0 B12R1.3862 C#CC1(NC(C)=O)CCCCC1 Amb1091884 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.3862 C#CC1(NC(N)=O)CCCCC1 Amb2733507 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.3862 C#CC1(OC(=O)Cl)CCCCC1 Amb33297126 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.3862 C#CC1(OC(C)=O)CCCCC1 Amb17670641 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.3862 C#CC1(OC(N)=O)CCCCC1 Amb13889630 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.3862 C=C(C)CC1(C#N)CCCCC1 Amb27450946 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.3862 C=C(C)CC1(C=O)CCCCC1 Amb26636327 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.3862 C=C(C)CC1(CBr)CCCCC1 Amb32689639 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.3862 C=C(C)CC1(CBr)CCCCO1 Amb32689655 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.3862 C=C(C)CC1(CBr)CCCOC1 Amb32689642 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.3862 C=C(C)CC1(CBr)CCOCC1 Amb32689641 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.3862 C=C(C)CC1(CCl)CCCCC1 Amb32689632 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.3862 C=C(C)CC1(CCl)CCCCO1 Amb32689654 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.3862 C=C(C)CC1(CCl)CCCOC1 Amb32689636 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.3862 C=C(C)CC1(CCl)CCOCC1 Amb32689635 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.3862 C=C(Cl)CC1(C=O)CCCCC1 Amb33503754 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.3862 C=C(Cl)CC1(CBr)CCCCC1 Amb32689690 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.3862 C=C(Cl)CC1(CBr)CCCCO1 Amb32689760 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.3862 C=C(Cl)CC1(CBr)CCCOC1 Amb32689723 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.3862 C=C(Cl)CC1(CBr)CCOCC1 Amb32689722 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.3862 C=C(Cl)CC1(CCl)CCCCC1 Amb32689683 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.3862 C=C(Cl)CC1(CCl)CCCCO1 Amb32689759 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.3862 C=C(Cl)CC1(CCl)CCCOC1 Amb32689687 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.3862 C=C(Cl)CC1(CCl)CCOCC1 Amb32689686 [0,0,0,0,0,0|4,0,0]=4 24 B12R1.3862 C=CC1(CC(=O)O)CCCCC1 Amb25124080 [0,0,0,0,0,0|1,0,1]=2 25 B12R1.3862 C=CC1(CC(=O)O)CCNCC1 Amb33097600 [0,0,0,0,0,0|2,0,1]=3 26 B12R1.3862 C=CC1(CC(=O)O)CCOCC1 Amb33097611 [0,0,0,0,0,0|2,0,1]=3 27 B12R1.3862 C=CC1(OC(N)=O)CCCCC1 Amb28293210 [0,0,0,0,0,0|3,0,1]=4 28 B12R1.3862 CC(=O)CC1(C#N)CCOCC1 Amb27758199 [0,0,0,0,0,0|2,0,2]=4 29 B12R1.3862 CC(=O)NC1(C#N)CCCCC1 Amb1158079 [0,0,0,0,0,0|2,0,2]=4 30 B12R1.3862 CC(=O)NC1(C=O)CCCCC1 Amb27758074 