0 B14R1.164 C=C(C)C1CCC(C)CC1NC(N)=O Amb27650566 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.164 C=C(C)C1CCC(C)CC1OC(C)=O Amb6357402 [0,0,0,0,0,0|0,0,2]=2 2 B14R1.164 C=C(C)CC1CC(=O)CCC1C(C)C Amb32865612 [0,0,0,0,0,0|3,0,1]=4 3 B14R1.164 C=C(C)CC1CC(N)CCC1C(C)C Amb32866532 [0,0,0,0,0,0|3,0,0]=3 4 B14R1.164 C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cl Amb33297214 [0,0,0,0,0,0|1,0,2]=3 5 B14R1.164 C=C(Cl)CC1CC(N)CCC1C(C)C Amb32866529 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.164 CC(=O)NC1C=C(C)CC[C@@H]1C(C)C Amb28251103 [0,0,0,0,0,0|1,0,2]=3 7 B14R1.164 CC(=O)N[C@@H]1C[C@H](C)CC[C@@H]1C(C)C Amb27859029 [0,0,0,0,0,0|1,0,0]=1 8 B14R1.164 CC(=O)N[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb28194141 [0,0,0,0,0,0|1,0,0]=1 9 B14R1.164 CC(=O)OC1CC(C)CCC1C(C)C Amb4036823 [0,0,0,0,0,0|0,0,0]=0 10 B14R1.164 CC(=O)O[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C Amb22232055 [0,0,0,0,0,0|0,0,0]=0 11 B14R1.164 CC(=O)O[C@H]1C[C@@H](C)CC[C@@H]1C(C)C Amb6357810 [0,0,0,0,0,0|0,0,0]=0 12 B14R1.164 CC(=O)O[C@H]1C[C@H](C)CC[C@H]1C(C)C Amb22336235 [0,0,0,0,0,0|0,0,0]=0 13 B14R1.164 CC(=O)\C=C1/CC(C)CCC1C(C)C Amb27599676 [0,0,0,0,0,0|1,0,1]=2 14 B14R1.164 CC(C)=C1CC[C@@H](C)C[C@@H]1CC(=O)O Amb27781545 [0,0,0,0,0,0|2,0,2]=4 15 B14R1.164 CC(C)C1CCC(=O)CC1CC(=O)O Amb32865623 [0,0,0,0,0,0|3,0,1]=4 16 B14R1.164 CC(C)CC1CC(N)CCC1C(C)C Amb32866521 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.164 CC(C)NC1CC(O)CCC1C(C)C Amb32867359 [0,0,0,0,0,0|3,0,1]=4 18 B14R1.164 CC(C)N[C@H]1C[C@H](C)CC[C@H]1C(C)C Amb27781468 [0,0,0,0,0,0|2,0,1]=3 19 B14R1.164 CC(C)OC1CC(=O)CCC1C(C)C Amb32867678 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C=C1CC(=O)O Amb27878712 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CC(=O)O Amb27845505 [0,0,0,0,0,0|2,0,0]=2 22 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cl Amb20242385 [0,0,0,0,0,0|1,0,0]=1 23 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(N)=O Amb17844396 [0,0,0,0,0,0|1,0,0]=1 24 B14R1.164 CC(C)[C@@H]1CC[C@H](C)C[C@H]1NC(N)=O Amb27201286 [0,0,0,0,0,0|2,0,0]=2 25 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(N)=O Amb27965003 [0,0,0,0,0,0|2,0,0]=2 26 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)Cl Amb8515451 [0,0,0,0,0,0|1,0,0]=1 27 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@H]1NC(N)=O Amb27966784 [0,0,0,0,0,0|2,0,0]=2 28 B14R1.164 CC1CCC(C(C)C)C(NC(C)C)C1 Amb6685401 [0,0,0,0,0,0|2,0,1]=3 29 B14R1.164 CC1CCC(C(C)C)C(NC(N)=O)C1 Amb25708464 [0,0,0,0,0,0|2,0,0]=2 30 B14R1.164 CC1CCC(C(C)C)C(OB(O)O)C1 Amb6357472 [0,0,0,0,0,0|2,0,1]=3 31 B14R1.164 CC1CCC(C(C)C)C(OC(=O)Cl)C1 Amb17678766 [0,0,0,0,0,0|1,0,0]=1 32 B14R1.164 CC1CCC(C(C)C)C(OC(N)=O)C1 Amb28245329 [0,0,0,0,0,0|1,0,0]=1 33 B14R1.164 CC1CCC(C(C)C)\C(=N\S(C)=O)C1 Amb35684982 [0,0,0,0,0,0|2,0,1]=3 34 B14R1.164 CN1CCC(N(C)C)C(CC(=O)O)C1 Amb18187392 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.356 C=CCC1CC(C)CCC1C(C)C Amb27667057 [1,0,0,0,0,0|1,0,1]=3 36 B13R1.356 C=CCC1CC(N)CCC1C(C)C Amb32866517 [1,0,0,0,0,0|2,0,1]=4 37 B13R1.356 C=COC1CC(C)CCC1C(C)C Amb27771730 [1,0,0,0,0,0|0,0,1]=2 38 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1N=[N+]=[N-] Amb26586304 [1,0,0,0,0,0|3,0,0]=4 39 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CCO Amb28206082 [1,0,0,0,0,0|1,0,2]=4 40 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCCl Amb8515153 [1,0,0,0,0,0|1,0,1]=3 41 B13R1.356 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC=O Amb27233647 [1,0,0,0,0,0|1,0,0]=2 