,0,0,0,1|2,0,0]=4 1842 B11R1.245 O=C1CC(CBr)=CCCCC1 Amb25082782 [0,1,0,0,0,1|2,0,0]=4 1843 B11R1.245 O=C1CCCCCC(=C1)C=O Amb25131196 [0,1,0,0,0,1|1,0,0]=3 1844 B11R1.558 CC=1CCCCCC(=O)C1C Amb24456705 [0,1,0,0,0,1|2,0,0]=4 1845 B11R1.558 CC=1CCCCCC(=O)C1F Amb25374036 [0,1,0,0,0,1|2,0,0]=4 1846 B11R1.558 O=C1CCCCCC(=O)C1Cl Amb25241200 [0,1,0,0,0,1|1,0,0]=3 1847 B11R1.563 O=C1CC(Cl)=CC(=O)CCC1 Amb24486435 [0,1,0,0,0,1|2,0,0]=4 1848 B11R1.110 CCOC=1CCCCC(=O)C1 Amb25151609 [0,2,0,0,0,0|1,0,1]=4 1849 B11R1.110 COCC=1CCCCC(=O)C1 Amb25372558 [0,2,0,0,0,0|1,0,1]=4 1850 B11R1.110 C\C=C\C=1CCCCC(=O)C1 Amb25318866 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.110 O=CC[C@H]1CC(=O)CCCC1 Amb25844434 [0,2,0,0,0,0|1,0,1]=4 1852 B11R1.381 CCC=1CCCCC(=O)C1O Amb25059678 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.381 C\C=C/1\CCCCC(=O)C1C Amb25093680 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.383 O\C=C/1\CCCCC(C=O)=C1 Amb24464914 [0,2,0,0,0,0|1,0,1]=4 1855 B11R1.384 CC1CCCC(=CC1=O)C=O Amb25218908 [0,2,0,0,0,0|1,0,0]=3 1856 B11R1.497 CC(C)C1CCCCC(=O)O1 Amb24366072 [0,2,0,0,0,0|1,0,1]=4 1857 B11R1.497 O=C1CCCCC(C1)C(=O)O Amb10603800 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.497 OC(=O)C1CCCCC(=O)N1 Amb19515429 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.497 OC(=O)C=1CC(=O)CCCC1 Amb24650908 [0,2,0,0,0,0|1,0,1]=4 1860 B11R1.952 CCC1CC(=O)NC(=O)NC1 Amb24404901 [0,2,0,0,0,0|2,0,0]=4 1861 B11R1.952 COC1CC(=O)NC(=O)NC1 Amb25810991 [0,2,0,0,0,0|2,0,0]=4 1862 B11R1.66 CCC1C(=O)CCCCC1=O Amb24405026 [0,2,0,0,0,0|1,0,0]=3 1863 B11R1.66 CCN1C(=O)NCCCC1=O Amb25832794 [0,2,0,0,0,0|2,0,0]=4 1864 B11R1.66 O=CC1C(=O)CCCCC1=O Amb24334670 [0,2,0,0,0,0|1,0,0]=3 1865 B11R1.494 CC1CC(=O)N(C)C(=O)NC1 Amb25077567 [0,2,0,0,0,0|2,0,0]=4 1866 B11R1.498 CC1(C)C(=O)CCCCC1=O Amb25840172 [0,2,0,0,0,0|1,0,0]=3 1867 B11R1.499 CC=1CCCC(C)C(=O)C1Cl Amb25092926 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.569 CC1C(=O)CCCCS1(=O)=O Amb24486166 [0,2,0,0,0,0|2,0,0]=4 1869 B11R1.500 CC1(C)OC(=O)CCC[C@@H]1O Amb25806709 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.512 CC=1CCC(C)(C)CC(=O)C1 Amb25718315 [0,2,0,0,0,0|2,0,0]=4 1871 B11R1.561 CC1CCCS(=O)(=O)CC1=O Amb25320106 [0,2,0,0,0,0|2,0,0]=4 1872 B11R1.564 CC1(C)CCCC(=C)CC1=O Amb24690670 [0,2,0,0,0,0|2,0,0]=4 1873 B11R1.564 CC=1CCCC(C)(C)C(=O)C1 Amb25188742 [0,2,0,0,0,0|2,0,0]=4 1874 B11R1.949 N#CC1CNCC(=O)NC1=O Amb25223467 [0,2,0,0,0,0|2,0,0]=4 1875 B9R1.7 CC1CC\C(\C1)=C/C=O Amb25792539 [0,0,1,1,0,0|2,0,0]=4 1876 B9R1.8 O=CC=C1CCCCC1 Amb17593282 [0,0,1,1,0,0|2,0,0]=4 1877 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [0,0,1,1,0,0|2,0,0]=4 1878 B9R1.8 O=CNC1=CCCCC1 Amb16192555 [0,0,1,1,0,0|2,0,0]=4 1879 B9R1.8 O=COC1CCCCC1 Amb17939405 [0,0,1,1,0,0|1,0,1]=4 1880 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [0,0,1,1,0,0|1,0,1]=4 1881 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,1,1,0,0|2,0,0]=4 1882 B9R1.12 CCCCc1nnco1 Amb2208687 [0,0,1,1,0,0|2,0,0]=4 1883 B9R1.22 CC1=CC(=O)CC1CC Amb24686502 [0,0,1,1,0,0|2,0,0]=4 1884 B9R1.22 CC=1CC(CC)C(=O)C1 Amb25759515 [0,0,1,1,0,0|2,0,0]=4 1885 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,0,1,1,0,0|1,0,0]=3 1886 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [0,0,1,1,0,0|0,0,0]=2 1887 B9R1.22 CCC1CC(O)OC1=O Amb24473366 [0,0,1,1,0,0|0,0,2]=4 1888 B9R1.22 CCC1NC(=O)CC1=O Amb18203277 [0,0,1,1,0,0|2,0,0]=4 1889 B9R1.22 CCC1NC(=O)NC1=O Amb1126591 [0,0,1,1,0,0|2,0,0]=4 1890 B9R1.22 CCC1NC(=O)OC1=O Amb25127713 [0,0,1,1,0,0|1,0,0]=3 1891 B9R1.22 CCC1OC(=O)NC1=O Amb24613855 [0,0,1,1,0,0|2,0,0]=4 1892 B9R1.22 CCC1SC(=O)NC1=O Amb10782080 [0,0,1,1,0,0|2,0,0]=4 1893 B9R1.22 CCN1CC(=O)CC1=O Amb24649940 [0,0,1,1,0,0|2,0,0]=4 1894 B9R1.22 CCN1CC(=O)NC1=O Amb24340233 [0,0,1,1,0,0|2,0,0]=4 1895 B9R1.22 CC[C@@H]1NC(=O)NC1=O Amb25146165 [0,0,1,1,0,0|2,0,0]=4 1896 B9R1.22 CC[C@H]1CC(=O)NC1=O Amb24606518 [0,0,1,1,0,0|1,0,0]=3 1897 B9R1.22 CC[C@H]1CC(=O)OC1O Amb25725427 [0,0,1,1,0,0|0,0,2]=4 1898 B9R1.22 CO[C@H]1CC(=O)NC1=O Amb25765322 [0,0,1,1,0,0|2,0,0]=4 1899 B9R1.22 CS[C@@H]1CC(=O)NC1=O Amb24367247 [0,0,1,1,0,0|2,0,0]=4 1900 B9R1.22 NCC1CC(=O)NC1=O Amb22899269 [0,0,1,1,0,0|2,0,0]=4 1901 B9R1.22 O=C1OC(=O)CC1CBr Amb24480245 [0,0,1,1,0,0|1,0,0]=3 1902 B9R1.22 O=C1OC(=O)NC1CCl Amb22054711 [0,0,1,1,0,0|2,0,0]=4 1903 B9R1.27 CC1CCC(=O)N1C=O Amb25190500 [0,0,1,1,0,0|1,0,0]=3 1904 B9R1.27 CC1CCC(Cl)=C1C=O Amb18644178 [0,0,1,1,0,0|2,0,0]=4 