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.3862 CC(=O)NC1(CBr)CCCCC1 Amb27981009 [0,0,0,0,0,0|3,0,0]=3 32 B12R1.3862 CC(=O)NC1(CCl)CCCCC1 Amb27801825 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.3862 CC(=O)NC1(CN)CCCCC1 Amb2606127 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.3862 CC(=O)NC1(CO)CCCNC1 Amb33072101 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.3862 CC(=O)NC1(CS)CCCCC1 Amb28243929 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.3862 CC(=O)OC1(C#N)CCCCC1 Amb4011623 [0,0,0,0,0,0|2,0,2]=4 37 B12R1.3862 CC(C)CC1(CBr)CCCCC1 Amb26938276 [0,0,0,0,0,0|3,0,1]=4 38 B12R1.3862 CC(C)CC1(CCl)CCCCC1 Amb26938275 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.3862 CC(C)CC1(CN)CCCCC1 Amb18801706 [0,0,0,0,0,0|2,0,1]=3 40 B12R1.3862 CC(C)CC1(CN)CCCCO1 Amb27985203 [0,0,0,0,0,0|3,0,1]=4 41 B12R1.3862 CC(C)CC1(CO)CCCCC1 Amb27756771 [0,0,0,0,0,0|3,0,1]=4 42 B12R1.3862 CC(C)OC1(CN)CCCCC1 Amb18986443 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.3862 CC(O)CC1(C#N)CCCCC1 Amb18646809 [0,0,0,0,0,0|1,0,3]=4 44 B12R1.3862 CC(O)CC1(C=O)CCCCC1 Amb27233779 [0,0,0,0,0,0|2,0,2]=4 45 B12R1.3862 CCC1(CC(=O)Cl)C=CCCC1 Amb27399567 [0,0,0,0,0,0|2,0,2]=4 46 B12R1.3862 CCC1(CC(=O)O)C=CCCC1 Amb28343050 [0,0,0,0,0,0|1,0,2]=3 47 B12R1.3862 CCC1(CC(=O)O)CCCCO1 Amb32648990 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.3862 CCC1(CC(=O)O)CCOCC1 Amb22735746 [0,0,0,0,0,0|2,0,0]=2 49 B12R1.3862 CCC1(CC(N)=O)CCCCO1 Amb32648989 [0,0,0,0,0,0|3,0,0]=3 50 B12R1.3862 CCC1(CC(N)=S)CCCCO1 Amb32648991 [0,0,0,0,0,0|3,1,0]=4 51 B12R1.3862 CCC1(NC(=N)N)CCCCC1 Amb27454020 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.3862 CCC1(NC(=O)Cl)CCCCC1 Amb35633518 [0,0,0,0,0,0|3,0,0]=3 53 B12R1.3862 CCC1(NC(=O)Cl)CCOCC1 Amb35633470 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.3862 CCC1(NC(C)=O)CCCNC1 Amb33229105 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.3862 CCC1(NC(C)=O)CCOCC1 Amb27457326 [0,0,0,0,0,0|4,0,0]=4 56 B12R1.3862 CCC1(NC(N)=S)CCCCC1 Amb28074970 [0,0,0,0,0,0|3,1,0]=4 57 B12R1.3862 CCC1(OC(N)=O)CCCCC1 Amb27961976 [0,0,0,0,0,0|3,0,0]=3 58 B12R1.3862 CN(C)CC1(CN)CCCCC1 Amb17334831 [0,0,0,0,0,0|3,0,0]=3 59 B12R1.3862 CN(C)CC1(CN)CCCOC1 Amb27636840 [0,0,0,0,0,0|4,0,0]=4 60 B12R1.3862 CN(C)CC1(CN)CCOCC1 Amb18990371 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.3862 CN(C)CC1(CN)CCOCC1 Amb35752858 [0,0,0,0,0,0|4,0,0]=4 62 B12R1.3862 CN(C)CC1(CO)CCCCC1 Amb17334873 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.3862 CN(C)CC1(CO)CCCCC1 Amb33527031 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.3862 CN(C)CC1(CS)CCCCC1 Amb27595225 [0,0,0,0,0,0|4,0,0]=4 65 B12R1.3862 CNC1(CC(=O)O)CCCCC1 Amb19374944 [0,0,0,0,0,0|2,0,0]=2 66 B12R1.3862 CNC1(CC(=O)O)CCCCC1 Amb22059477 [0,0,0,0,0,0|2,0,0]=2 67 B12R1.3862 CNC1(CC(C)O)CCCCC1 Amb35622702 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.3862 CNC1(CC(N)=O)CCOCC1 Amb27770182 [0,0,0,0,0,0|4,0,0]=4 69 B12R1.3862 COC1(CC(=N)N)CCCCC1 Amb35727141 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.3862 COC1(CC(=O)O)CCCCC1 Amb28421716 [0,0,0,0,0,0|2,0,0]=2 71 B12R1.3862 COC1(CC(=O)O)CCOCC1 Amb26540064 [0,0,0,0,0,0|3,0,0]=3 72 B12R1.3862 COC1(CC(N)=S)CCCCC1 Amb35723610 [0,0,0,0,0,0|3,1,0]=4 73 B12R1.3862 COC1(CS(=O)Cl)CCCCC1 Amb32720677 [0,0,0,0,0,0|4,0,0]=4 74 B12R1.3862 COC1(CS(=O)[O-])CCCCC1 Amb32754967 [0,0,0,0,0,0|3,0,1]=4 75 B12R1.3862 COC1(CS(N)=O)CCCCC1 Amb32720678 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.3862 FC(F)CC1(CBr)CCCCC1 Amb32690332 [0,0,0,0,0,0|3,0,1]=4 77 B12R1.3862 FC(F)CC1(CCl)CCCCC1 Amb30009399 [0,0,0,0,0,0|3,0,1]=4 78 B12R1.3862 N#CC1(CC(=O)O)CCCCC1 Amb16232027 [0,0,0,0,0,0|0,0,2]=2 79 B12R1.3862 N#CC1(CC(=O)O)CCOCC1 Amb32666544 [0,0,0,0,0,0|1,0,2]=3 80 B12R1.3862 N#CC1(CS(=O)Cl)CCCCC1 Amb32720620 [0,0,0,0,0,0|2,0,2]=4 81 B12R1.3862 N#CC1(CS(=O)[O-])CCCCC1 Amb32754772 [0,0,0,0,0,0|1,0,3]=4 82 B12R1.3862 N#CC1(CS(N)=O)CCCCC1 Amb32720621 [0,0,0,0,0,0|2,0,2]=4 83 B12R1.3862 N=C(N)NC1(CO)CCCCC1 Amb18807016 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.3862 NCC1(CC(=O)O)CCCCC1 Amb22169676 [0,0,0,0,0,0|0,0,0]=0 85 B12R1.3862 NCC1(CC(=O)O)CCCCC1 Amb534599 [0,0,0,0,0,0|0,0,0]=0 86 B12R1.3862 NCC1(CC(=O)O)CCCOC1 Amb27164402 [0,0,0,0,0,0|1,0,0]=1 87 B12R1.3862 NCC1(CC(=O)O)CCOCC1 Amb18825299 [0,0,0,0,0,0|1,0,0]=1 88 B12R1.3862 NCC1(CC(=O)O)CCOCC1 Amb32664734 [0,0,0,0,0,0|1,0,0]=1 89 B12R1.3862 NCC1(CC(=O)O)CCSCC1 Amb18819909 [0,0,0,0,0,0|1,0,0]=1 90 B12R1.3862 NCC1(CC(F)F)CCCCC1 Amb28396795 [0,0,0,0,0,0|2,0,1]=3 91 B12R1.3862 NCC1(CC(F)F)CCCCO1 Amb30008991 [0,0,0,0,0,0|3,0,1]=4 92 B12R1.3862 NCC1(CC(N)=O)CCCCC1 Amb18252113 [0,0,0,0,0,0|1,0,0]=1 93 B12R1.3862 NCC1(CC(N)=O)CCCCC1 Amb32667615 [0,0,0,0,0,0|1,0,0]=1 94 B12R1.3862 NCC1(C[PH](=O)O)CCCCC1 Amb27400694 [0,0,0,0,0,0|1,0,0]=1 95 B12R1.3862 NCC1(NC(N)=O)CCCCC1 Amb18908849 [0,0,0,0,0,0|2,0,0]=2 96 B12R1.3862 NCC1(OC(F)F)CCCCC1 Amb25728243 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.3862 NOC1(CC(=O)O)CCCCC1 Amb33072018 [0,0,0,0,0,0|1,0,0]=1 98 B12R1.3862 NOC1(CC(=O)O)CCCSC1 Amb33098057 [0,0,0,0,0,0|2,0,0]=2 99 B12R1.3862 NOC1(CC(=O)O)CCNCC1 Amb33072025 [0,0,0,0,0,0|2,0,0]=2 100 B12R1.3862 NOC1(CC(=O)O)CCOCC1 Amb33072034 [0,0,0,0,0,0|2,0,0]=2 101 B12R1.3862 O=C(O)CC1(CO)CCCCC1 Amb25295489 [0,0,0,0,0,0|1,0,0]=1 102 B12R1.3862 O=C([O-])CC1(CO)CCCCC1 Amb33482712 [0,0,0,0,0,0|1,0,1]=2 