42 B13R1.356 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCCl Amb26896033 [1,0,0,0,0,0|1,0,1]=3 43 B13R1.356 CC(C)[C@H]1CC[C@@H](C)C[C@H]1N=[N+]=[N-] Amb25259169 [1,0,0,0,0,0|3,0,0]=4 44 B13R1.356 CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC=O Amb27816158 [1,0,0,0,0,0|1,0,0]=2 45 B13R1.356 CC(C)[C@H]1CC[C@H](C)CC1NC=S Amb27620364 [1,0,0,0,0,0|1,1,0]=3 46 B13R1.356 CC(C)[C@H]1CC[C@H](C)C[C@H]1NC=O Amb27794375 [1,0,0,0,0,0|1,0,0]=2 47 B13R1.356 CC1CCC(C(C)C)C(CCCl)C1 Amb27873233 [1,0,0,0,0,0|2,0,1]=4 48 B13R1.356 CC1CCC(C(C)C)C(OC=O)C1 Amb10562527 [1,0,0,0,0,0|0,0,0]=1 49 B13R1.356 CC1CCC(C(C)C)C(OCCl)C1 Amb25690513 [1,0,0,0,0,0|1,0,1]=3 50 B13R1.356 CC1CCC(C(C)C)\C(=C\C=O)C1 Amb27210578 [1,0,0,0,0,0|1,0,1]=3 51 B13R1.356 CCCC1CC(N)CCC1C(C)C Amb32866520 [1,0,0,0,0,0|2,0,1]=4 52 B13R1.356 CCNC1CC(O)CCC1C(C)C Amb32867357 [1,0,0,0,0,0|2,0,1]=4 53 B13R1.356 CCNC1C[C@H](C)CC[C@@H]1C(C)C Amb27883158 [1,0,0,0,0,0|1,0,1]=3 54 B13R1.356 CCN[C@@H]1C[C@H](C)CC[C@@H]1C(C)C Amb27215333 [1,0,0,0,0,0|1,0,1]=3 55 B13R1.356 CCN[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb28323063 [1,0,0,0,0,0|1,0,1]=3 56 B13R1.356 CCOC1CC(=O)CCC1C(C)C Amb32867672 [1,0,0,0,0,0|1,0,2]=4 57 B13R1.356 COCC1CC(Br)CCC1C(C)C Amb32866137 [1,0,0,0,0,0|3,0,0]=4 58 B13R1.356 COCC1CC(Cl)CCC1C(C)C Amb32865941 [1,0,0,0,0,0|3,0,0]=4 59 B13R1.356 COCC1CC(N)CCC1C(C)C Amb32866523 [1,0,0,0,0,0|3,0,0]=4 60 B13R1.356 CO\N=C1/C[C@H](C)CC[C@@H]1C(C)C Amb27452250 [1,0,0,0,0,0|2,0,1]=4 61 B13R1.589 CC(=O)NC1CCCCC1N(C)C Amb26375210 [1,0,0,0,0,0|2,0,0]=3 62 B13R1.589 CC(=O)N[C@@H]1CCCC[C@@H]1N(C)C Amb27213883 [1,0,0,0,0,0|2,0,0]=3 63 B13R1.589 CC(=O)OC1CCCCC1C(=O)Cl Amb25222643 [1,0,0,0,0,0|2,0,1]=4 64 B13R1.589 CC(=O)O[C@@H]1CCCC[C@H]1C(=O)Cl Amb27409374 [1,0,0,0,0,0|2,0,1]=4 65 B13R1.589 CC(C)C1CCCCC1CC(=O)O Amb28044620 [1,0,0,0,0,0|2,0,0]=3 66 B13R1.589 CC(C)C1CCCCC1NC(=O)Cl Amb35625911 [1,0,0,0,0,0|2,0,0]=3 67 B13R1.589 CC(C)C1CCCCC1OC(=O)Cl Amb33297334 [1,0,0,0,0,0|1,0,0]=2 68 B13R1.589 CC(C)C1CCCCN1CC(=O)O Amb27208020 [1,0,0,0,0,0|3,0,0]=4 69 B13R1.589 CC(C)C1CCCCN1CC(N)=O Amb27979249 [1,0,0,0,0,0|3,0,0]=4 70 B13R1.589 CC(C)C1CCCC\C1=C/C(=O)O Amb27426985 [1,0,0,0,0,0|2,0,1]=4 71 B13R1.589 CC(C)C1CCCC\C1=N/S(C)=O Amb35722110 [1,0,0,0,0,0|2,0,1]=4 72 B13R1.589 CC(C)C1NCCCC1CC(=O)O Amb27765416 [1,0,0,0,0,0|3,0,0]=4 73 B13R1.589 CC(C)[C@@H]1NCCC[C@H]1CC(=O)O Amb18191312 [1,0,0,0,0,0|3,0,0]=4 74 B13R1.589 CN(C)C1CCCCC1CC(=O)O Amb18822385 [1,0,0,0,0,0|3,0,0]=4 75 B13R1.589 CN(C)C1CCCCC1NC(N)=O Amb25791028 [1,0,0,0,0,0|3,0,0]=4 76 B13R1.589 CN(C)[C@@H]1CCCC[C@H]1NC(N)=O Amb27195426 [1,0,0,0,0,0|3,0,0]=4 77 B13R1.3089 C=C(C)CC1CC(N)CCC1CC Amb32866398 [1,0,0,0,0,0|3,0,0]=4 78 B13R1.3089 CCC1CCC(C)CC1NC(C)C Amb27205976 [1,0,0,0,0,0|2,0,1]=4 79 B13R1.3089 COC1OCC(O)CC1OC(C)=O Amb27415076 [1,0,0,0,0,0|3,0,0]=4 80 B15R1.134 CC(C)C1CCC(N)CC1CS(C)(=O)=O Amb32866542 [0,1,0,0,0,0|3,0,0]=4 81 B15R1.3825 C#CC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb17779643 [0,1,0,0,0,0|0,0,1]=2 82 B15R1.3825 CC1CCC(C(C)C)C(NC(C)CO)C1 Amb9359844 [0,1,0,0,0,0|1,0,2]=4 83 B15R1.3825 CC1CCC(C(C)C)C(OC(=O)CCl)C1 Amb9702660 [0,1,0,0,0,0|0,0,0]=1 84 B15R1.3825 CC1CCC(C(C)C)C(OC(=O)CO)C1 Amb1111301 [0,1,0,0,0,0|0,0,0]=1 85 B15R1.3825 COC(=O)\C=C1\CC(C)CCC1C(C)C Amb26840329 [0,1,0,0,0,0|1,0,1]=3 86 B15R1.8416 CC1CCC(C(C)C)C(C(Br)C(C)C)C1 Amb27765119 [0,1,0,0,0,0|2,0,1]=4 87 B15R1.8416 CC1CCC(C(C)C)C(C(C)C(=O)O)C1 Amb28255943 [0,1,0,0,0,0|2,0,0]=3 88 B15R1.8416 CC1CCC(C(C)C)C(C(Cl)C(C)C)C1 