1905 B9R1.33 CCCC1C=CCC1=O Amb24722811 [0,0,1,1,0,0|2,0,0]=4 1906 B9R1.33 CCCC1CCOC1=O Amb25032145 [0,0,1,1,0,0|1,0,1]=4 1907 B9R1.50 O=C1CC=CCCCC1 Amb25767841 [0,0,1,1,0,0|2,0,0]=4 1908 B9R1.50 O=C1CCCCC=CN1 Amb24477747 [0,0,1,1,0,0|2,0,0]=4 1909 B9R1.50 O=C1CCCCNC=C1 Amb24745434 [0,0,1,1,0,0|2,0,0]=4 1910 B9R1.73 C=CCC(=O)C1CCC1 Amb25227397 [0,0,1,1,0,0|2,0,0]=4 1911 B9R1.73 O=CC=C(Cl)C1CCC1 Amb24722506 [0,0,1,1,0,0|2,0,0]=4 1912 B9R1.73 O=CNC(=O)C1CCC1 Amb25840105 [0,0,1,1,0,0|1,0,0]=3 1913 B9R1.75 CCOC(=O)CC1CC1 Amb22728965 [0,0,1,1,0,0|1,0,1]=4 1914 B9R1.75 O=C=NC(=O)CC1CC1 Amb24495364 [0,0,1,1,0,0|1,0,1]=4 1915 B9R1.154 C=C1OC(=O)C1CCCl Amb24340121 [0,0,1,1,0,0|2,0,0]=4 1916 B9R1.183 CC1CC1C(=O)CC=O Amb25762285 [0,0,1,1,0,0|1,0,0]=3 1917 B9R1.183 CC1CC1C(=O)N=C=O Amb24638481 [0,0,1,1,0,0|1,0,1]=4 1918 B9R1.183 C[C@@H]1C[C@H]1C(=O)OCC Amb24514988 [0,0,1,1,0,0|1,0,1]=4 1919 B9R1.13 CC(=O)CC=1CCCN1 Amb24659155 [0,0,1,1,0,0|2,0,0]=4 1920 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,0,1,1,0,0|0,0,2]=4 1921 B9R1.13 CC(=O)OC1CCCS1 Amb24402377 [0,0,1,1,0,0|0,1,1]=4 1922 B9R1.13 CC(=O)\C=C/1\CCCN1 Amb17593301 [0,0,1,1,0,0|2,0,0]=4 1923 B9R1.13 CC(=O)\C=C/1\CCCO1 Amb25241353 [0,0,1,1,0,0|1,0,1]=4 1924 B9R1.25 CC(=O)C1C(CC)C1=C Amb24340210 [0,0,1,1,0,0|2,0,0]=4 1925 B9R1.41 CC(=C)C1CCCC1=O Amb25032164 [0,0,1,1,0,0|2,0,0]=4 1926 B9R1.41 CC(=N)C1CCCC1=O Amb25728897 [0,0,1,1,0,0|2,0,0]=4 1927 B9R1.41 CC(=O)C1=CCCC1=O Amb25735738 [0,0,1,1,0,0|1,0,1]=4 1928 B9R1.41 CC(=O)C1CCCC1=S Amb24646456 [0,0,1,1,0,0|1,1,0]=4 1929 B9R1.41 CC(=O)C1CCOC1=O Amb2404781 [0,0,1,1,0,0|2,0,0]=4 1930 B9R1.41 CC(=O)C1CCSC1=O Amb24340323 [0,0,1,1,0,0|2,0,0]=4 1931 B9R1.41 CC(=O)N1SCCC1=O Amb25839837 [0,0,1,1,0,0|2,0,0]=4 1932 B9R1.41 CC(N)=C1CCCC1=O Amb24514883 [0,0,1,1,0,0|2,0,0]=4 1933 B9R1.41 CS(=O)C1CCCC1=O Amb24357722 [0,0,1,1,0,0|2,0,0]=4 1934 B9R1.41 C\C(\Cl)=C\1/CCCC1=O Amb24686528 [0,0,1,1,0,0|2,0,0]=4 1935 B9R1.41 C\C(\N)=C\1/CCCC1=O Amb25844128 [0,0,1,1,0,0|2,0,0]=4 1936 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,0,1,1,0,0|2,0,0]=4 1937 B9R1.41 NC(=O)N1CCCC1=O Amb16210586 [0,0,1,1,0,0|2,0,0]=4 1938 B9R1.41 NC(=O)[C@@H]1CCCC1=O Amb24182045 [0,0,1,1,0,0|2,0,0]=4 1939 B9R1.41 O=C1CCCC1C(=O)Cl Amb21961757 [0,0,1,1,0,0|2,0,0]=4 1940 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [0,0,1,1,0,0|2,0,0]=4 1941 B9R1.137 CC(=O)NC(=O)C1CC1 Amb25258842 [0,0,1,1,0,0|1,0,0]=3 1942 B9R1.137 CC(=S)CC(=O)C1CC1 Amb24752830 [0,0,1,1,0,0|1,1,0]=4 1943 B9R1.137 CC(S)=CC(=O)C1CC1 Amb25347596 [0,0,1,1,0,0|1,1,0]=4 1944 B9R1.137 C[C@H](OC(C)=O)C1CC1 Amb25767468 [0,0,1,1,0,0|1,0,1]=4 1945 B9R1.137 C\C(\S)=C\C(=O)C1CC1 Amb25298257 [0,0,1,1,0,0|1,1,0]=4 1946 B9R1.137 NC(=O)NC(=O)C1CC1 Amb25104753 [0,0,1,1,0,0|2,0,0]=4 1947 B9R1.137 O=C(C1CC1)CC(=O)O Amb10576272 [0,0,1,1,0,0|2,0,0]=4 1948 B9R1.171 CC(=O)OC1(C)CCC1 Amb24481922 [0,0,1,1,0,0|1,0,1]=4 1949 B9R1.6 CC(=O)C1CCCC=C1 Amb17593287 [0,0,1,1,0,0|2,0,0]=4 1950 B9R1.6 CC(=O)[C@H]1CCCC=C1 Amb25683968 [0,0,1,1,0,0|2,0,0]=4 1951 B9R1.6 NC(=O)C1CCCC=C1 Amb24623548 [0,0,1,1,0,0|2,0,0]=4 1952 B9R1.6 OC(=O)C1C=CCCN1 Amb25145978 [0,0,1,1,0,0|2,0,0]=4 1953 B9R1.6 OC(=O)C1CC=NCC1 Amb24340500 [0,0,1,1,0,0|2,0,0]=4 1954 B9R1.6 OC(=O)C1CCC=CN1 Amb24640071 [0,0,1,1,0,0|1,0,1]=4 1955 B9R1.6 OC(=O)C1CCC=CO1 Amb10071565 [0,0,1,1,0,0|0,0,2]=4 1956 B9R1.6 OC(=O)C1CCCC=C1 Amb18642396 [0,0,1,1,0,0|1,0,0]=3 1957 B9R1.6 OC(=O)C1CCCC=N1 Amb24346763 [0,0,1,1,0,0|1,0,0]=3 1958 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [0,0,1,1,0,0|0,1,1]=4 1959 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [0,0,1,1,0,0|2,0,0]=4 1960 B9R1.6 OC(=O)C1CCCNO1 Amb24672392 [0,0,1,1,0,0|1,0,1]=4 1961 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [0,0,1,1,0,0|2,0,0]=4 1962 B9R1.6 OC(=O)C1CCCSS1 Amb24480090 [0,0,1,1,0,0|1,1,0]=4 1963 B9R1.6 OC(=O)C1CNCC=C1 Amb18642497 [0,0,1,1,0,0|2,0,0]=4 1964 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [0,0,1,1,0,0|2,0,0]=4 1965 B9R1.6 OC(=O)[C@@H]1CC=CCC1 Amb19131346 [0,0,1,1,0,0|1,0,1]=4 1966 B9R1.6 OC(=O)[C@@H]1CCC=CC1 Amb17611453 [0,0,1,1,0,0|1,0,1]=4 1967 B9R1.6 OC(=O)[C@@H]1CCC=CN1 Amb19888332 [0,0,1,1,0,0|1,0,1]=4 1968 B9R1.6 OC(=O)[C@@H]1CCCC=N1 Amb25349486 [0,0,1,1,0,0|1,0,0]=3 1969 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [0,0,1,1,0,0|0,0,2]=4 1970 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [0,0,1,1,0,0|2,0,0]=4 1971 B9R1.6 OC(=O)[C@@H]1CCCNN1 Amb22747164 [0,0,1,1,0,0|2,0,0]=4 1972 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [0,0,1,1,0,0|2,0,0]=4 1973 B9R1.6 OC(=O)[C@H]1CNCC=C1 Amb24445539 [0,0,1,1,0,0|2,0,0]=4 1974 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [0,0,1,1,0,0|1,0,1]=4 1975 B9R1.24 CC1(O)CCCC1C=O Amb25723323 [0,0,1,1,0,0|1,0,1]=4 1976 B9R1.24 C[C@]1(O)CCC[C@H]1C=O Amb25326489 [0,0,1,1,0,0|1,0,1]=4 1977 B9R1.46 C=C1CC1NCC(O)=O Amb24402024 [0,0,1,1,0,0|2,0,0]=4 1978 B9R1.67 CC(=O)CC1CCC1=O Amb24434546 [0,0,1,1,0,0|1,0,0]=3 1979 B9R1.67 CC(=O)CN1CCC1=O Amb24566627 [0,0,1,1,0,0|2,0,0]=4 1980 B9R1.67 CC(=O)NC1CCC1=O Amb22896798 [0,0,1,1,0,0|2,0,0]=4 1981 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,0,1,1,0,0|1,0,1]=4 1982 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,0,1,1,0,0|1,0,1]=4 1983 B9R1.67 OC(=O)CN1CCC1=O Amb25368422 [0,0,1,1,0,0|1,0,0]=3 1984 B9R1.83 O=CCCCCC1CO1 Amb24469270 [0,0,1,1,0,0|1,0,1]=4 1985 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [0,0,1,1,0,0|1,0,1]=4 1986 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [0,0,1,1,0,0|0,0,2]=4 1987 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,0,1,1,0,0|1,0,1]=4 1988 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [0,0,1,1,0,0|2,0,0]=4 1989 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [0,0,1,1,0,0|2,0,0]=4 1990 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [0,0,1,1,0,0|1,0,1]=4 1991 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [0,0,1,1,0,0|1,0,1]=4 1992 B9R1.96 O=NN1CC[C@H]1C(=O)O Amb17618565 [0,0,1,1,0,0|2,0,0]=4 1993 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,0,1,1,0,0|0,0,0]=2 1994 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [0,0,1,1,0,0|1,0,1]=4 1995 B9R1.96 OC(=O)C1CCN1N=O Amb24726882 [0,0,1,1,0,0|2,0,0]=4 1996 B9R1.96 OC(=O)[C@H]1CCN1N=O Amb24340220 [0,0,1,1,0,0|2,0,0]=4 1997 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,0,1,1,0,0|0,0,2]=4 1998 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,0,1,1,0,0|1,0,1]=4 1999 B9R1.21 CCc1[n][n]c(CC)o1 Amb24728977 [0,0,1,1,0,0|2,0,0]=4 2000 B9R1.21 CCc1ncc(o1)CC Amb10554427 [0,0,1,1,0,0|2,0,0]=4 2001 B9R1.23 CC1N=C(OC1=O)CN Amb10603481 [0,0,1,1,0,0|2,0,0]=4 2002 B9R1.23 CCC=1NC(C)C(=O)N1 Amb24079431 [0,0,1,1,0,0|2,0,0]=4 2003 B9R1.23 COC1=CC(C)C(=O)O1 Amb24415354 [0,0,1,1,0,0|2,0,0]=4 2004 B9R1.37 CC1=NC(=O)C(C)C1C Amb24353879 [0,0,1,1,0,0|2,0,0]=4 2005 B9R1.37 CC1C(=O)CC(=O)N1C Amb22728666 [0,0,1,1,0,0|2,0,0]=4 2006 B9R1.37 CC1C(=O)CC(=O)N1C Amb22736319 [0,0,1,1,0,0|2,0,0]=4 2007 B9R1.37 CC1C(=O)NC(=O)N1C Amb25081567 [0,0,1,1,0,0|2,0,0]=4 2008 B9R1.37 CC1C(=O)OC(=O)C1=O Amb25358983 [0,0,1,1,0,0|1,0,1]=4 2009 B9R1.37 CC1C(=O)OC(=O)N1C Amb24718553 [0,0,1,1,0,0|1,0,0]=3 2010 B9R1.37 CC1C(C)C(=O)N=C1N Amb25733077 [0,0,1,1,0,0|2,0,0]=4 2011 B9R1.37 CC1C(C)C(=O)NC1=O Amb19148076 [0,0,1,1,0,0|1,0,0]=3 2012 B9R1.37 CC1C(C)C(O)OC1=O Amb24705671 [0,0,1,1,0,0|0,0,2]=4 2013 B9R1.37 CC1C(N)C(=O)OC1=O Amb24549009 [0,0,1,1,0,0|1,0,0]=3 2014 B9R1.37 CC1C(O)C(=O)NC1=O Amb24749603 [0,0,1,1,0,0|2,0,0]=4 2015 B9R1.37 C[C@@H]1C(=O)OC(=O)N1C Amb24183510 [0,0,1,1,0,0|1,0,0]=3 2016 B9R1.37 C[C@@H]1C(C)C(=O)NC1=O Amb24399285 [0,0,1,1,0,0|1,0,0]=3 2017 B9R1.37 C[C@@H]1[C@@H](C)C(=O)NC1=C Amb25064615 [0,0,1,1,0,0|2,0,0]=4 2018 B9R1.37 C[C@H]1C(=O)OC(=O)N1C Amb24528343 [0,0,1,1,0,0|1,0,0]=3 2019 B9R1.37 C[C@H]1[C@@H](C)C(=O)NC1=C Amb24608855 [0,0,1,1,0,0|2,0,0]=4 2020 B9R1.37 C[C@H]1[C@H](C)C(=O)NC1=O Amb24604822 [0,0,1,1,0,0|1,0,0]=3 2021 B9R1.37 O=C1OC(=O)C(Br)C1Br Amb22339491 [0,0,1,1,0,0|2,0,0]=4 2022 B9R1.37 O=C1OC(=O)C(Br)C1Cl Amb25119148 [0,0,1,1,0,0|2,0,0]=4 2023 B9R1.37 O=C1OC(=O)[C@H](Cl)[C@H]1Cl Amb25257992 [0,0,1,1,0,0|2,0,0]=4 2024 B9R1.37 OC1C(O)C(=O)OC1=O Amb25188995 [0,0,1,1,0,0|2,0,0]=4 2025 B9R1.79 CCC(=O)C=C1CCC1 Amb25712655 [0,0,1,1,0,0|2,0,0]=4 2026 B9R1.79 CCC(=O)OC1CCC1 Amb25851974 [0,0,1,1,0,0|1,0,1]=4 2027 B9R1.81 CCC(=O)N1CCC1=O Amb25190242 [0,0,1,1,0,0|1,0,0]=3 2028 B9R1.81 COC(=O)N1CCC1=O Amb24078326 [0,0,1,1,0,0|2,0,0]=4 2029 B9R1.81 C\C(\CC)=C\1/CCC1=O Amb25768437 [0,0,1,1,0,0|2,0,0]=4 2030 B9R1.81 O=C1CCN1C(=O)CBr Amb25837460 [0,0,1,1,0,0|2,0,0]=4 2031 B9R2.7 O=C1CC2CCCC12 Amb25106047 [1,0,0,1,0,0|1,0,1]=4 2032 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [1,0,0,1,0,0|2,0,0]=4 2033 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [1,0,0,1,0,0|1,0,1]=4 2034 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [1,0,0,1,0,0|1,0,0]=3 2035 B9R2.20 