103 B12R1.3862 O=C([O-])CC1(CO)CCOCC1 Amb33620355 [0,0,0,0,0,0|2,0,1]=3 104 B12R1.3862 OCC1(CC(F)F)CCCCC1 Amb35674305 [0,0,0,0,0,0|3,0,1]=4 105 B11R1.928 C=C(Br)CC1(O)CCCCC1 Amb27839830 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.928 C=C(C)CC1(N)CCCOC1 Amb30030500 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.928 C=C(C)CC1(N)CCOCC1 Amb27854215 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.928 C=C(C)CC1(O)CCCCC1 Amb27797037 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.928 CC(=O)CC1(C)CCCCC1 Amb26476616 [1,0,0,0,0,0|1,0,0]=2 110 B11R1.928 CC(=O)CC1(C)CCOCC1 Amb33416914 [1,0,0,0,0,0|2,0,0]=3 111 B11R1.928 CC(=O)CC1(C)OCCCO1 Amb28194600 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.928 CC(=O)CC1(Cl)CCCCC1 Amb28198314 [1,0,0,0,0,0|2,0,0]=3 113 B11R1.928 CC(=O)CC1(N)CCCCC1 Amb24488108 [1,0,0,0,0,0|1,0,0]=2 114 B11R1.928 CC(=O)CC1(N)CCOCC1 Amb30033901 [1,0,0,0,0,0|2,0,0]=3 115 B11R1.928 CC(=O)CC1(N)CCSCC1 Amb33307897 [1,0,0,0,0,0|2,0,0]=3 116 B11R1.928 CC(=O)CC1(O)CCCCC1 Amb24486238 [1,0,0,0,0,0|2,0,0]=3 117 B11R1.928 CC(=O)CC1(O)CCCOC1 Amb32943790 [1,0,0,0,0,0|3,0,0]=4 118 B11R1.928 CC(=O)CC1(O)CCCSC1 Amb32943785 [1,0,0,0,0,0|3,0,0]=4 119 B11R1.928 CC(=O)CC1(O)CCNCC1 Amb25351671 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.928 CC(=O)CC1(O)CCOCC1 Amb32751701 [1,0,0,0,0,0|3,0,0]=4 121 B11R1.928 CC(=O)CC1(O)CCSCC1 Amb32943773 [1,0,0,0,0,0|3,0,0]=4 122 B11R1.928 CC(=O)NC1(C)CCCCC1 Amb6541245 [1,0,0,0,0,0|2,0,0]=3 123 B11R1.928 CC(=O)NC1(C)CCCNC1 Amb18200146 [1,0,0,0,0,0|3,0,0]=4 124 B11R1.928 CC(=O)NC1(C)CCCOC1 Amb27407625 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.928 CC(=O)NC1(C)CCNCC1 Amb25909610 [1,0,0,0,0,0|3,0,0]=4 126 B11R1.928 CC(=O)NC1(C)CCNCC1 Amb33189237 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.928 CC(=O)NC1(C)CCNCC1 Amb35788349 [1,0,0,0,0,0|3,0,0]=4 128 B11R1.928 CC(=O)NC1(C)CCSCC1 Amb27176411 [1,0,0,0,0,0|3,0,0]=4 129 B11R1.928 CC(=O)OC1(C)CCNCC1 Amb24689303 [1,0,0,0,0,0|3,0,0]=4 130 B11R1.928 CC(Br)CC1(C)CCCCC1 Amb33334497 [1,0,0,0,0,0|2,0,1]=4 131 B11R1.928 CC(C)CC1(N)CCCCC1 Amb9676118 [1,0,0,0,0,0|2,0,1]=4 132 B11R1.928 CC(Cl)CC1(C)CCCCC1 Amb28137936 [1,0,0,0,0,0|2,0,1]=4 133 B11R1.928 CC(O)CC1(C)CCCCC1 Amb33319300 [1,0,0,0,0,0|1,0,1]=3 134 B11R1.928 CC(O)CC1(C)CCOCC1 Amb33416807 [1,0,0,0,0,0|2,0,1]=4 135 B11R1.928 CC(O)CC1(N)CCCOC1 Amb29883675 [1,0,0,0,0,0|2,0,1]=4 136 B11R1.928 CC(O)CC1(N)CCOCC1 Amb29883681 [1,0,0,0,0,0|2,0,1]=4 137 B11R1.928 CC(O)CC1(O)CCCCC1 Amb28352233 [1,0,0,0,0,0|2,0,1]=4 138 B11R1.928 CC1(C=C(Br)Br)CCCCC1 Amb28194052 [1,0,0,0,0,0|2,0,1]=4 139 B11R1.928 CC1(CC(=N)N)CCCCC1 Amb33417892 [1,0,0,0,0,0|2,0,0]=3 140 B11R1.928 