0 B14R1.5977 C=C1CCCC(C)(C)C1\C=C\C(C)=O Amb25752909 [0,0,0,0,0,0|0,0,2]=2 1 B14R1.5977 CC(=O)CCC1=C(C)CCCC1(C)C Amb4053556 [0,0,0,0,0,0|0,0,4]=4 2 B14R1.5977 CC(=O)CCC1C(C)=CCCC1(C)C Amb22350479 [0,0,0,0,0,0|0,0,2]=2 3 B14R1.5977 CC(=O)CCC1C(C)CCCC1(C)C Amb22734102 [0,0,0,0,0,0|0,0,4]=4 4 B14R1.5977 CC(=O)O\C=C1\C(C)=CCCC1(C)C Amb6846014 [0,0,0,0,0,0|1,0,1]=2 5 B14R1.5977 CC(=O)\C=C/C1C(C)=CCCC1(C)C Amb27616372 [0,0,0,0,0,0|0,0,0]=0 6 B14R1.5977 CC(=O)\C=C\C1=C(C)CCCC1(C)C Amb533159 [0,0,0,0,0,0|0,0,2]=2 7 B14R1.5977 CC(=O)\C=C\C1C(C)=CCCC1(C)C Amb9703133 [0,0,0,0,0,0|0,0,0]=0 8 B14R1.5977 CC(=O)\C=C\C1C(C)CCCC1(C)C Amb26401979 [0,0,0,0,0,0|0,0,2]=2 9 B14R1.5977 CC1=C(\C=C\C(=O)O)C(C)(C)CCC1 Amb4090369 [0,0,0,0,0,0|1,0,2]=3 10 B14R1.5977 CC1=C(\C=C\C(C)Br)C(C)(C)CCC1 Amb27762670 [0,0,0,0,0,0|1,0,3]=4 11 B14R1.5977 CC1=C(\C=C\C(C)O)C(C)(C)CCC1 Amb663617 [0,0,0,0,0,0|0,0,4]=4 12 B14R1.5977 CC1=C(\C=C\C(N)=O)C(C)(C)CCC1 Amb27843465 [0,0,0,0,0,0|1,0,2]=3 13 B14R1.5977 CC1=C(\C=C\[C@@H](C)O)C(C)(C)CCC1 Amb28280967 [0,0,0,0,0,0|0,0,4]=4 14 B14R1.5977 CC1=C(\C=C\[C@H](C)O)C(C)(C)CCC1 Amb27826396 [0,0,0,0,0,0|0,0,4]=4 15 B14R1.5977 CC1=CC=CC(C)(C)[C@@H]1\C=C\[C@H](C)O Amb28065901 [0,0,0,0,0,0|0,0,4]=4 16 B14R1.5977 CC1=CC=CC(C)(C)[C@H]1\C=C\[C@H](C)O Amb27452420 [0,0,0,0,0,0|0,0,4]=4 17 B14R1.5977 CC1=CCCC(C)(C)C1=C=C[C@@H](C)O Amb27833730 [0,0,0,0,0,0|0,0,4]=4 18 B14R1.5977 CC1=CCCC(C)(C)C1CCC(C)O Amb28185015 [0,0,0,0,0,0|0,0,4]=4 19 B14R1.5977 CC1=CCCC(C)(C)C1\C=C\C(=O)O Amb18651978 [0,0,0,0,0,0|1,0,0]=1 20 B14R1.5977 CC1=CCCC(C)(C)C1\C=C\C(C)Br Amb28348582 [0,0,0,0,0,0|1,0,1]=2 21 B14R1.5977 CC1=CCCC(C)(C)C1\C=C\C(C)O Amb22347885 [0,0,0,0,0,0|0,0,2]=2 22 B14R1.5977 CC1=CCCC(C)(C)[C@H]1CC[C@H](C)O Amb27449917 [0,0,0,0,0,0|0,0,4]=4 23 B14R1.5977 CC1=CCCC(C)(C)[C@H]1\C=C\C(C)O Amb27457714 [0,0,0,0,0,0|0,0,2]=2 24 B14R1.5977 CC1=CCCC(C)(C)[C@H]1\C=C\[C@H](C)O Amb27443332 [0,0,0,0,0,0|0,0,2]=2 25 B14R1.5977 CC1=CCCC(C)(C)\C1=C/CC(C)O Amb24681916 [0,0,0,0,0,0|0,0,4]=4 26 B14R1.5977 CC1=CCCC(C)(C)\C1=C\CC(C)O Amb17616149 [0,0,0,0,0,0|0,0,4]=4 27 B14R1.5977 C[C@@H]1CCCC(C)(C)[C@H]1\C=C\C(=O)O Amb27863487 [0,0,0,0,0,0|1,0,2]=3 28 B13R1.1620 CC1=CCCC(C)(C)C1CCC=O Amb18648428 [1,0,0,0,0,0|0,0,2]=3 29 B13R1.1620 CC1=CCCC(C)(C)[C@@H]1\C=C\C#N Amb24346901 [1,0,0,0,0,0|1,0,1]=3 30 B13R1.1620 CC1=CCCC(C)(C)[C@H]1\C=C\CO