O=C1C=C[C@@H]2CC[C@H]12 Amb25373394 [1,0,0,1,0,0|1,0,0]=3 2036 B9R2.20 O=C1CC[C@H]2C=C[C@@H]12 Amb25319526 [1,0,0,1,0,0|1,0,1]=4 2037 B9R2.20 O=C1NCC2CCC12 Amb24121240 [1,0,0,1,0,0|1,0,1]=4 2038 B9R2.21 O=C1C[C@@H]2C[C@H]2CC1 Amb25294409 [1,0,0,1,0,0|1,0,1]=4 2039 B9R2.21 O=C1N[C@H]2C[C@H]2CO1 Amb24630201 [1,0,0,1,0,0|1,0,1]=4 2040 B9R2.33 O=C1C[C@@H]2CC[C@H]2C1 Amb24614774 [1,0,0,1,0,0|1,0,1]=4 2041 B9R2.33 O=C1C[C@H]2CC[C@@H]2C1 Amb24724072 [1,0,0,1,0,0|1,0,1]=4 2042 B9R2.109 O=C1CCCC2C1C2 Amb17593139 [1,0,0,1,0,0|1,0,1]=4 2043 B9R2.109 O=C1CCCC2OC12 Amb20671097 [1,0,0,1,0,0|2,0,0]=4 2044 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [1,0,0,1,0,0|1,0,1]=4 2045 B9R2.109 O=C1CCC[C@@H]2O[C@@H]12 Amb25373140 [1,0,0,1,0,0|2,0,0]=4 2046 B9R2.109 O=C1CCC[C@@H]2O[C@H]12 Amb24631684 [1,0,0,1,0,0|2,0,0]=4 2047 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [1,0,0,1,0,0|1,0,1]=4 2048 B9R2.109 O=C1CCC[C@H]2O[C@@H]12 Amb25252262 [1,0,0,1,0,0|2,0,0]=4 2049 B9R2.109 O=C1NCCC2CC12 Amb25717930 [1,0,0,1,0,0|1,0,1]=4 2050 B9R2.123 O=C1C2CCCCC12 Amb24689511 [1,0,0,1,0,0|1,0,1]=4 2051 B9R2.18 O=C1C2CNC(=O)C12 Amb24671207 [0,0,0,1,1,0|2,0,0]=4 2052 B9R2.25 CC1=CC(=O)C2CC12 Amb25833652 [0,0,0,1,1,0|2,0,0]=4 2053 B9R2.25 O=C1NC(=O)C2C1C2 Amb2446323 [0,0,0,1,1,0|1,0,0]=3 2054 B9R2.25 O=C1NC(=S)[C@@H]2C[C@H]12 Amb25206358 [0,0,0,1,1,0|1,1,0]=4 2055 B9R2.25 O=C1OC(=O)C2C1C2 Amb2445133 [0,0,0,1,1,0|0,0,0]=2 2056 B9R2.25 O=C1OC(=O)C2OC12 Amb22366041 [0,0,0,1,1,0|1,0,0]=3 2057 B9R2.25 OC1OC(=O)C2CC21 Amb25809854 [0,0,0,1,1,0|0,0,2]=4 2058 B9R2.17 CC12CC1CCC2=O Amb24752240 [0,0,0,1,1,0|1,0,1]=4 2059 B9R2.19 O=C1CCC2CC1C2 Amb22499413 [0,0,0,1,1,0|1,0,1]=4 2060 B9R2.19 O=C1CCC2CC1O2 Amb22364973 [0,0,0,1,1,0|0,0,2]=4 2061 B9R2.19 O=C1CC[C@H]2C[C@@H]1C2 Amb25128839 [0,0,0,1,1,0|1,0,1]=4 2062 B9R2.37 CC1C2CC2CC1=O Amb24467038 [0,0,0,1,1,0|1,0,1]=4 2063 B9R2.37 C[C@@H]1[C@H]2C[C@H]2CC1=O Amb25810735 [0,0,0,1,1,0|1,0,1]=4 2064 B9R2.53 O=C1[C@@H]2C[C@H]1CCC2 Amb24633468 [0,0,0,1,1,0|1,0,1]=4 2065 B9R2.90 O=C1C(Cl)C2CCC12 Amb25212274 [0,0,0,1,1,0|1,0,1]=4 2066 B9R2.90 O=C1[C@@H](Cl)[C@H]2CC[C@@H]12 Amb24740810 [0,0,0,1,1,0|1,0,1]=4 2067 B11R2.66 C=C1C[C@H]2CCC(=O)[C@H]2C1 Amb24598977 [0,0,0,1,0,1|2,0,0]=4 2068 B11R2.66 NC1CCC2CC(=O)OC21 Amb25725757 [0,0,0,1,0,1|1,0,1]=4 2069 B11R2.66 O=C1CC2C(C1)CCC2=O Amb25735878 [0,0,0,1,0,1|1,0,0]=3 2070 B11R2.66 O=C1CC2C(C1)COC2=O Amb25735126 [0,0,0,1,0,1|2,0,0]=4 2071 B11R2.66 O=C1CC2CCC(=O)N2C1 Amb24422098 [0,0,0,1,0,1|1,0,0]=3 2072 B11R2.66 O=C1CC2COC(=O)N2C1 Amb25783364 [0,0,0,1,0,1|2,0,0]=4 2073 B11R2.66 O=C1CC[C@@H]2NC(=O)CN12 Amb24712902 [0,0,0,1,0,1|2,0,0]=4 2074 B11R2.66 O=C1CC[C@H]2NC(=O)CN12 Amb25316850 [0,0,0,1,0,1|2,0,0]=4 2075 B11R2.66 O=C1C[C@H]2CCC(=O)[C@H]2O1 Amb25288519 [0,0,0,1,0,1|0,0,0]=2 2076 B11R2.66 O=C1C[C@H]2CC[C@H](Cl)[C@H]2O1 Amb24666593 [0,0,0,1,0,1|1,0,1]=4 2077 B11R2.66 O=C1C[C@H]2[C@@H](C1)CCC2=O Amb25377838 [0,0,0,1,0,1|1,0,0]=3 2078 B11R2.117 C=C1CN2C(CC2=O)CC1 Amb24377740 [0,0,0,1,0,1|2,0,0]=4 2079 B11R2.117 O=C1COC2CC(=O)N2C1 Amb24502173 [0,0,0,1,0,1|2,0,0]=4 2080 B11R2.117 O=C1CSC2CC(=O)N2C1 Amb25073402 [0,0,0,1,0,1|2,0,0]=4 2081 B11R2.207 O=C1CNC(=O)[C@H]2CCN12 Amb25113517 [0,0,0,1,0,1|2,0,0]=4 2082 B11R2.67 CC1=CCC2CCC(=O)C12 Amb25094420 [0,0,0,1,0,1|2,0,0]=4 2083 B11R2.67 O=C1CCC2CCC(=O)C12 Amb25297295 [0,0,0,1,0,1|1,0,0]=3 2084 B11R2.67 O=C1CCC2CCC(=O)N12 Amb24502246 [0,0,0,1,0,1|1,0,0]=3 2085 B11R2.67 O=C1CCC2COC(=O)N12 Amb24751422 [0,0,0,1,0,1|1,0,0]=3 2086 B11R2.67 O=C1CCC2N1C(=O)CS2 Amb2428441 [0,0,0,1,0,1|1,0,0]=3 2087 B11R2.67 O=C1CC[C@H]2COC(=O)N12 Amb24720585 [0,0,0,1,0,1|1,0,0]=3 2088 B11R2.67 O=C1CC[C@H]2COC(=O)[C@@H]12 Amb24760769 [0,0,0,1,0,1|1,0,0]=3 2089 B11R2.67 O=C1CSC2CCC(=O)C12 Amb25833252 [0,0,0,1,0,1|1,0,0]=3 2090 B11R2.70 O=C1CC(=O)C2CC2CC1 Amb25319977 [0,0,0,1,0,1|1,0,0]=3 2091 B11R2.202 C=C1CC(=O)N2CCCC21 Amb25233982 [0,0,0,1,0,1|2,0,0]=4 2092 B11R2.202 C=C1CC(=O)N2CCC[C@H]21 Amb24334708 [0,0,0,1,0,1|2,0,0]=4 2093 B11R2.202 NC1=NC(=O)C2CCCN12 Amb24449783 [0,0,0,1,0,1|2,0,0]=4 2094 B11R2.202 O=C1CC(=O)[C@@H]2CCCN12 Amb18832117 [0,0,0,1,0,1|1,0,0]=3 2095 B11R2.202 O=C1CC(=O)[C@H]2CCCN12 Amb24707784 [0,0,0,1,0,1|1,0,0]=3 2096 B11R2.202 O=C1NC(=O)C2CNCC12 Amb20622869 [0,0,0,1,0,1|1,0,0]=3 2097 B11R2.202 O=C1NC(=O)C2SCCN12 Amb24524342 [0,0,0,1,0,1|2,0,0]=4 2098 B11R2.202 O=C1NC(=O)C=2CCCC12 Amb25060653 [0,0,0,1,0,1|1,0,1]=4 2099 B11R2.202 O=C1NC(=O)[C@@H]2[C@H]1CNC2 