CC1(CC(=N)N)CCOCC1 Amb33415582 [1,0,0,0,0,0|3,0,0]=4 141 B11R1.928 CC1(CC(=O)Cl)CCCCC1 Amb26373080 [1,0,0,0,0,0|1,0,0]=2 142 B11R1.928 CC1(CC(=O)O)CCCCC1 Amb17194149 [1,0,0,0,0,0|0,0,0]=1 143 B11R1.928 CC1(CC(=O)O)CCCCO1 Amb32648987 [1,0,0,0,0,0|1,0,0]=2 144 B11R1.928 CC1(CC(=O)O)CCOCC1 Amb22737067 [1,0,0,0,0,0|1,0,0]=2 145 B11R1.928 CC1(CC(=O)O)COCCO1 Amb28436326 [1,0,0,0,0,0|2,0,0]=3 146 B11R1.928 CC1(CC(=O)O)SCCCS1 Amb22472163 [1,0,0,0,0,0|2,0,0]=3 147 B11R1.928 CC1(CC(N)=O)CCCCO1 Amb32648985 [1,0,0,0,0,0|2,0,0]=3 148 B11R1.928 CC1(CC(N)=S)CCCCC1 Amb33417904 [1,0,0,0,0,0|1,1,0]=3 149 B11R1.928 CC1(CC(N)=S)CCCCO1 Amb32648986 [1,0,0,0,0,0|2,1,0]=4 150 B11R1.928 CC1(CC(N)=S)CCOCC1 Amb33415581 [1,0,0,0,0,0|2,1,0]=4 151 B11R1.928 CC1(CS(=O)Cl)CCCCC1 Amb32720634 [1,0,0,0,0,0|2,0,0]=3 152 B11R1.928 CC1(CS(=O)Cl)CCOCC1 Amb32720812 [1,0,0,0,0,0|3,0,0]=4 153 B11R1.928 CC1(CS(=O)[O-])CCCCC1 Amb32754771 [1,0,0,0,0,0|1,0,1]=3 154 B11R1.928 CC1(CS(=O)[O-])CCOCC1 Amb32755841 [1,0,0,0,0,0|2,0,1]=4 155 B11R1.928 CC1(CS(N)=O)CCCCC1 Amb32720635 [1,0,0,0,0,0|2,0,0]=3 156 B11R1.928 CC1(CS(N)=O)CCOCC1 Amb32720814 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.928 CC1(C[N+](=O)[O-])CCCCC1 Amb33417972 [1,0,0,0,0,0|1,0,1]=3 158 B11R1.928 CC1(C[N+](=O)[O-])CCOCC1 Amb33415484 [1,0,0,0,0,0|2,0,1]=4 159 B11R1.928 CC1(NC(=N)N)CCCCC1 Amb18796922 [1,0,0,0,0,0|3,0,0]=4 160 B11R1.928 CC1(NC(=O)Cl)CCCCC1 Amb35625768 [1,0,0,0,0,0|2,0,0]=3 161 B11R1.928 CC1(NC(=O)Cl)CCCOC1 Amb35633435 [1,0,0,0,0,0|3,0,0]=4 162 B11R1.928 CC1(NC(=O)Cl)CCOCC1 Amb35625930 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.928 CC1(NC(N)=O)CCCCC1 Amb18183090 [1,0,0,0,0,0|2,0,0]=3 164 B11R1.928 CC1(NC(N)=S)CCCCC1 Amb18185745 [1,0,0,0,0,0|2,1,0]=4 165 B11R1.928 CN(C)CC1(N)CCCCC1 Amb6715653 [1,0,0,0,0,0|3,0,0]=4 166 B11R1.928 CN(O)CC1(C)CCCCC1 Amb33318951 [1,0,0,0,0,0|2,0,0]=3 167 B11R1.928 CN(O)CC1(C)CCOCC1 Amb33415992 [1,0,0,0,0,0|3,0,0]=4 168 B11R1.928 C[C@@H](N)CC1(C)CCCCC1 Amb33318880 [1,0,0,0,0,0|2,0,1]=4 169 B11R1.928 C[C@@H](O)CC1(C)CCCCC1 Amb33318875 [1,0,0,0,0,0|1,0,1]=3 170 B11R1.928 C[C@@H](O)CC1(C)CCOCC1 Amb33415618 [1,0,0,0,0,0|2,0,1]=4 171 B11R1.928 C[C@H](N)CC1(C)CCCCC1 Amb33318878 [1,0,0,0,0,0|2,0,1]=4 172 B11R1.928 C[C@H](O)CC1(C)CCCCC1 Amb33318876 [1,0,0,0,0,0|1,0,1]=3 173 B11R1.928 C[C@H](O)CC1(C)CCOCC1 Amb33415619 [1,0,0,0,0,0|2,0,1]=4 174 B11R1.928 NC(=O)CC1(N)CCCCC1 Amb25151318 [1,0,0,0,0,0|1,0,0]=2 175 B11R1.928 NC(=O)CC1(N)CCCCC1 Amb30584715 [1,0,0,0,0,0|1,0,0]=2 176 B11R1.928 NC(=O)CC1(N)CCCOC1 Amb33308435 [1,0,0,0,0,0|2,0,0]=3 177 B11R1.928 NC(=O)CC1(N)CCCSC1 Amb33254922 [1,0,0,0,0,0|2,0,0]=3 178 B11R1.928 NC(=O)CC1(N)CCNCC1 Amb33254900 [1,0,0,0,0,0|2,0,0]=3 179 B11R1.928 NC(=O)CC1(N)CCOCC1 Amb20623957 [1,0,0,0,0,0|2,0,0]=3 180 B11R1.928 NC(=O)CC1(N)CCOCC1 Amb25265365 [1,0,0,0,0,0|2,0,0]=3 181 B11R1.928 NC(=O)CC1(N)CCSCC1 Amb32787603 [1,0,0,0,0,0|2,0,0]=3 182 B11R1.928 NC(=O)CC1(O)CCCCC1 Amb28322770 [1,0,0,0,0,0|2,0,0]=3 183 B11R1.928 NC(=O)CC1(O)CCCNC1 Amb26568051 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.928 NC(=S)CC1(O)CCCCC1 Amb27650667 [1,0,0,0,0,0|2,1,0]=4 185 B11R1.928 NC1(CC(=O)O)C=CCCC1 Amb33036363 [1,0,0,0,0,0|0,0,2]=3 186 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb10602480 [1,0,0,0,0,0|0,0,0]=1 187 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb2697380 [1,0,0,0,0,0|0,0,0]=1 188 B11R1.928 NC1(CC(=O)O)CCCOC1 Amb27960202 [1,0,0,0,0,0|1,0,0]=2 189 B11R1.928 NC1(CC(=O)O)CCCOC1 Amb32664553 [1,0,0,0,0,0|1,0,0]=2 190 B11R1.928 NC1(CC(=O)O)CCCSC1 Amb25875659 [1,0,0,0,0,0|1,0,0]=2 191 B11R1.928 NC1(CC(=O)O)CCNCC1 Amb25085887 [1,0,0,0,0,0|1,0,0]=2 192 B11R1.928 NC1(CC(=O)O)CCNCC1 Amb28653010 [1,0,0,0,0,0|1,0,0]=2 193 B11R1.928 NC1(CC(=O)O)CCOCC1 Amb19135893 [1,0,0,0,0,0|1,0,0]=2 194 B11R1.928 NC1(CC(=O)O)CCOCC1 Amb28652901 [1,0,0,0,0,0|1,0,0]=2 195 B11R1.928 NC1(CC(=O)O)CCSCC1 Amb19135848 [1,0,0,0,0,0|1,0,0]=2 196 B11R1.928 NC1(CC(F)F)CCCCC1 Amb27815400 [1,0,0,0,0,0|2,0,1]=4 197 B11R1.928 NS(=O)CC1(F)CCCCC1 Amb32720721 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.928 O=C(O)CC1(Cl)CCCCC1 Amb27477728 [1,0,0,0,0,0|1,0,0]=2 199 B11R1.928 O=C(O)CC1(O)C=CCCC1 Amb25893115 [1,0,0,0,0,0|1,0,2]=4 200 B11R1.928 O=C(O)CC1(O)CCCCC1 Amb2785810 [1,0,0,0,0,0|1,0,0]=2 201 B11R1.928 O=C(O)CC1(O)CCCNC1 Amb27153944 [1,0,0,0,0,0|2,0,0]=3 202 B11R1.928 O=C(O)CC1(O)CCCOC1 Amb18830295 [1,0,0,0,0,0|2,0,0]=3 203 B11R1.928 O=C(O)CC1(O)CCCSC1 Amb18965248 [1,0,0,0,0,0|2,0,0]=3 204 B11R1.928 O=C(O)CC1(O)CCNCC1 Amb18961453 [1,0,0,0,0,0|2,0,0]=3 205 B11R1.928 O=C(O)CC1(O)CCNCC1 Amb33803799 [1,0,0,0,0,0|2,0,0]=3 206 B11R1.928 O=C(O)CC1(O)CCOCC1 Amb18961450 [1,0,0,0,0,0|2,0,0]=3 207 B11R1.928 O=C(O)CC1(O)CCSCC1 Amb18285927 [1,0,0,0,0,0|2,0,0]=3 208 B11R1.928 O=C(O)CC1(S)CCCCC1 Amb26951602 [1,0,0,0,0,0|1,0,0]=2 209 B11R1.928 O=S(Cl)CC1(F)CCCCC1 Amb32720720 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.928 O=S([O-])CC1(F)CCCCC1 Amb32754925 [1,0,0,0,0,0|2,0,1]=4 211 B11R1.928 O=[N+]([O-])CC1(O)CCCCC1 Amb2720791 [1,0,0,0,0,0|2,0,1]=4 212 B11R1.1253 C#CCC1(CN)CCOCC1 Amb27267658 [1,0,0,0,0,0|2,0,1]=4 213 B11R1.1253 C=CC1(CC=O)CCCCC1 Amb18125475 [1,0,0,0,0,0|1,0,1]=3 214 B11R1.1253 C=CC1(CCO)CCCCC1 Amb27663581 [1,0,0,0,0,0|1,0,2]=4 215 B11R1.1253 C=CCC1(C=O)CCCCC1 Amb17593807 [1,0,0,0,0,0|2,0,1]=4 216 B11R1.1253 C=CCC1(CBr)CCCCC1 Amb26867906 [1,0,0,0,0,0|2,0,0]=3 