Amb27206531 [1,0,0,0,0,0|0,0,2]=3 31 B13R1.1620 CC1CCCC(C)(C)C1\C=C\C=O Amb27974649 [1,0,0,0,0,0|0,0,2]=3 32 B13R1.1620 C[C@H]1CCCC(C)(C)[C@H]1\C=C\C=O Amb28073053 [1,0,0,0,0,0|0,0,2]=3 33 B13R1.3575 CC(=O)\C=C\C1=CCCCC1(C)C Amb26958782 [1,0,0,0,0,0|0,0,2]=3 34 B13R1.3575 CC(=O)\C=C\[C@H]1C=CCCC1(C)C Amb27434301 [1,0,0,0,0,0|0,0,0]=1 35 B13R1.3575 CC1(C)CCCCC1\C=C\C(=O)O Amb33470092 [1,0,0,0,0,0|1,0,2]=4 36 B13R1.3787 C=C(C)CC[C@H]1C(C)=CCCC1C Amb25106866 [1,0,0,0,0,0|1,0,2]=4 37 B13R1.3787 C=C1CCCC(C)C1\C=C\C(C)=O Amb25735063 [1,0,0,0,0,0|0,0,2]=3 38 B13R1.3787 CC(=O)\C=C\C1=C(C)CCCC1C Amb28052214 [1,0,0,0,0,0|0,0,2]=3 39 B13R1.3787 CC1=CCCC(C)C1\C=C\C(=O)O Amb26863752 [1,0,0,0,0,0|1,0,0]=2 40 B15R1.8434 CC(=O)\C=C\C1C(C)=CCC(C)C1(C)C Amb33512722 [0,1,0,0,0,0|0,0,0]=1 41 B15R1.25522 CC(=O)\C(C)=C\C1C(C)=CCCC1(C)C Amb533156 [0,1,0,0,0,0|0,0,0]=1 42 B15R1.38786 CC1=C(C\C=C(/C)C=O)C(C)(C)CCC1 Amb533798 [0,1,0,0,0,0|0,0,3]=4 43 B15R1.38786 CCC(=O)\C=C\C1=C(C)CCCC1(C)C Amb17595529 [0,1,0,0,0,0|0,0,2]=3 44 B15R1.38786 C\C=C(C)\C=C\C1C(C)=CCCC1(C)C Amb30621738 [0,1,0,0,0,0|1,0,0]=2 45 B15R2.16299 CC(=O)c1cc2c(o1)CCCC2(C)C Amb18190561 [0,0,0,1,0,0|1,0,2]=4 46 B15R2.19750 CC(=O)\C=C\C1[C@H]2CC[C@H](C2)C1(C)C Amb28131891 [0,0,0,1,0,0|0,0,2]=3 47 B15R2.19750 CC1(C)[C@H](\C=C\C(=O)O)[C@H]2CC[C@@H]1C2 Amb27614369 [0,0,0,1,0,0|1,0,2]=4 48 B13R1.844 CC(=O)OC1C(=O)C=CCC1(C)C Amb17594690 [0,0,0,0,1,0|2,0,1]=4 49 B13R1.844 CC(=O)OC1C(C)=CCCC1(C)C Amb27654111 [0,0,0,0,1,0|1,0,0]=2 50 B13R1.5904 C=C(C)\C=C\C1C(=O)CCC1(C)C Amb26937888 [0,0,0,0,1,0|2,0,0]=3 51 B13R1.5904 CC(=O)\C=C\C1=C(C)CCC1(C)C Amb26344674 [0,0,0,0,1,0|0,0,1]=2 52 B12R1.1631 CO\N=C\C1C(C)=CCCC1C Amb27456076 [2,0,0,0,0,0|2,0,0]=4 53 B12R1.125 CC(=O)C\C=C1/C=CCCC1C Amb27861489 [2,0,0,0,0,0|0,0,2]=4 54 B12R1.125 CC(=O)C\C=C1/CCCC=C1C Amb27211924 [2,0,0,0,0,0|0,0,2]=4 55 B12R1.125 CC(=O)C\C=C1\CCCC=C1C Amb27789962 [2,0,0,0,0,0|0,0,2]=4 56 B12R1.125 CC(=O)\C=C\C1CCCCN1C Amb33322455 [2,0,0,0,0,0|1,0,1]=4 57 B14R1.17001 CC1=C(C\C=C\C=O)C(C)(C)CCC1 Amb28252346 [1,1,0,0,0,0|0,0,2]=4 58 B14R1.18803 C=C1CCCC(C)(C)C1C(=O)\C=C\C Amb25944386 [1,1,0,0,0,0|0,0,2]=4 59 B14R1.18803 CCNC(=O)C1C(C)=CCCC1(C)C Amb28408750 [1,1,0,0,0,0|1,0,1]=4 60 B14R1.18803 C\C=C/C(=O)C1=C(C)CCCC1(C)C Amb24538796 [1,1,0,0,0,0|0,0,2]=4 61 B14R1.18803 C\C=C\C(=O)C1C(C)=CCCC1(C)C Amb533152 [1,1,0,0,0,0|0,0,0]=2 62 B14R1.18803 C\C=C\C(=O)C1C(C)C=CCC1(C)C Amb8493064 [1,1,0,0,0,0|0,0,2]=4 63 B14R1.18803 C\C=C\[C@H](O)[C@H]1C(C)=CCCC1(C)C Amb27972536 [1,1,0,0,0,0|0,0,1]=3 64 B14R1.19284 C\C=C\C=C1/C(C)=CC(=O)CC1(C)C Amb27798770 [1,1,0,0,0,0|0,0,2]=4 65 B14R1.20252 CC1=CCCC(C)(C)C1\C=C(/C)C=O Amb27620487 [1,1,0,0,0,0|0,0,0]=2 66 B14R1.20252 CC1=CCCC(C)(C)C1\C=C(/C)CO Amb28069644 [1,1,0,0,0,0|0,0,2]=4 67 B14R1.24360 C[C@@H]1CCCC(C)(C)[C@]1(O)\C=C\C=O Amb27841712 [1,1,0,0,0,0|0,0,2]=4 68 B14R1.3152 CC(=O)\C=C\C1C(C)C=C(C)CC1C Amb576318 [1,1,0,0,0,0|0,0,2]=4 69 B14R1.6065 CC(=O)OC1C(C)=CCC(O)C1(C)C Amb27808359 [0,1,0,0,1,0|1,0,0]=3 70 B16R1.69464 CC1=C(\C=C\C(C)=C\C=O)C(C)(C)CCC1 Amb17595961 [0,2,0,0,0,0|0,0,2]=4 71 B14R1.14398 CC(=O)c1cc(C(C)(C)C)n(C)c1C Amb26955543 [0,0,1,1,0,0|1,0,1]=4 72 B14R1.164 CC(=O)\C=C1/CC(C)CCC1C(C)C Amb27599676 [0,0,1,1,0,0|0,0,2]=4 73 B14R2.24466 CC1=C2C=CC(=O)CC2(C)CCC1 Amb28201078 [1,0,0,1,0,0|0,0,2]=4 74 B14R2.24466 CC1=CCC[C@@]2(C)CC(=O)CC[C@H]12 Amb27493444 [1,0,0,1,0,0|0,0,2]=4 75 B14R2.2937 CC(=O)\C=C\[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C Amb27973063 [1,0,0,1,0,0|0,0,2]=4 76 B14R2.28849 CC1=CCCC2(C)CCC(=O)C=C12 Amb27974061 [0,0,0,1,1,0|0,0,1]=3 77 B14R2.28849 CC1=CCCC2(C)CCC(=O)CC12 Amb28074734 [0,0,0,1,1,0|0,0,1]=3 78 B14R2.28849 CC1=CCC[C@]2(C)CCC(=O)C[C@@H]12 Amb28052352 [0,0,0,1,1,0|0,0,1]=3 79 B16R2.401149 CC(=O)\C=C\C1C(C)(C)CCC2OC21C Amb22047818 [0,0,0,1,0,1|0,0,2]=4 80 B12R1.924 CC(=O)\C=C\C1CCSC1(C)C Amb33224338 [1,0,0,0,1,0|1,0,1]=4 81 B12R1.895 C=C1CCC(C)C1\C=C\C(C)=O Amb27859448 [1,0,0,0,1,0|0,0,1]=3 82 B12R1.895 C=C1CC[C@@H](C)[C@@H]1\C=C\C(C)=O Amb28285920 [1,0,0,0,1,0|0,0,1]=3 83 B12R1.1258 CC(=O)C1=C(C)C=CCC1(C)C Amb17594081 [0,0,0,0,2,0|0,0,2]=4 84 B12R1.1258 CC(=O)C1C(C)=CCCC1(C)C Amb27828842 [0,0,0,0,2,0|0,0,0]=2 85 B12R1.1258 CC(=O)C1C(C)C=CCC1(C)C Amb26493870 [0,0,0,0,2,0|0,0,2]=4 86 B12R1.1258 CC(=O)C1C(C)CCCC1(C)C Amb28325915 [0,0,0,0,2,0|0,0,2]=4 87 B12R1.1258 CC(=O)C1[C@H](C)CCCC1(C)C Amb27948658 [0,0,0,0,2,0|0,0,2]=4 88 B12R1.1258 CC(=O)[C@@H]1[C@@H](C)CCCC1(C)C Amb27862451 [0,0,0,0,2,0|0,0,2]=4 89 B12R1.1258 CC(=O)[C@@H]1[C@H](C)CCCC1(C)C Amb26431856 [0,0,0,0,2,0|0,0,2]=4 90 B12R1.1258 CC(=O)[C@H]1[C@H](C)CCCC1(C)C Amb26491730 [0,0,0,0,2,0|0,0,2]=4 91 B12R1.3805 CC(=O)CC1C(=O)CCC1(C)C Amb27176073 [0,0,0,0,2,0|1,0,1]=4