Amb15701381 [0,0,0,1,0,1|1,0,0]=3 2100 B11R2.202 O=C1NC(=O)[C@H]2CCCN12 Amb24079782 [0,0,0,1,0,1|1,0,0]=3 2101 B11R2.202 O=C1NC(=O)[C@H]2CSCN12 Amb24417934 [0,0,0,1,0,1|2,0,0]=4 2102 B11R2.202 O=C1NC(=S)N2CCC[C@H]21 Amb24079755 [0,0,0,1,0,1|1,1,0]=4 2103 B11R2.202 O=C1OC(=O)C=2CSCC12 Amb24453008 [0,0,0,1,0,1|0,0,2]=4 2104 B11R2.202 O=C1OC(=O)[C@@H]2CNC[C@H]12 Amb24479124 [0,0,0,1,0,1|0,0,0]=2 2105 B11R2.202 O=C1SC(=O)C2CCCN12 Amb25240598 [0,0,0,1,0,1|0,1,0]=3 2106 B11R2.202 OC1OC(=O)C2CCCC21 Amb24705711 [0,0,0,1,0,1|0,0,2]=4 2107 B11R2.468 O=C1CC2CCCC(=O)C12 Amb24524374 [0,0,0,1,0,1|1,0,0]=3 2108 B11R2.610 O=C1NC(=O)C2CCN2N1 Amb25351612 [0,0,0,1,0,1|2,0,0]=4 2109 B11R2.610 O=C1NC2CCC2C(=O)N1 Amb22490465 [0,0,0,1,0,1|1,0,0]=3 2110 B11R2.610 O=C1N[C@@H]2CC[C@@H]2C(=O)N1 Amb10975540 [0,0,0,1,0,1|1,0,0]=3 2111 B11R2.234 OC[C@@H]1OC(=O)[C@@H]2CC[C@@H]21 Amb25306510 [0,1,0,1,0,0|0,0,2]=4 2112 B11R2.234 OC[C@@H]1OC(=O)[C@H]2CC[C@H]21 Amb25204939 [0,1,0,1,0,0|0,0,2]=4 2113 B11R2.234 OC[C@H]1OC(=O)[C@@H]2CC[C@@H]21 Amb25317565 [0,1,0,1,0,0|0,0,2]=4 2114 B11R2.432 O=C1CC2CCC(C1)C2=O Amb23448495 [0,1,0,1,0,0|1,0,1]=4 2115 B11R2.432 O=C1C[C@@H]2CC[C@H](C1)C2=O Amb24466543 [0,1,0,1,0,0|1,0,1]=4 2116 B11R2.432 OC1C2CCC1CC(=O)O2 Amb25854359 [0,1,0,1,0,0|0,0,2]=4 2117 B11R2.1024 O=C1OC(CC2OC12)C=O Amb24545302 [0,1,0,1,0,0|1,0,1]=4 2118 B11R2.1385 O=CC1C2C1CCCC2=O Amb24408478 [0,1,0,1,0,0|1,0,1]=4 2119 B11R2.116 NC1CCC2CC1C(=O)O2 Amb24477012 [0,1,0,1,0,0|1,0,1]=4 2120 B11R2.116 O=C1CC2CC1C(=O)CC2 Amb23452863 [0,1,0,1,0,0|1,0,0]=3 2121 B11R2.116 O=C1CCC2CC1C(=O)N2 Amb23596866 [0,1,0,1,0,0|2,0,0]=4 2122 B11R2.130 OC1C2CC(CC2)OC1=O Amb25333566 [0,1,0,1,0,0|1,0,1]=4 2123 B11R2.494 CC=1C2CCC2C(=O)C1C Amb25145623 [0,1,0,1,0,0|2,0,0]=4 2124 B11R2.494 NN1C(=O)[C@H]2CC[C@H]2C1=O Amb24561980 [0,1,0,1,0,0|1,0,0]=3 2125 B11R2.542 C=C1CCC2CC(=O)C12Cl Amb24378856 [0,1,0,1,0,0|2,0,0]=4 2126 B11R2.542 CC12C(CC1=O)CCC2=C Amb25298339 [0,1,0,1,0,0|2,0,0]=4 2127 B11R2.542 CC12C(CCC1=O)CC2=C Amb25714387 [0,1,0,1,0,0|2,0,0]=4 2128 B11R2.68 O=C1OC2CC1CCC2Cl Amb25185385 [0,1,0,1,0,0|1,0,1]=4 2129 B11R2.68 O=C1OC2CC1CCC2I Amb24375690 [0,1,0,1,0,0|1,0,1]=4 2130 B11R2.68 O=C1O[C@@H]2C[C@H]1CC[C@@H]2Br Amb24606112 [0,1,0,1,0,0|1,0,1]=4 2131 B11R2.68 O=C1O[C@@H]2C[C@H]1CC[C@@H]2Cl Amb24595263 [0,1,0,1,0,0|1,0,1]=4 2132 B11R2.68 O=C1O[C@H]2C[C@@H]1CC[C@@H]2Br Amb24519671 [0,1,0,1,0,0|1,0,1]=4 2133 B11R2.68 O[C@H]1CC[C@H]2C[C@@H]1OC2=O Amb25332134 [0,1,0,1,0,0|1,0,1]=4 2134 B11R2.119 NC12CC(CCC1)OC2=O Amb24653771 [0,1,0,1,0,0|1,0,1]=4 2135 B11R2.119 N[C@]12C[C@H](CCC1)OC2=O Amb25259203 [0,1,0,1,0,0|1,0,1]=4 2136 B11R2.201 O=C1C=C(Cl)C2CC1CC2 Amb24619447 [0,1,0,1,0,0|2,0,0]=4 2137 B11R2.201 O=C1CC(=O)C2CCC1O2 Amb25730098 [0,1,0,1,0,0|1,0,0]=3 2138 B11R2.201 O=C1CC(=O)[C@@H]2C[C@H]1CC2 Amb24708580 [0,1,0,1,0,0|1,0,0]=3 2139 B11R2.201 O=C1NC(=O)C2CCC1N2 Amb24384838 [0,1,0,1,0,0|1,0,0]=3 2140 B11R2.201 O=C1NC(=O)C2CCC1O2 Amb24701946 [0,1,0,1,0,0|1,0,0]=3 2141 B11R2.201 O=C1NC(=O)[C@@H]2C[C@H]1CC2 Amb25325946 [0,1,0,1,0,0|1,0,0]=3 2142 B11R2.201 O=C1OC(=O)C2CC1CC2 Amb2221144 [0,1,0,1,0,0|0,0,0]=2 2143 B11R2.201 O=C1OC(=O)C2CCC1S2 Amb25224569 [0,1,0,1,0,0|0,0,0]=2 2144 B11R2.201 O=C1OC(=O)[C@@H]2C[C@H]1CC2 Amb25275974 [0,1,0,1,0,0|0,0,0]=2 2145 B11R2.201 OC1=CC(=O)C2CC1CC2 Amb25707477 [0,1,0,1,0,0|1,0,1]=4 2146 B11R2.434 O=C1CC2CC(CC2Br)O1 Amb24402753 [0,1,0,1,0,0|1,0,1]=4 2147 B11R2.434 O=C1C[C@@H]2C[C@H](C[C@@H]2Br)O1 Amb25176396 [0,1,0,1,0,0|1,0,1]=4 2148 B11R2.434 O[C@@H]1C[C@@H]2C[C@H]1CC(=O)O2 Amb25225944 [0,1,0,1,0,0|1,0,1]=4 2149 B11R2.624 C=C1CC2C1C(=O)NC2=O Amb25808061 [0,1,0,1,0,0|1,0,1]=4 2150 B7R0.5 CC(=C)C(=O)CCN Amb25694471 [0,0,1,0,1,0|2,0,0]=4 2151 B7R0.5 CC(=C)C(=O)CSC Amb25704058 [0,0,1,0,1,0|2,0,0]=4 2152 B7R0.5 CC(=C)C(=O)NCC Amb17934052 [0,0,1,0,1,0|2,0,0]=4 2153 B7R0.5 CC(=O)C(=C)CCO Amb25831249 [0,0,1,0,1,0|2,0,0]=4 2154 B7R0.5 CC(=O)C(=C)COC Amb25796652 [0,0,1,0,1,0|2,0,0]=4 2155 B7R0.5 CC(=O)C(=O)C#CC Amb24481230 [0,0,1,0,1,0|0,0,2]=4 2156 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [0,0,1,0,1,0|1,0,1]=4 2157 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,0,1,0,1,0|1,0,0]=3 2158 B7R0.5 CC(=O)C(=O)COC Amb24694271 [0,0,1,0,1,0|1,0,0]=3 2159 B7R0.5 CC(=O)C(=O)CSC Amb24623163 [0,0,1,0,1,0|1,0,0]=3 2160 B7R0.5 CC(=O)C(=O)\C=C\C Amb24625395 [0,0,1,0,1,0|0,0,2]=4 2161 B7R0.5 CC(=O)\C(\Br)=C\CC Amb25205445 [0,0,1,0,1,0|1,0,1]=4 2162 B7R0.5 CC(=O)\C(\F)=C/CC