Amb27592510 [0,1,0,0,0,0|2,0,1]=4 89 B15R1.8416 CC1CCC(C(C)C)C(C(F)C(=O)O)C1 Amb27774123 [0,1,0,0,0,0|2,0,0]=3 90 B15R1.8416 CC1CCC(C(C)C)C(C(N)C(=O)O)C1 Amb29890840 [0,1,0,0,0,0|2,0,0]=3 91 B15R1.8438 C=C(C)CC1CC(N)CCC1C(C)(C)C Amb32866471 [0,1,0,0,0,0|3,0,0]=4 92 B15R1.12198 CN(C)C1CCC(C)(C)CC1CC(=O)O Amb18170267 [0,1,0,0,0,0|3,0,0]=4 93 B13R0.1398 CC(=O)OCCC(C)CCC=C(C)C Amb4011988 [0,0,1,0,0,0|0,0,2]=3 94 B15R2.7491 CC1CCC2C(C1)OC(=O)NC2(C)C Amb27596172 [0,0,0,1,0,0|1,0,0]=2 95 B15R2.7491 C[C@@H]1CC[C@H]2[C@H](C1)OC(=O)NC2(C)C Amb27220621 [0,0,0,1,0,0|1,0,0]=2 96 B15R2.7569 CC1CCC(C(C)C)C(NC2CC2)C1 Amb1120311 [0,0,0,1,0,0|2,0,1]=4 97 B15R2.14564 CC(C)C1CCC(C)C2C(C(=O)O)C12 Amb27407854 [0,0,0,1,0,0|2,0,0]=3 98 B15R2.14565 CC(C)[C@H]1CC[C@@H](C)[C@@H]2NC(=O)O[C@@H]21 Amb28319918 [0,0,0,1,0,0|1,0,0]=2 99 B15R2.63030 CC(C)[C@]12CC[C@H](C)C[C@H]1OC(=O)N2 Amb27203350 [0,0,0,1,0,0|1,0,0]=2 100 B15R2.63030 CC1CCC2(C(C)C)NC(=O)OC2C1 Amb27599985 [0,0,0,1,0,0|1,0,0]=2 101 B15R2.68082 CC1(C)[C@@H]2CC[C@@]1(C)CC2SC(=N)N Amb28422748 [0,0,0,1,0,0|2,1,0]=4 102 B15R2.68082 CC12CCC(C(CC(=O)O)C1)C2(C)C Amb23589662 [0,0,0,1,0,0|2,0,0]=3 103 B15R2.68082 CC12CCC(C(SC(=N)[NH3+])C1)C2(C)C Amb32427973 [0,0,0,1,0,0|2,1,0]=4 104 B13R1.165 C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)O Amb28052106 [0,0,0,0,1,0|1,0,2]=4 105 B13R1.165 CC(=O)C1CCC(C)CC1C(=O)O Amb27952088 [0,0,0,0,1,0|2,0,1]=4 106 B13R1.165 CC(=O)N1CC(C)NCC1C(C)C Amb17578363 [0,0,0,0,1,0|2,0,0]=3 107 B13R1.165 CC(C)C1CCC(=O)CC1C(=O)O Amb26627022 [0,0,0,0,1,0|2,0,1]=4 108 B13R1.165 CC(C)C1CCC(=O)CC1C(N)=O Amb32865626 [0,0,0,0,1,0|2,0,1]=4 109 B13R1.165 CC(C)C1CCC(=O)CC1S(C)=O Amb32867684 [0,0,0,0,1,0|2,0,1]=4 110 B13R1.165 CC(C)C1CCC(N)CC1C(=O)O Amb32866538 [0,0,0,0,1,0|2,0,0]=3 111 B13R1.165 CC(C)C1CCC(N)CC1C(C)C Amb32866522 [0,0,0,0,1,0|2,0,1]=4 112 B13R1.165 CC(C)C1CCC(O)CC1C(=O)O Amb32867812 [0,0,0,0,1,0|2,0,0]=3 113 B13R1.165 CC(C)C1CCC(O)CC1N(C)C Amb32867351 [0,0,0,0,1,0|3,0,0]=4 114 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)CC1C(=O)O Amb27630689 [0,0,0,0,1,0|1,0,0]=2 115 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)Cl Amb24602894 [0,0,0,0,1,0|1,0,0]=2 116 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)O Amb22169743 [0,0,0,0,1,0|1,0,0]=2 117 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(N)=O Amb25233002 [0,0,0,0,1,0|1,0,0]=2 118 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[SiH](C)C Amb27625658 [0,0,0,0,1,0|1,1,0]=3 119 B13R1.165 CC(C)[C@H]1CCC(=O)C[C@@H]1C(=O)O Amb27423210 [0,0,0,0,1,0|2,0,1]=4 120 B13R1.165 CC(C)[C@H]1CC[C@H](C)C[C@@H]1C(=O)O Amb27637667 [0,0,0,0,1,0|1,0,0]=2 121 B13R1.165 CC1CCC(C(C)C)C(C(=O)Cl)C1 Amb28436127 [0,0,0,0,1,0|1,0,0]=2 122 B13R1.165 CC1CCC(C(C)C)C(C(=O)O)C1 Amb18318870 [0,0,0,0,1,0|1,0,0]=2 123 B13R1.165 CC1CCC(C(C)C)C(C(C)Br)C1 Amb28126154 [0,0,0,0,1,0|1,0,1]=3 124 B13R1.165 CC1CCC(C(C)C)C(C(C)N)C1 Amb27253673 [0,0,0,0,1,0|1,0,1]=3 125 B13R1.165 CC1CCC(C(C)C)C(N(C)C)C1 Amb17689172 [0,0,0,0,1,0|2,0,0]=3 126 B13R1.165 CC1CCC(C(C)C)C([SiH](C)C)C1 Amb27794777 [0,0,0,0,1,0|1,1,0]=3 127 B13R1.165 CN1CCC(N(C)C)C(C(=O)O)C1 Amb18822006 [0,0,0,0,1,0|3,0,0]=4 128 B15R1.8435 C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)O Amb32946454 [0,0,0,0,0,1|1,0,2]=4 129 B15R1.8435 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)O Amb34146162 [0,0,0,0,0,1|1,0,0]=2 130 B15R1.8435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)O Amb3428604 [0,0,0,0,0,1|1,0,0]=2 131 B15R1.8435 CC(C)[C@H]1CC[C@H](C)C[C@@H]1OCC(=O)O