Amb24565632 [0,0,1,0,1,0|1,0,1]=4 2163 B7R0.5 CCCC(=C)C(=O)Cl Amb25081936 [0,0,1,0,1,0|2,0,0]=4 2164 B7R0.5 CCCC(=C)C(N)=O Amb25189878 [0,0,1,0,1,0|2,0,0]=4 2165 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [0,0,1,0,1,0|2,0,0]=4 2166 B7R0.5 CCCC(=O)C(=O)Cl Amb24690783 [0,0,1,0,1,0|1,0,0]=3 2167 B7R0.5 CCCC(=O)C(C)N Amb18641850 [0,0,1,0,1,0|1,0,1]=4 2168 B7R0.5 CCCC(=O)C(C)O Amb24481443 [0,0,1,0,1,0|0,0,2]=4 2169 B7R0.5 CCCC(=O)C(N)=N Amb24670027 [0,0,1,0,1,0|2,0,0]=4 2170 B7R0.5 CCCC(=O)C(N)=O Amb24473081 [0,0,1,0,1,0|1,0,0]=3 2171 B7R0.5 CCCC(=O)C(N)=S Amb24562225 [0,0,1,0,1,0|1,1,0]=4 2172 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [0,0,1,0,1,0|1,0,0]=3 2173 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [0,0,1,0,1,0|1,0,0]=3 2174 B7R0.5 CCCC(=O)[C@@H](C)O Amb24582982 [0,0,1,0,1,0|0,0,2]=4 2175 B7R0.5 CCCC(=O)[C@H](C)O Amb24546365 [0,0,1,0,1,0|0,0,2]=4 2176 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,0,1,0,1,0|0,0,2]=4 2177 B7R0.5 CCCC(S)C(C)=O Amb24689502 [0,0,1,0,1,0|0,1,1]=4 2178 B7R0.5 CCCN(C)C(C)=O Amb24451102 [0,0,1,0,1,0|2,0,0]=4 2179 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [0,0,1,0,1,0|1,0,1]=4 2180 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [0,0,1,0,1,0|0,0,2]=4 2181 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,0,1,0,1,0|0,0,2]=4 2182 B7R0.5 CCNC(=O)C(=O)C Amb17399798 [0,0,1,0,1,0|1,0,0]=3 2183 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,0,1,0,1,0|2,0,0]=4 2184 B7R0.5 CCO[13C](=O)C(C)=O Amb22056123 [0,0,1,0,1,0|1,0,0]=3 2185 B7R0.5 CCSC(=O)C(N)=O Amb25081710 [0,0,1,0,1,0|2,0,0]=4 2186 B7R0.5 COCC(=O)C(O)=O Amb25304863 [0,0,1,0,1,0|2,0,0]=4 2187 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [0,0,1,0,1,0|2,0,0]=4 2188 B7R0.5 C\C(=C/CC)\C(C)=O Amb25067970 [0,0,1,0,1,0|1,0,1]=4 2189 B7R0.5 C\C(=C\CC)\C(C)=O Amb24575271 [0,0,1,0,1,0|1,0,1]=4 2190 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [0,0,1,0,1,0|2,0,0]=4 2191 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [0,0,1,0,1,0|2,0,0]=4 2192 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [0,0,1,0,1,0|2,0,0]=4 2193 B7R0.5 [13CH3][13CH2]OC(=O)C(=O)Cl Amb22353953 [0,0,1,0,1,0|2,0,0]=4 2194 B7R0.5 [2H][13CH2]CC(=O)C([O-])=O Amb22337314 [0,0,1,0,1,0|2,0,0]=4 2195 B7R0.5 [O-]C(=O)C(=O)OCC Amb16192061 [0,0,1,0,1,0|2,0,0]=4 2196 B7R0.10 BrCC(=O)C(=O)OC Amb2455971 [0,0,1,0,1,0|2,0,0]=4 2197 B7R0.10 CC(=CC)C(=O)CC Amb25233725 [0,0,1,0,1,0|1,0,1]=4 2198 B7R0.10 CC(CC)C(=O)CC Amb22229845 [0,0,1,0,1,0|1,0,1]=4 2199 B7R0.10 CCC(=C)C(=O)OC Amb24469857 [0,0,1,0,1,0|2,0,0]=4 2200 B7R0.10 CCC(=O)C(=C)CC Amb17593165 [0,0,1,0,1,0|1,0,0]=3 2201 B7R0.10 CCC(=O)C(=C)CCl Amb25314914 [0,0,1,0,1,0|2,0,0]=4 2202 B7R0.10 CCC(=O)C(=C)CO Amb24364209 [0,0,1,0,1,0|2,0,0]=4 2203 B7R0.10 CCC(=O)C(=O)C=O Amb25758777 [0,0,1,0,1,0|1,0,1]=4 2204 B7R0.10 CCC(=O)C(=O)CBr Amb24730429 [0,0,1,0,1,0|1,0,0]=3 2205 B7R0.10 CCC(=O)C(=O)NN Amb24706937 [0,0,1,0,1,0|2,0,0]=4 2206 B7R0.10 CCC(=O)C(=O)NO Amb25304726 [0,0,1,0,1,0|2,0,0]=4 2207 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,0,1,0,1,0|1,0,0]=3 2208 B7R0.10 CCC(=O)C(Br)=CC Amb24600977 [0,0,1,0,1,0|1,0,1]=4 2209 B7R0.10 CCC(=O)C(CC)Cl Amb17593422 [0,0,1,0,1,0|1,0,1]=4 2210 B7R0.10 CCC(=O)C(Cl)=CC Amb24512746 [0,0,1,0,1,0|1,0,1]=4 2211 B7R0.10 CCC(=O)C(F)=CC Amb24617907 [0,0,1,0,1,0|1,0,1]=4 2212 B7R0.10 CCC(=O)C(N)CC Amb18203255 [0,0,1,0,1,0|1,0,1]=4 2213 B7R0.10 CCC(=O)C(S)CC Amb25801155 [0,0,1,0,1,0|0,1,1]=4 2214 B7R0.10 CCC(=O)[C@@H](O)CC Amb24724312 [0,0,1,0,1,0|0,0,2]=4 2215 B7R0.10 CCC(=O)[C@H](O)CC Amb24333825 [0,0,1,0,1,0|0,0,2]=4 2216 B7R0.10 CN(CC)C(=O)CC Amb24663431 [0,0,1,0,1,0|2,0,0]=4 2217 B7R0.10 C[C@@H](CC)C(=O)CC Amb25735825 [0,0,1,0,1,0|1,0,1]=4 2218 B7R0.10 C\C(\CC)=C(/C)\CC Amb24099381 [0,0,1,0,1,0|2,0,0]=4 2219 B7R0.10 C\C(\CC)=C(\C)/CC Amb24561037 [0,0,1,0,1,0|2,0,0]=4 2220 B7R0.10 ClCC(=O)C(=O)CBr Amb17506259 [0,0,1,0,1,0|2,0,0]=4 2221 B7R0.10 O=C(CCl)C(=O)CCl Amb24579585 [0,0,1,0,1,0|2,0,0]=4 2222 B7R1.3 BrC1=CCCCO1 Amb24322651 [1,0,0,0,1,0|1,0,1]=4 2223 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,0,1,0|1,0,1]=4 2224 B7R1.3 BrC=1CCCCC1 Amb21856761 [1,0,0,0,1,0|1,0,0]=3 2225 B7R1.3 BrC=1CCCOC1 Amb24322600 [1,0,0,0,1,0|2,0,0]=4 2226 B7R1.3 BrC=1CCNCC1 Amb24317585 [1,0,0,0,1,0|2,0,0]=4 2227 B7R1.3 BrC=1CCOCC1 Amb21964919 [1,0,0,0,1,0|2,0,0]=4 2228 B7R1.3 BrC=1CCSCC1 Amb22229691 [1,0,0,0,1,0|2,0,0]=4 2229 B7R1.3 C=C1CNCCO1 Amb25800394 [1,0,0,0,1,0|2,0,0]=4 2230 B7R1.3 C=C1OCCCO1 Amb25734089 [1,0,0,0,1,0|2,0,0]=4 2231 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,0,1,0|1,0,1]=4 2232 B7R1.3 CC=1CCCNC1 Amb25694414 [1,0,0,0,1,0|2,0,0]=4 2233 B7R1.3 CC=1CCNCC1 Amb18639053 [1,0,0,0,1,0|2,0,0]=4 2234 B7R1.3 CC=1CCNCC1 Amb21961140 [1,0,0,0,1,0|2,0,0]=4 2235 B7R1.3 CC=1CCOCC1 Amb24070517 [1,0,0,0,1,0|2,0,0]=4 2236 B7R1.3 CC=1CNCCC1 Amb23439963 [1,0,0,0,1,0|2,0,0]=4 2237 B7R1.3 CC=1CNCCC1 Amb25063349 [1,0,0,0,1,0|2,0,0]=4 2238 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,0,1,0|1,0,1]=4 2239 B7R1.3 ClC=1CCOCC1 Amb24581676 [1,0,0,0,1,0|2,0,0]=4 2240 B7R1.3 ClC=1CCSCC1 Amb25025197 [1,0,0,0,1,0|2,0,0]=4 2241 B7R1.3 Cl[C@H]1CCCCO1 Amb24479760 [1,0,0,0,1,0|1,0,1]=4 2242 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,0,1,0|1,0,1]=4 2243 B7R1.3 FC=1CCCOC1 Amb24322810 [1,0,0,0,1,0|2,0,0]=4 2244 B7R1.3 IC=1CCCOC1 Amb24322812 [1,0,0,0,1,0|2,0,0]=4 2245 B7R1.3 IC=1CCOCC1 Amb25364046 [1,0,0,0,1,0|2,0,0]=4 2246 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,0,1,0|2,0,0]=4 2247 B7R1.3 N=C1NCCCO1 Amb23597225 [1,0,0,0,1,0|2,0,0]=4 2248 B7R1.3 NC1CCCCO1 Amb25137158 [1,0,0,0,1,0|1,0,1]=4 2249 B7R1.3 N[C@@H]1CCCCO1 Amb25146492 [1,0,0,0,1,0|1,0,1]=4 2250 B7R1.3 O=C1C=CCCN1 Amb22001783 [1,0,0,0,1,0|1,0,1]=4 2251 B7R1.3 O=C1CC=CCC1 Amb22365196 [1,0,0,0,1,0|1,0,1]=4 2252 B7R1.3 O=C1CCCC=C1 Amb17843126 [1,0,0,0,1,0|0,0,1]=3 2253 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,0,1,0|0,1,0]=3 2254 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,0,1,0|1,0,1]=4 2255 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,0,1,0|1,0,1]=4 2256 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,0,1,0|2,0,0]=4 2257 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,0,1,0|1,0,1]=4 2258 B7R1.3 O=C1CCOC=C1 Amb22000873 [1,0,0,0,1,0|1,0,1]=4 2259 B7R1.3 O=C1CCSC=C1 Amb25375022 [1,0,0,0,1,0|1,0,1]=4 2260 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,0,1,0|1,0,1]=4 2261 B7R1.3 O=C1CCSCN1 Amb24479868 [1,0,0,0,1,0|2,0,0]=4 2262 B7R1.3 O=C1CNCCC1 Amb19958010 [1,0,0,0,1,0|1,0,1]=4 2263 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,0,1,0|1,0,0]=3 2264 B7R1.3 O=C1COCC=C1 Amb22234519 [1,0,0,0,1,0|1,0,1]=4 2265 B7R1.3 O=C1COCCC1 Amb19373430 [1,0,0,0,1,0|1,0,1]=4 2266 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,0,1,0|2,0,0]=4 2267 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,0,1,0|1,0,0]=3 2268 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,0,1,0|1,1,0]=4 2269 B7R1.3 O=C1NCCC=N1 Amb24480889 [1,0,0,0,1,0|2,0,0]=4 2270 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,0,1,0|1,0,0]=3 2271 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,0,1,0|1,1,0]=4 2272 B7R1.3 O=C1OCCC=C1 Amb15693457 [1,0,0,0,1,0|0,0,2]=4 2273 B7R1.3 O=S1OCCCO1 Amb20240777 [1,0,0,0,1,0|2,0,0]=4 2274 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [1,0,0,0,1,0|0,0,1]=3 2275 B7R1.3 S=C1CCCCC1 Amb24565839 [1,0,0,0,1,0|0,1,1]=4 2276 B7R1.3 S=C1NCCCO1 Amb22524560 [1,0,0,0,1,0|1,1,0]=4 2277 B7R1.2 C=C1COC(=O)O1 Amb20248769 [0,0,0,0,2,0|2,0,0]=4 2278 B7R1.2 N=C1CCC(=O)N1 Amb10552414 [0,0,0,0,2,0|2,0,0]=4 2279 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [0,0,0,0,2,0|2,0,0]=4 2280 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,0,0,0,2,0|1,0,1]=4 2281 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,0,0,0,2,0|0,0,2]=4 2282 B7R1.2 O=C1C=CC(=O)O1 Amb22369065 [0,0,0,0,2,0|0,0,2]=4 2283 B7R1.2 O=C1C=C[13C](=O)O1 Amb22367487 [0,0,0,0,2,0|0,0,2]=4 2284 B7R1.2 O=C1CCC(=O)[15NH]1 Amb22338306 [0,0,0,0,2,0|1,0,0]=3 2285 B7R1.2 O=C1CCC(Br)=C1 Amb23399816 [0,0,0,0,2,0|2,0,0]=4 2286 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,0,0,0,2,0|1,0,1]=4 2287 B7R1.2 O=C1CCC(Cl)=N1 Amb24712377 [0,0,0,0,2,0|2,0,0]=4 2288 B7R1.2 O=C1CCC(I)=C1 Amb25811714 [0,0,0,0,2,0|2,0,0]=4 2289 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [0,0,0,0,2,0|1,0,1]=4 2290 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,0,0,0,2,0|2,0,0]=4 2291 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,0,0,0,2,0|2,0,0]=4 2292 B7R1.2 O=C1NCC(=O)S1 Amb22372196 [0,0,0,0,2,0|1,1,0]=4 2293 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [0,0,0,0,2,0|2,0,0]=4 2294 B7R1.2 O=C1SCC(=O)N1 Amb1853667 [0,0,0,0,2,0|2,0,0]=4 2295 B7R1.2 O=C1[13CH]=[13CH]C(=O)O1 Amb22353372 [0,0,0,0,2,0|0,0,2]=4 2296 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [0,0,0,0,2,0|0,0,0]=2 2297 