Amb3939941 [0,0,0,0,0,1|1,0,0]=2 132 B15R1.8435 CC(O)CNC1CC(C)CCC1C(C)C Amb9246030 [0,0,0,0,0,1|1,0,2]=4 133 B15R1.8435 CC1CCC(C(C)C)C(OCC(=O)Cl)C1 Amb16233700 [0,0,0,0,0,1|1,0,0]=2 134 B15R1.8435 CC1CCC(C(C)C)C(OCC(=O)O)C1 Amb270382 [0,0,0,0,0,1|1,0,0]=2 135 B15R1.8435 CC1CCC(C(C)C)\C(=N/NC(N)=O)C1 Amb21947900 [0,0,0,0,0,1|2,0,1]=4 136 B12R0.268 CC(C)CCCCCCCC(=O)O Amb24117911 [1,0,1,0,0,0|2,0,0]=4 137 B12R1.57 C#C[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb25912102 [2,0,0,0,0,0|0,0,2]=4 138 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C=C1C=O Amb27489045 [2,0,0,0,0,0|0,0,2]=4 139 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)CC1CO Amb28422711 [2,0,0,0,0,0|0,0,2]=4 140 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)CC1NN Amb28250901 [2,0,0,0,0,0|2,0,0]=4 141 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C#N Amb28247928 [2,0,0,0,0,0|1,0,1]=4 142 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C=O Amb27880581 [2,0,0,0,0,0|0,0,0]=2 143 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C=O Amb24513203 [2,0,0,0,0,0|0,0,0]=2 144 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CO Amb26388874 [2,0,0,0,0,0|0,0,2]=4 145 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1ON Amb27471879 [2,0,0,0,0,0|1,0,0]=3 146 B12R1.57 CC(C)[C@H]1CC[C@@H](C)C[C@H]1C#N Amb25259156 [2,0,0,0,0,0|1,0,1]=4 147 B12R1.57 CC(C)[C@H]1CC[C@@H](C)C\C1=C/Cl Amb27444643 [2,0,0,0,0,0|1,0,1]=4 148 B12R1.57 CC(C)[C@H]1CC[C@H](C)CC1CO Amb27423282 [2,0,0,0,0,0|0,0,2]=4 149 B12R1.57 CC1=CC[C@@H](C(C)C)[C@H](C=O)C1 Amb27493436 [2,0,0,0,0,0|0,0,2]=4 150 B12R1.57 CC1CCC(C(C)C)C(C#N)C1 Amb8950072 [2,0,0,0,0,0|1,0,1]=4 151 B12R1.57 CC1CCC(C(C)C)C(CN)C1 Amb10610272 [2,0,0,0,0,0|1,0,1]=4 152 B12R1.57 CC1CCC(C(C)C)C(CN)C1 Amb8950170 [2,0,0,0,0,0|1,0,1]=4 153 B12R1.57 CC1CCC(C(C)C)C(NO)C1 Amb26855320 [2,0,0,0,0,0|1,0,1]=4 154 B12R1.57 CC1CCC(C(C)C)\C(=C\Cl)C1 Amb28121184 [2,0,0,0,0,0|1,0,1]=4 155 B12R1.57 CCC1CC(N)CCC1C(C)C Amb32866530 [2,0,0,0,0,0|1,0,1]=4 156 B12R1.57 CNC1CC(O)CCC1C(C)C Amb32867356 [2,0,0,0,0,0|2,0,0]=4 157 B12R1.57 CNC1C[C@H](C)CC[C@@H]1C(C)C Amb27432050 [2,0,0,0,0,0|1,0,0]=3 158 B12R1.57 CN[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C Amb27629638 [2,0,0,0,0,0|1,0,0]=3 159 B12R1.57 CN[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb27623247 [2,0,0,0,0,0|1,0,0]=3 160 B12R1.57 COC1CC(=O)CCC1C(C)C Amb32867676 [2,0,0,0,0,0|1,0,1]=4 161 B12R1.57 CO[C@@H]1CC(C)=CC[C@H]1C(C)C Amb27880404 [2,0,0,0,0,0|0,0,2]=4 162 B12R1.283 CN(C)[C@@H]1CCCC[C@H]1NC=O Amb27814166 [2,0,0,0,0,0|2,0,0]=4 163 B12R1.283 CN(C)[C@H]1CCCC[C@H]1NC=O Amb27194325 [2,0,0,0,0,0|2,0,0]=4 164 B12R1.75 CC(=O)NC1CCCCC1CN Amb27257787 [2,0,0,0,0,0|2,0,0]=4 165 B12R1.75 CC(=O)NC1CCCCC1CO Amb27868462 [2,0,0,0,0,0|2,0,0]=4 166 B12R1.75 CC(=O)N[C@H]1CCCC[C@H]1CO Amb28428478 [2,0,0,0,0,0|2,0,0]=4 167 B12R1.75 CC(=O)OC1CCCCC1C=O Amb18647323 [2,0,0,0,0,0|1,0,1]=4 168 B12R1.75 CC(=O)O[C@H]1CCCC[C@@H]1CO Amb27420620 [2,0,0,0,0,0|1,0,0]=3 169 B12R1.75 CC(=S)OC1CCCCC1CO Amb28065110 [2,0,0,0,0,0|1,1,0]=4 170 B12R1.75 CC(=S)O[C@H]1CCCC[C@@H]1CO Amb28255711 [2,0,0,0,0,0|1,1,0]=4 171 B12R1.75 CCC1CCCCC1CC(=O)O Amb25152261 [2,0,0,0,0,0|2,0,0]=4 172 B12R1.75 CCC1CCCCC1CC(C)=O Amb27495385 [2,0,0,0,0,0|1,0,0]=3 173 B12R1.75 CCC1CCCCC1NC(=O)Cl Amb35625776 [2,0,0,0,0,0|2,0,0]=4 174 B12R1.75 CCC1CCCCC1OC(=O)Cl Amb27181224 [2,0,0,0,0,0|1,0,0]=3 175 B12R1.75 CCC1CCCCC1OC(C)=O Amb27766398 [2,0,0,0,0,0|0,0,0]=2 176 B12R1.75 CCC1CCNCC1NC(C)=O Amb32677496 [2,0,0,0,0,0|2,0,0]=4 177 B12R1.75 CO[C@@H]1CCCC[C@@H]1NC(C)=O Amb28074111 [2,0,0,0,0,0|2,0,0]=4 178 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)=O Amb27956180 [2,0,0,0,0,0|2,0,0]=4 179 B12R1.75 CSC1CCCCC1NC(C)=O Amb28067814 [2,0,0,0,0,0|2,0,0]=4 180 B12R1.75 NCC1CCCCC1OC(N)=O Amb28195875 [2,0,0,0,0,0|2,0,0]=4 181 B12R1.127 CC(=O)NC1CC(C)CCC1O Amb28243942 [2,0,0,0,0,0|2,0,0]=4 182 B12R1.127 CC(=O)NC1CC(C)CNC1C Amb29867207 [2,0,0,0,0,0|2,0,0]=4 183 B12R1.127 CC(=O)NC1CC(C)SCC1C Amb25359911 [2,0,0,0,0,0|2,0,0]=4 184 B12R1.127 CC(=O)NC1CC(Cl)CCC1C Amb4010861 [2,0,0,0,0,0|2,0,0]=4 185 B12R1.127 CC(=O)N[C@@H]1CC(C)CC[C@H]1O Amb27454952 [2,0,0,0,0,0|2,0,0]=4 186 B12R1.127 CC(=O)O[C@@H]1CC(C)CC[C@@H]1O Amb27443595 [2,0,0,0,0,0|1,0,0]=3 187 B12R1.127 CC(=O)O[C@@H]1C[C@H](C)CCC1=O Amb27620363 [2,0,0,0,0,0|1,0,1]=4 188 B12R1.127 CC1CCC(C)C(CC(=O)O)C1 Amb25793973 [2,0,0,0,0,0|2,0,0]=4 189 B12R1.127 CC1CCC(C)C(OC(=O)Cl)C1 Amb33297337 [2,0,0,0,0,0|1,0,0]=3 190 B14R0.304 CCC(=O)OCCC(C)CCC=C(C)C Amb4016541 [0,1,1,0,0,0|0,0,2]=4 191 B14R1.440 CCNC1CC(C)CCC1C(C)(C)C Amb27228571 [1,1,0,0,0,0|1,0,1]=4 192 B14R1.440 CCOC1CC(C)CCC1C(C)(C)O Amb25951253 [1,1,0,0,0,0|0,0,1]=3 193 B14R1.707 CCC(Cl)C1CC(C)CCC1C(C)C Amb27162723 [1,1,0,0,0,0|1,0,1]=4 194 B14R1.707 CCC(N)C1CC(C)CCC1C(C)C Amb27459579 [1,1,0,0,0,0|1,0,1]=4 195 B14R1.707 CNC(=O)C1CC(C)CCC1C(C)C Amb27759343 [1,1,0,0,0,0|2,0,0]=4 196 B14R1.760 CC1CCC(C(C)C)C(\C=C\C=O)C1 Amb28253900 [1,1,0,0,0,0|1,0,0]=3 197 B14R1.760 CC1CCC(C(C)C)\C(=C\CC=O)C1 Amb27640601 [1,1,0,0,0,0|1,0,1]=4 198 B14R1.14833 CC(C)[C@H]1CC[C@H](C)C(=O)C1CC=O Amb27789871 [1,1,0,0,0,0|1,0,1]=4 199 B14R1.17362 C=CC[C@]1(O)C[C@H](C)CC[C@H]1C(C)C Amb20242996 [1,1,0,0,0,0|1,0,1]=4 200 B14R1.17362 CC#CC1(O)CC(C)CCC1C(C)C Amb27393428 [1,1,0,0,0,0|1,0,1]=4 201 B14R1.17362 CC1CCC(C(C)C)C(O)(CC=O)C1 Amb27755999 [1,1,0,0,0,0|1,0,0]=3 202 B14R1.429 CC(C)C1CCCCC1C(F)C(=O)O Amb27836947 [1,1,0,0,0,0|2,0,0]=4 203 B14R1.429 CC(C)C1CCCCC1C(N)C(=O)O Amb35663201 [1,1,0,0,0,0|2,0,0]=4 204 B14R1.815 CC(=O)CC1CCCCC1C(C)(C)C Amb27958998 [1,1,0,0,0,0|1,0,0]=3 205 B14R1.815 CC(=O)OC1CCCCC1C(C)(C)C Amb3372044 [1,1,0,0,0,0|0,0,0]=2 206 B14R1.815 CC(=O)O[C@@H]1CCCC[C@@H]1C(C)(C)C Amb27881831 [1,1,0,0,0,0|0,0,0]=2 207 B14R1.815 CC(=O)O[C@@H]1CCCC[C@H]1C(C)(C)C Amb26055295 [1,1,0,0,0,0|0,0,0]=2 208 B14R1.3302 C#CC(=O)NC1CCCCC1C(C)C Amb35694326 [1,1,0,0,0,0|1,0,1]=4 209 B14R1.3302 C=CC(=O)NC1CCCCC1C(C)C Amb27585768 [1,1,0,0,0,0|1,0,1]=4 210 B14R1.3302 CC(C)C1CCCCC1NC(=O)CCl Amb27968355 [1,1,0,0,0,0|1,0,0]=3 211 B14R1.3302 CC(C)C1CCCCC1NC(=O)CS Amb27612794 [1,1,0,0,0,0|1,0,0]=3 212 B14R1.3302 CCC(=N)NC1CCCCC1C(C)C Amb27971999 [1,1,0,0,0,0|2,0,0]=4 213 B14R1.3302 CCC(=O)NC1CCCCC1C(C)C Amb27612749 [1,1,0,0,0,0|1,0,0]=3 214 B14R1.3302 CNC(=N)NC1CCCCC1C(C)C Amb27591840 [1,1,0,0,0,0|2,0,0]=4 215 B14R1.3302 CNC(=O)NC1CCCCC1C(C)C Amb27183102 [1,1,0,0,0,0|1,0,0]=3 216 B14R1.3302 COC(=O)NC1CCCCC1C(C)O Amb27169162 [1,1,0,0,0,0|2,0,0]=4 217 B14R1.3302 COC(=O)N[C@H]1CCCC[C@@H]1N(C)C Amb28287722 [1,1,0,0,0,0|2,0,0]=4 218 B14R1.6312 CC(C)C1CCCCC1NS(C)(=N)=O Amb29851584 [1,1,0,0,0,0|2,0,0]=4 219 B14R1.6721 CCCC1CCC(C)CC1NC(C)=O Amb27413634 [1,1,0,0,0,0|1,0,0]=3 220 B14R1.104 CNC1CCC(C(C)C)C(C(=O)O)C1 Amb32866796 [0,1,0,0,1,0|1,0,0]=3 221 B14R1.104 CNC1CCC(C(C)C)C(C(C)C)C1 Amb32866788 [0,1,0,0,1,0|1,0,1]=4 222 B14R1.1126 CC1CCN(C(C)CO)C(C(=O)O)C1 Amb27658704 [0,1,0,0,1,0|2,0,0]=4 223 B14R1.6044 CC(C)C1CCC(O)CC1S(C)(=O)=O Amb32790995 [0,1,0,0,1,0|2,0,0]=4 224 B14R1.6044 CC1CCC(C(C)C)C(S(=O)(=O)Cl)C1 Amb28143757 [0,1,0,0,1,0|2,0,0]=4 225 B14R1.6044 CC1CCC(C(C)C)C(S(=O)(=O)F)C1 Amb33352196 [0,1,0,0,1,0|2,0,0]=4 226 B14R1.6044 CC1CCC(C(C)C)C(S(N)(=O)=O)C1 Amb24344984 [0,1,0,0,1,0|2,0,0]=4 227 B14R1.6051 CC(C)(C)C1CCC(N)CC1C(=O)O Amb32866477 [0,1,0,0,1,0|2,0,0]=4 228 B14R1.6051 CC(C)(C)C1CCC(O)CC1C(=O)O Amb32867809 [0,1,0,0,1,0|2,0,0]=4 229 B14R1.6064 C=C(C)C1(O)CC(C)CCC1C(C)C Amb27393288 [0,1,0,0,1,0|1,0,0]=3 230 B14R1.6064 CC(C)[C@@H]1CC[C@@H](C)CC1(O)C(C)N Amb27632380 [0,1,0,0,1,0|1,0,1]=4 231 B14R1.6064 CC(C)[C@@H]1CC[C@@H](C)C[C@@]1(N)C(=O)O Amb24649824 [0,1,0,0,1,0|1,0,0]=3 232 B14R1.6064 CC1CCC(C(C)C)C(C)(C(=O)O)C1 Amb32654888 [0,1,0,0,1,0|1,0,0]=3 233 B14R1.6064 CC1CCC(C(C)C)C(N)(C(=O)O)C1 Amb4134831 [0,1,0,0,1,0|1,0,0]=3 234 B14R1.6064 CC1CCC(C(C)C)C(N)(C(N)=O)C1 Amb19055443 [0,1,0,0,1,0|1,0,0]=3 235 B14R1.6064 CC1CCC(C(C)C)C(O)(C(C)C)C1 Amb9675862 [0,1,0,0,1,0|1,0,1]=4 236 B14R1.6064 CC1CCC(C(C)C)C(O)(C(C)N)C1 Amb27967205 [0,1,0,0,1,0|1,0,1]=4 237 B16R1.1302 CC1CCC(C(C)C)C(OCC(O)CO)C1 Amb24061577 [0,1,0,0,0,1|0,0,2]=4 238 B16R1.1302 COC(=O)COC1CC(C)CCC1C(C)C Amb9203875 [0,1,0,0,0,1|0,0,0]=2 239 B16R1.11435 CC(=O)C(=O)OC1CC(C)CCC1C(C)C Amb22546812 [0,1,0,0,0,1|0,0,0]=2 240 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@@H](C)O Amb2718735 [0,1,0,0,0,1|0,0,2]=4 241 B16R1.11435 CC1CCC(C(C)C)C(OC(=O)C(C)O)C1 Amb1953961 [0,1,0,0,0,1|0,0,2]=4 242 B16R1.10287 CC1CCC(C(C)C)C(OC(C)(C)CBr)C1 Amb33348289 [0,2,0,0,0,0|1,0,1]=4 243 B16R1.10287 CC1CCC(C(C)C)C(OC(C)(C)CI)C1 Amb33348468 [0,2,0,0,0,0|1,0,1]=4 244 B16R1.1519 CC1CCC(C(C)C)C(OC(=O)CC#N)C1 Amb2386150 [0,2,0,0,0,0|0,0,0]=2 245 B16R1.1519 CCOC(=O)\C=C1\CC(C)CCC1C(C)C Amb33493122 [0,2,0,0,0,0|1,0,1]=4 246 B14R1.19575 CCC(C)CC1=CC(=O)CC(C)(C)C1 Amb28124146 [0,0,1,1,0,0|1,0,1]=4 247 B14R1.23183 CC(C)CC1CC(C)(CO)NC(=O)O1 Amb27596165 [0,0,1,1,0,0|2,0,0]=4 248 B14R1.6325 CC(=O)\C=C1/CCCCCC1C(C)C Amb35734057 [0,0,1,1,0,0|1,0,1]=4 249 B14R1.6325 CC(C)C1CCCCCC1CC(=O)O Amb29865071 [0,0,1,1,0,0|2,0,0]=4 250 B14R1.327 CC(=O)CN(C)C1CCCCCC1C Amb35681313 [0,0,1,1,0,0|2,0,0]=4 251 B14R1.5977 CC(=O)CCC1C(C)CCCC1(C)C Amb22734102 [0,0,1,1,0,0|1,0,0]=3 252 B14R1.5977 CC(=O)\C=C\C1C(C)CCCC1(C)C Amb26401979 [0,0,1,1,0,0|1,0,1]=4 253 B14R1.5977 C[C@H]1CCCC(C)(C)[C@@H]1CCC(=O)O Amb28245342 [0,0,1,1,0,0|2,0,0]=4 254 B14R1.6385 CC1(C)CCCC(CCCC(=O)O)C1 Amb33226602 [0,0,1,1,0,0|2,0,0]=4 255 B14R2.4640 C[C@@H]1CC[C@@H]2[C@@H](C1)OCSC2(C)C Amb27654045 [1,0,0,1,0,0|0,1,1]=4 256 B14R2.4646 CC1CCC2C(=CC(=O)C2(C)C)C1 Amb27227074 [1,0,0,1,0,0|1,0,1]=4 257 B14R2.6942 CCN[C@@H]1C[C@H](C)C2CC1C2(C)C Amb27252268 [1,0,0,1,0,0|1,0,1]=4 258 B14R2.29365 CC1CCC2C(=CC(=O)CC2C)C1 Amb27948745 [1,0,0,1,0,0|1,0,1]=4 259 B14R2.40991 CC1CCC(C(C)C)C2(CCN2)C1 Amb28430585 [1,0,0,1,0,0|1,0,1]=4 260 B14R2.7787 CC(=O)N[C@H]1[C@H]2CCC[C@@H]1C[C@@H]2C Amb28060180 [1,0,0,1,0,0|1,0,0]=3 261 B14R2.8189 CC1(C)NC(=S)O[C@H]2CCCC[C@H]21 Amb27775932 [1,0,0,1,0,0|1,1,0]=4 262 B14R2.9577 CC(=N)NC1CCCCC1C2CC2 Amb35661863 [1,0,0,1,0,0|2,0,0]=4 263 B14R2.9577 CC(=O)NC1CCCCC1C2CC2 Amb35603621 [1,0,0,1,0,0|1,0,0]=3 264 B14R2.9577 CC(=O)\C=C1\CCCCC1C2CC2 Amb35676101 [1,0,0,1,0,0|1,0,1]=4 265 B14R2.9577 NC(=O)NC1CCCCC1C2CC2 Amb29853830 [1,0,0,1,0,0|2,0,0]=4 266 B14R2.9577 O=C(Cl)NC1CCCCC1C2CC2 Amb35633548 [1,0,0,1,0,0|2,0,0]=4 267 B14R2.9577 O=C(O)CC1CCCCC1C2CC2 Amb35661933 [1,0,0,1,0,0|2,0,0]=4 268 B14R2.30981 CC(=O)OC1CCCC2C1C2(Cl)Cl Amb27492778 [1,0,0,1,0,0|2,0,0]=4 269 B14R2.31793 CC(=O)CC1CCC2CC1C2(C)C Amb33481157 [1,0,0,1,0,0|1,0,0]=3 