B7R1.2 O=C1[15NH][13CH2]C(=O)N1 Amb17615001 [0,0,0,0,2,0|2,0,0]=4 2298 B7R1.2 O=C1[15NH][13CH2][13C](=O)N1 Amb17615000 [0,0,0,0,2,0|2,0,0]=4 2299 B7R1.2 O=[13C]1C=C[13C](=O)O1 Amb22367373 [0,0,0,0,2,0|0,0,2]=4 2300 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [0,0,0,0,2,0|0,0,0]=2 2301 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [0,0,0,0,2,0|0,0,0]=2 2302 B7R1.2 O=[13C]1[13CH]=[13CH][13C](=O)O1 Amb22055653 [0,0,0,0,2,0|0,0,2]=4 2303 B7R1.2 OC1CCC(=O)O1 Amb22740957 [0,0,0,0,2,0|0,0,2]=4 2304 B7R1.4 CC=1CCCC1Br Amb24479762 [0,0,0,0,2,0|2,0,0]=4 2305 B7R1.4 CC=1CCCC1C Amb22227705 [0,0,0,0,2,0|2,0,0]=4 2306 B7R1.4 CN1CCCC1=O Amb22493780 [0,0,0,0,2,0|2,0,0]=4 2307 B7R1.4 NC1CCCC1=O Amb17939050 [0,0,0,0,2,0|1,0,1]=4 2308 B7R1.4 O=C1CCBC1=O Amb25186988 [0,0,0,0,2,0|1,0,0]=3 2309 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,0,0,0,2,0|1,0,1]=4 2310 B7R1.4 O=C1CCC=C1Cl Amb24749092 [0,0,0,0,2,0|1,0,1]=4 2311 B7R1.4 O=C1CCC=C1O Amb17593067 [0,0,0,0,2,0|0,0,2]=4 2312 B7R1.4 O=C1CCCC1=C Amb17593061 [0,0,0,0,2,0|1,0,0]=3 2313 B7R1.4 O=C1CCCC1=O Amb24053064 [0,0,0,0,2,0|0,0,0]=2 2314 B7R1.4 O=C1CCCC1Br Amb16234114 [0,0,0,0,2,0|1,0,1]=4 2315 B7R1.4 O=C1CCCC1I Amb25756212 [0,0,0,0,2,0|1,0,1]=4 2316 B7R1.4 O=C1CCCC1O Amb17593081 [0,0,0,0,2,0|0,0,2]=4 2317 B7R1.4 O=C1CCC[C@H]1Br Amb25778341 [0,0,0,0,2,0|1,0,1]=4 2318 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,0,0,0,2,0|1,0,1]=4 2319 B7R1.4 O=C1CCNC1=O Amb21858086 [0,0,0,0,2,0|1,0,0]=3 2320 B7R1.4 O=C1CNCC1=O Amb18639280 [0,0,0,0,2,0|1,0,0]=3 2321 B7R1.4 O=C1COCC1=O Amb25723319 [0,0,0,0,2,0|1,0,0]=3 2322 B7R1.4 O=C1CSCC1=O Amb25249861 [0,0,0,0,2,0|1,0,0]=3 2323 B7R1.4 O=C=1CCCC1Br Amb21927711 [0,0,0,0,2,0|1,0,1]=4 2324 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [0,0,0,0,2,0|0,0,2]=4 2325 B7R1.4 [13CH3]N1[13CH2]CC[13C]1=O Amb22055816 [0,0,0,0,2,0|2,0,0]=4 2326 B9R0.24 CC(CC)=NNC(=O)CC Amb24397815 [0,0,1,0,0,1|2,0,0]=4 2327 B9R0.24 CC(COC(=O)CC)CC Amb24061296 [0,0,1,0,0,1|1,0,1]=4 2328 B9R0.24 CCC(=C)CNC(=O)CC Amb24339353 [0,0,1,0,0,1|2,0,0]=4 2329 B9R0.24 CCC(=O)C#CC(=O)CC Amb25146883 [0,0,1,0,0,1|1,0,0]=3 2330 B9R0.24 CCC(=O)C#CC(=O)OC Amb25042967 [0,0,1,0,0,1|2,0,0]=4 2331 B9R0.24 CCC(=O)CCC(=O)OC Amb24369355 [0,0,1,0,0,1|2,0,0]=4 2332 B9R0.24 CCC(=O)CNC(=O)CC Amb24505115 [0,0,1,0,0,1|1,0,0]=3 2333 B9R0.24 CCC(=O)CNC(=O)CCl Amb24725631 [0,0,1,0,0,1|2,0,0]=4 2334 B9R0.24 CCC(=O)CNC(=O)OC Amb25782037 [0,0,1,0,0,1|2,0,0]=4 2335 B9R0.24 CCC(=O)NNC(=O)CC Amb22347723 [0,0,1,0,0,1|1,0,0]=3 2336 B9R0.24 CCC(=O)NNC(=O)CCl Amb16186696 [0,0,1,0,0,1|2,0,0]=4 2337 B9R0.24 CCC(=O)NNC(=O)CN Amb17334235 [0,0,1,0,0,1|2,0,0]=4 2338 B9R0.24 CCC(=O)NNC(=O)CO Amb24482882 [0,0,1,0,0,1|2,0,0]=4 2339 B9R0.24 CCC(=O)NNC(=O)OC Amb24674682 [0,0,1,0,0,1|2,0,0]=4 2340 B9R0.24 CCC(=O)OCC(=C)CBr Amb24354139 [0,0,1,0,0,1|2,0,0]=4 2341 B9R0.24 CCC(=O)OCC(=O)NC Amb25355366 [0,0,1,0,0,1|1,0,0]=3 2342 B9R0.24 CCC(=O)OCC(F)CC Amb25058063 [0,0,1,0,0,1|1,0,1]=4 2343 B9R0.24 CCC(=O)OCC(O)CC Amb24449905 [0,0,1,0,0,1|0,0,2]=4 2344 B9R0.24 CCC(=O)OC[C@@H](O)CC Amb24481128 [0,0,1,0,0,1|0,0,2]=4 2345 B9R0.24 CCC(=O)OC[C@H](O)CC Amb25259058 [0,0,1,0,0,1|0,0,2]=4 2346 B9R0.24 CCC(=O)\C=C/C(=O)CC Amb24708993 [0,0,1,0,0,1|1,0,0]=3 2347 B9R0.24 CCC(=O)\C=C\C(=C)CC Amb25792622 [0,0,1,0,0,1|2,0,0]=4 2348 B9R0.24 CCC(=O)\C=C\C(=O)OC Amb24617859 [0,0,1,0,0,1|2,0,0]=4 2349 B9R0.24 CCC(N)=NOC(=O)CC Amb24640221 [0,0,1,0,0,1|1,0,0]=3 2350 B9R0.24 CNC(=O)NNC(=O)CC Amb24538945 [0,0,1,0,0,1|2,0,0]=4 2351 B9R0.24 CNC(=O)NOC(=O)NC Amb25266923 [0,0,1,0,0,1|2,0,0]=4 2352 B9R0.24 CNC(=O)ONC(=O)CS Amb24655108 [0,0,1,0,0,1|2,0,0]=4 2353 B9R0.24 COC(=O)COC(=O)CCl Amb24378028 [0,0,1,0,0,1|2,0,0]=4 2354 B9R0.24 COC(=O)OCC(=O)CC Amb25059695 [0,0,1,0,0,1|1,0,0]=3 2355 B9R0.24 COC(=O)OOC(=O)OC Amb22731739 [0,0,1,0,0,1|2,0,0]=4 2356 B9R0.24 C\C(\CBr)=C/OC(=O)CC Amb25082683 [0,0,1,0,0,1|2,0,0]=4 2357 B11R1.144 O=C1CCC(=O)CCCCC1 Amb25830564 [0,0,0,0,0,2|1,0,0]=3 2358 B11R1.144 O=C1CCCCCC(=O)C=C1 Amb25282753 [0,0,0,0,0,2|1,0,0]=3 2359 B11R1.145 C=C1CCCC(=O)CCCC1 Amb25773409 [0,0,0,0,0,2|2,0,0]=4 2360 B11R1.145 O=C1CCCCC(=O)OCC1 Amb25128459 [0,0,0,0,0,2|0,0,0]=2 2361 B11R1.107 C=C1CC(=O)CCCCCC1 Amb24646699 [0,0,0,0,0,2|2,0,0]=4 2362 B11R1.107 CC=1CCCCCCC(=O)C1 Amb25188731 [0,0,0,0,0,2|2,0,0]=4 2363 B11R1.107 O=C1CC(=O)NCCCCC1 Amb25207080 [0,0,0,0,0,2|1,0,0]=3 2364 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [0,0,0,0,0,2|1,0,0]=3