270 B14R2.31793 CC(=O)CC1CC[C@H]2C[C@@H]1C2(C)C Amb33198232 [1,0,0,1,0,0|1,0,0]=3 271 B14R2.31793 CC(=O)OC1=CCC2CC1C2(C)C Amb4014253 [1,0,0,1,0,0|0,0,2]=4 272 B14R2.31793 CC1(C)C2CCC(CC(=O)O)C1C2 Amb26080185 [1,0,0,1,0,0|2,0,0]=4 273 B14R2.31793 CC1(C)C2CCC(NC(=O)Cl)C1C2 Amb35633332 [1,0,0,1,0,0|2,0,0]=4 274 B14R2.31793 CC1(C)C2CCC(NC(N)=O)C1C2 Amb27785977 [1,0,0,1,0,0|2,0,0]=4 275 B14R2.31793 CC1(C)[C@H]2CCC(CC(=O)O)[C@@H]1C2 Amb33198249 [1,0,0,1,0,0|2,0,0]=4 276 B14R2.5653 CC(=O)OC1C2CCC(O)C1CC2 Amb27632832 [1,0,0,1,0,0|1,0,0]=3 277 B14R2.5653 CC(=O)O[C@@H]1[C@H]2CC[C@@H]1CC[C@H]2O Amb27422615 [1,0,0,1,0,0|1,0,0]=3 278 B14R2.5653 CC(=O)O[C@H]1[C@@H]2CC[C@H](O)[C@H]1CC2 Amb28350053 [1,0,0,1,0,0|1,0,0]=3 279 B14R2.14141 CCC12CCC(CC1NC(C)=O)C2 Amb27234670 [1,0,0,1,0,0|1,0,0]=3 280 B14R2.4643 C[C@@H]1CC[C@@H]2[C@H](C1)C(=S)NC2(C)C Amb27783327 [0,0,0,1,1,0|1,1,0]=4 281 B14R2.4643 C[C@@H]1CC[C@H]2[C@H](C1)C(=S)NC2(C)C Amb27469722 [0,0,0,1,1,0|1,1,0]=4 282 B14R2.5774 CC1=CCC2COC(C(C)C)C1C2 Amb3360871 [0,0,0,1,1,0|2,0,0]=4 283 B14R2.5774 CC1=CC[C@H]2COC(C(C)C)[C@@H]1C2 Amb537484 [0,0,0,1,1,0|2,0,0]=4 284 B14R2.6130 CC(=O)C1C=C(C)CC2C1C2(C)C Amb28366772 [0,0,0,1,1,0|0,0,2]=4 285 B14R2.7890 CC1=C[C@@H]2C(=O)C[C@H]1C[C@@H]2C(C)C Amb28052585 [0,0,0,1,1,0|0,0,2]=4 286 B14R2.8664 CC1=CCC(C(C)C)C2C(=O)CC12 Amb28381280 [0,0,0,1,1,0|0,0,2]=4 287 B14R2.8751 C=C1CC[C@@H]2[C@@H](C)CCC(=O)[C@H]2C1 Amb27630512 [0,0,0,1,1,0|0,0,2]=4 288 B14R2.8751 CC1CCC2=C(C1)C(=O)CCC2C Amb27256489 [0,0,0,1,1,0|0,0,2]=4 289 B14R2.31378 CC(C)C1CC2CC2CC1C(=O)O Amb33230270 [0,0,0,1,1,0|1,0,0]=3 290 B14R2.62308 CC(=O)C1=CC2(C)CCC1C2(C)C Amb27861388 [0,0,0,1,1,0|0,0,2]=4 291 B14R2.62308 CC1(C)[C@@H]2CC[C@@]1(C)C[C@@H]2C(=O)O Amb27876040 [0,0,0,1,1,0|1,0,0]=3 292 B14R2.62308 CC1(C)[C@@H]2CC[C@]1(C)C[C@@H]2C(=O)O Amb27858684 [0,0,0,1,1,0|1,0,0]=3 293 B14R2.62308 CC12CCC(C(C(=O)O)C1)C2(C)C Amb17778084 [0,0,0,1,1,0|1,0,0]=3 294 B14R2.8683 CC1CCC2C(O)CCC(=O)CC12 Amb27415399 [0,0,0,1,1,0|2,0,0]=4 295 B14R2.8683 C[C@@H]1CC[C@H]2[C@H](O)CCC(=O)C[C@H]12 Amb27420423 [0,0,0,1,1,0|2,0,0]=4 296 B16R2.45634 CC1CCC(C(C)C)C2(CC(=O)CO2)C1 Amb35722263 [0,0,0,1,0,1|0,0,0]=2 297 B16R2.179899 CC(=O)OCC1CC2(C)CCC1C2(C)C Amb17778096 [0,0,0,1,0,1|0,0,0]=2 298 B16R3.471042 CC1(C)C2CCC1(C)C3NC(=O)NC23 Amb17777954 [0,0,0,2,0,0|2,0,0]=4 299 B16R3.471042 CC1(C)C2CCC1(C)C3OC(=O)NC23 Amb28285857 [0,0,0,2,0,0|2,0,0]=4 300 B16R3.471042 CC1(C)[C@@H]2CC[C@@]1(C)C3NC(=O)NC32 Amb27790216 [0,0,0,2,0,0|2,0,0]=4 301 B16R3.471042 CC1(C)[C@H]2CC[C@@]1(C)[C@H]3OC(=O)N[C@@H]23 Amb27452433 [0,0,0,2,0,0|2,0,0]=4 302 B16R3.471042 CC1(C)[C@H]2CC[C@]1(C)[C@@H]3NC(=O)C[C@H]23 Amb27206622 [0,0,0,2,0,0|2,0,0]=4 303 B16R3.471042 CC1(C)[C@H]2CC[C@]1(C)[C@@H]3OC(=O)N[C@@H]32 Amb28069643 [0,0,0,2,0,0|2,0,0]=4 304 B12R1.276 CCOC1OC(C)CC1C(C)C Amb27486210 [1,0,0,0,1,0|1,0,1]=4 305 B12R1.489 CC(C)[C@H]1CC[C@@H](C)\C1=C/C=O Amb25915059 [1,0,0,0,1,0|1,0,1]=4 306 B12R1.489 CC1CCC(C(C)C)\C1=C\C=O Amb27256400 [1,0,0,0,1,0|1,0,1]=4 307 B12R1.261 C=C(C)C1CCCCC1C(C)=O Amb27176038 [1,0,0,0,1,0|0,0,2]=4 308 B12R1.261 CC(=O)C1CCCC=C1C(C)C Amb27178038 [1,0,0,0,1,0|0,0,2]=4 309 B12R1.261 CC(=O)C1CCCCC1C(C)=O Amb28397272 [1,0,0,0,1,0|1,0,1]=4 310 B12R1.261 CC(=O)N1CCCCC1C(C)C Amb27806330 [1,0,0,0,1,0|1,0,0]=3 311 B12R1.261 CC(=O)N1CCCCC1C(C)O Amb27970713 [1,0,0,0,1,0|2,0,0]=4 312 B12R1.261 CC(=O)N1CCNCC1C(C)C Amb17578203 [1,0,0,0,1,0|2,0,0]=4 313 B12R1.261 CC(=O)[C@@H]1CCCC[C@H]1C(C)C Amb27420186 [1,0,0,0,1,0|0,0,0]=2 314 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1C(C)=O Amb27789988 [1,0,0,0,1,0|1,0,1]=4 315 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1[C@@H](C)O Amb27253580 [1,0,0,0,1,0|1,0,0]=3 316 B12R1.261 CC(C)C1CCCCC1C(C)Br Amb27875551 [1,0,0,0,1,0|1,0,1]=4 317 B12R1.261 CC(C)C1CCNCC1C(=O)O Amb18198521 [1,0,0,0,1,0|2,0,0]=4 318 B12R1.261 CC(C)C1OCCCC1C(=O)O Amb25311827 [1,0,0,0,1,0|2,0,0]=4 319 B12R1.261 CC(C)C1OCCCC1C(N)=O Amb27485445 [1,0,0,0,1,0|2,0,0]=4 320 B12R1.261 CC(C)N1CCCCC1C(=O)O Amb33551648 [1,0,0,0,1,0|2,0,0]=4 321 B12R1.261 CC(C)N1CCCCC1C(=O)O Amb9299682 [1,0,0,0,1,0|2,0,0]=4 322 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O Amb13886258 [1,0,0,0,1,0|2,0,0]=4 323 B12R1.261 CC(C)[C@@H]1CNCC[C@@H]1C(=O)O Amb35788318 [1,0,0,0,1,0|2,0,0]=4 324 B12R1.261 CC(C)[C@@H]1CNCC[C@@H]1C(=O)O Amb35788451 [1,0,0,0,1,0|2,0,0]=4 325 B12R1.261 CC(C)[C@@H]1NCCC[C@H]1C(=O)O Amb18198546 [1,0,0,0,1,0|2,0,0]=4 326 B12R1.261 CC(C)[C@@H]1OCCC[C@@H]1C(=O)O Amb25374170 [1,0,0,0,1,0|2,0,0]=4 327 B12R1.261 CC(C)[C@@H]1OCCC[C@H]1C(=O)O Amb26945477 [1,0,0,0,1,0|2,0,0]=4 328 B12R1.261 CC(C)[C@H]1NCCC[C@@H]1C(=O)O Amb27420236 [1,0,0,0,1,0|2,0,0]=4 329 B12R1.261 CN(C)C1CCCCC1C(=O)O Amb18288576 [1,0,0,0,1,0|2,0,0]=4 330 B12R1.261 CN(C)[C@H]1CCCC[C@@H]1C(=O)O Amb27459775 [1,0,0,0,1,0|2,0,0]=4 331 B12R1.261 CN(C)[C@H]1CCCC[C@H]1C(=O)O Amb5722358 [1,0,0,0,1,0|2,0,0]=4 332 B12R1.392 CC(=O)C[C@@H]1COC[C@@H]1C(C)C Amb27844314 [1,0,0,0,1,0|2,0,0]=4 333 B12R1.392 CC(=O)NC1CNCC1C(C)C Amb28208328 [1,0,0,0,1,0|2,0,0]=4 334 B12R1.392 CC(=O)NC1COCC1C(C)C Amb35633022 [1,0,0,0,1,0|2,0,0]=4 335 B12R1.392 CC(=O)N[C@H]1CCC[C@@H]1N(C)C Amb28064980 [1,0,0,0,1,0|2,0,0]=4 336 B12R1.392 CC(=O)OC1CCCC1C(C)=O Amb26546008 [1,0,0,0,1,0|1,0,1]=4 337 B12R1.392 CC(=O)OC1COCC1N(C)C Amb24484090 [1,0,0,0,1,0|2,0,0]=4 338 B12R1.46 CCC1CCC(C)NC1C(=O)O Amb33072388 [1,0,0,0,1,0|2,0,0]=4 339 B12R1.46 CCC1CCC(N)CC1C(=O)O Amb32866426 [1,0,0,0,1,0|2,0,0]=4 340 B12R1.46 CCC1CCC(O)CC1C(=O)O Amb32867808 [1,0,0,0,1,0|2,0,0]=4 341 B12R1.46 CCC1COC(C)CN1C(C)=O Amb27589319 [1,0,0,0,1,0|2,0,0]=4 342 B12R1.46 CCC1NCC(C)CC1C(=O)O Amb27218515 [1,0,0,0,1,0|2,0,0]=4 343 B12R1.46 CCN1CCC(C)CC1C(N)=O Amb27650103 [1,0,0,0,1,0|2,0,0]=4 344 B12R1.46 CNC1CCC(C)CC1S(C)=O Amb27426603 [1,0,0,0,1,0|2,0,0]=4 345 B12R1.498 CC(=O)C1C(C)CCC1C(C)C Amb17777984 [0,0,0,0,2,0|0,0,0]=2 346 B12R1.498 CC(=O)[C@H]1C(=C(C)C)CC[C@@H]1C Amb28321903 [0,0,0,0,2,0|0,0,2]=4 347 B12R1.498 CC(C)C1CCC(C)C1C(=O)O Amb17777979 [0,0,0,0,2,0|1,0,0]=3 348 B12R1.498 CC(C)C1CCC(C)C1C(N)=O Amb28458540 [0,0,0,0,2,0|1,0,0]=3 349 B12R1.498 CC(C)[C@H]1CC[C@@H](C)[C@H]1C(=O)O Amb27419958 [0,0,0,0,2,0|1,0,0]=3 350 B12R1.498 CC(C)[C@H]1CC[C@H](C)[C@H]1C(=O)O Amb27637689 [0,0,0,0,2,0|1,0,0]=3 351 B12R1.498 CC(O)[C@@H]1CC[C@@H](C)[C@H]1C(=O)O Amb27863513 [0,0,0,0,2,0|2,0,0]=4 352 B12R1.850 CC(C)[C@@H]1CN(C)C[C@H]1C(=O)O Amb32946182 [0,0,0,0,2,0|2,0,0]=4 353 B14R1.814 CC(=O)NC1CCCCC1OC(C)=O Amb8451466 [1,0,0,0,0,1|1,0,1]=4 354 B14R1.814 CC(=O)NC1CNCCC1CC(C)C Amb32677285 [1,0,0,0,0,1|2,0,0]=4 355 B14R1.814 CC(=O)OC1CCCCC1OC(C)=O Amb22734719 [1,0,0,0,0,1|1,0,1]=4 356 B14R1.676 C=C(C)C1CCC(C)C(OC(C)=O)C1 Amb2718729 [0,0,0,0,1,1|0,0,2]=4 357 B14R1.676 CC(=O)N[C@H]1C[C@@H](C(C)C)CC[C@@H]1C Amb27622169 [0,0,0,0,1,1|1,0,0]=3 358 B14R1.676 CC(=O)OC1OC(C(C)N)CCC1N Amb27948580 [0,0,0,0,1,1|2,0,0]=4 359 B14R1.676 CC(=O)O[C@@H]1O[C@H](C(C)N)CC[C@H]1N Amb28287709 [0,0,0,0,1,1|2,0,0]=4 360 B14R1.676 CC(=O)O[C@H]1O[C@H]([C@H](C)N)CC[C@H]1N Amb28194221 [0,0,0,0,1,1|2,0,0]=4