217 B11R1.1253 C=CCC1(CBr)CCCCO1 Amb28396797 [1,0,0,0,0,0|3,0,0]=4 218 B11R1.1253 C=CCC1(CBr)CCCOC1 Amb24696217 [1,0,0,0,0,0|3,0,0]=4 219 B11R1.1253 C=CCC1(CBr)CCOCC1 Amb26494029 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.1253 C=CCC1(CCl)CCCCC1 Amb25055442 [1,0,0,0,0,0|2,0,0]=3 221 B11R1.1253 C=CCC1(CCl)CCCCO1 Amb25031342 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.1253 C=CCC1(CCl)CCCOC1 Amb27631818 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.1253 C=CCC1(CCl)CCOCC1 Amb25234484 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.1253 C=CCC1(CN)CCCCC1 Amb18125612 [1,0,0,0,0,0|1,0,0]=2 225 B11R1.1253 C=CCC1(CO)CCCCC1 Amb27169908 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.1253 C=CCC1(CO)CCCCO1 Amb27455417 [1,0,0,0,0,0|3,0,0]=4 227 B11R1.1253 C=CCC1(CO)CCCNC1 Amb24486707 [1,0,0,0,0,0|3,0,0]=4 228 B11R1.1253 C=CCC1(CO)CCOCC1 Amb24416645 [1,0,0,0,0,0|3,0,0]=4 229 B11R1.1253 C=CCC1(OC)CCCCC1 Amb8389778 [1,0,0,0,0,0|3,0,0]=4 230 B11R1.1253 CCC1(CC=O)CCCCC1 Amb26317392 [1,0,0,0,0,0|1,0,0]=2 231 B11R1.1253 CCC1(CCN)CCCCC1 Amb27967641 [1,0,0,0,0,0|2,0,1]=4 232 B11R1.1253 CCC1(CCO)CCCCC1 Amb27804924 [1,0,0,0,0,0|1,0,1]=3 233 B11R1.1253 CCCC1(CBr)CCCCC1 Amb27399850 [1,0,0,0,0,0|2,0,1]=4 234 B11R1.1253 CCCC1(CCl)CCCCC1 Amb26856283 [1,0,0,0,0,0|2,0,1]=4 235 B11R1.1253 CCCC1(CN)CCCCC1 Amb18995829 [1,0,0,0,0,0|1,0,1]=3 236 B11R1.1253 CCCC1(CN)CCOCC1 Amb18999644 [1,0,0,0,0,0|2,0,1]=4 237 B11R1.1253 CCNC1(CN)CCCCC1 Amb18985366 [1,0,0,0,0,0|2,0,1]=4 238 B11R1.1253 CCOC1(CN)CCCCC1 Amb18986438 [1,0,0,0,0,0|2,0,1]=4 239 B11R1.1253 CNCC1(CO)CCCCC1 Amb28048467 [1,0,0,0,0,0|3,0,0]=4 240 B11R1.1253 COC1(CC=O)CCCCC1 Amb28201179 [1,0,0,0,0,0|2,0,0]=3 241 B11R1.1253 COC1(CC=O)CCCCO1 Amb27798327 [1,0,0,0,0,0|3,0,0]=4 242 B11R1.1253 COCC1(CBr)CCCCC1 Amb25715726 [1,0,0,0,0,0|3,0,0]=4 243 B11R1.1253 COCC1(CCl)CCCCC1 Amb26078917 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.1253 COCC1(CN)CCCCC1 Amb17570027 [1,0,0,0,0,0|2,0,0]=3 245 B11R1.1253 COCC1(CN)CCCCO1 Amb25031493 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.1253 COCC1(CN)CCOCC1 Amb17570030 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.1253 COCC1(CN)CCOCC1 Amb28872315 [1,0,0,0,0,0|3,0,0]=4 248 B11R1.1253 COCC1(CO)CCCCC1 Amb25802387 [1,0,0,0,0,0|3,0,0]=4 249 B11R1.1253 CSCC1(CN)CCCCC1 Amb33272068 [1,0,0,0,0,0|2,0,0]=3 250 B11R1.1253 C\C=C\C1(CN)CCCCC1 Amb27412340 [1,0,0,0,0,0|1,0,1]=3 251 B11R1.1253 ClCCC1(CCl)CCCCC1 Amb27444609 [1,0,0,0,0,0|2,0,1]=4 252 B11R1.1253 N#CC1(CC=O)CCCCC1 Amb18125294 [1,0,0,0,0,0|0,0,2]=3 253 B11R1.1253 N#CC1(CC=O)CCOCC1 Amb32938534 [1,0,0,0,0,0|1,0,2]=4 254 B11R1.1253 N#CC1(CCO)CCCCC1 Amb28142432 [1,0,0,0,0,0|0,0,3]=4 255 B11R1.1253 N#CC1(NC=O)CCCCC1 Amb25145704 [1,0,0,0,0,0|1,0,2]=4 256 B11R1.1253 NCC1(CCCl)CCCCC1 Amb27955470 [1,0,0,0,0,0|1,0,1]=3 257 B11R1.1253 NCC1(CCCl)CCCOC1 Amb27402004 [1,0,0,0,0,0|2,0,1]=4 258 B11R1.1253 NCC1(CCF)CCCCC1 Amb26852903 [1,0,0,0,0,0|1,0,1]=3 259 B11R1.1253 NCC1(CCO)CCCCC1 Amb20623295 [1,0,0,0,0,0|0,0,1]=2 260 B11R1.1253 NCC1(CCO)CCCOC1 Amb28198301 [1,0,0,0,0,0|1,0,1]=3 261 B11R1.1253 NCC1(CCO)CCOCC1 Amb20623272 [1,0,0,0,0,0|1,0,1]=3 262 B11R1.1253 O=CC1(CCO)CCCCC1 Amb24470287 [1,0,0,0,0,0|1,0,2]=4 263 B11R1.1253 O=CNC1(CO)CCOCC1 Amb28124101 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.1253 OCCC1(CO)CCCCC1 Amb2780771 [1,0,0,0,0,0|1,0,1]=3 265 B13R1.3119 C=C(C)CC1(CN)CCCCC1O Amb27231006 [0,1,0,0,0,0|2,0,0]=3 266 B13R1.3119 CC(C)CC1(CN)CCCCC1O Amb28387815 [0,1,0,0,0,0|2,0,1]=4 267 B13R1.3119 CCC1(CC(=O)O)CCCNC1=O Amb24533523 [0,1,0,0,0,0|2,0,1]=4 268 B13R1.3119 CC[C@@]1(CC(=O)O)CCCCC1=O Amb27863577 [0,1,0,0,0,0|1,0,1]=3 269 B13R1.4942 C#CC(=O)CC1(CN)CCCCC1 Amb27168487 [0,1,0,0,0,0|1,0,0]=2 270 B13R1.4942 C#CC(=O)NC1(CC)CCCCC1 Amb29888606 [0,1,0,0,0,0|3,0,0]=4 271 B13R1.4942 C#CC(=O)NC1(CO)CCCCC1 Amb18186833 [0,1,0,0,0,0|3,0,0]=4 272 B13R1.4942 C#CC(O)CC1(CN)CCCCC1 Amb35740613 [0,1,0,0,0,0|1,0,1]=3 273 B13R1.4942 C#CC1(OC(=O)OC)CCCCC1 Amb33620300 [0,1,0,0,0,0|2,0,1]=4 274 B13R1.4942 CCC(=O)NC1(CO)CCCCC1 Amb19075337 [0,1,0,0,0,0|3,0,0]=4 275 B13R1.4942 CCC1(NC(=O)CBr)CCCCC1 Amb27434768 [0,1,0,0,0,0|3,0,0]=4 276 B13R1.4942 CCC1(NC(=O)CN)CCCCC1 Amb27983885 [0,1,0,0,0,0|3,0,0]=4 277 B13R1.4942 CCC1(NC(=O)NC)CCCCC1 Amb28193231 [0,1,0,0,0,0|3,0,0]=4 278 B13R1.4942 CCC1(NC(=O)NN)CCCCC1 Amb27245388 [0,1,0,0,0,0|3,0,0]=4 279 B13R1.4942 CCC1(NC(=O)OC)CCCCC1 Amb28193232 [0,1,0,0,0,0|2,0,0]=3 280 B13R1.4942 CCC1(NC(=O)OC)CCOCC1 Amb28345181 [0,1,0,0,0,0|3,0,0]=4 281 B13R1.4942 CNC(=O)CC1(CN)CCCCC1 Amb18252869 [0,1,0,0,0,0|1,0,0]=2 282 B13R1.4942 CNC(=O)CC1(CN)CCCCC1 Amb28556067 [0,1,0,0,0,0|1,0,0]=2 283 B13R1.4942 CNC(=O)NC1(CN)CCCCC1 Amb18909469 [0,1,0,0,0,0|2,0,0]=3 284 B13R1.4942 CNC1(CC(=O)NO)CCCCC1 Amb28193290 [0,1,0,0,0,0|2,0,0]=3 285 B13R1.4942 CNC1(CC(=O)OC)CCCCC1 Amb33726857 [0,1,0,0,0,0|2,0,0]=3 286 B13R1.4942 COC(=O)CC1(CN)CCCCC1 Amb18326740 [0,1,0,0,0,0|0,0,0]=1 287 B13R1.4942 COC(=O)CC1(CN)CCCCC1 Amb28600308 [0,1,0,0,0,0|0,0,0]=1 288 B13R1.4942 COC(=O)CC1(CN)CCOCC1 Amb32652281 [0,1,0,0,0,0|1,0,0]=2 289 B13R1.4942 COC(=O)CC1(CN)CCOCC1 Amb32652282 [0,1,0,0,0,0|1,0,0]=2 290 B13R1.4942 COC(=O)NC1(CN)CCCCC1 Amb18909545 [0,1,0,0,0,0|1,0,0]=2 291 B13R1.4942 COC(=O)NC1(CN)CCOCC1 Amb27983399 [0,1,0,0,0,0|2,0,0]=3 292 B13R1.4942 COC1(C\C(N)=N\O)CCCCC1 Amb35734558 [0,1,0,0,0,0|3,0,0]=4 293 B13R1.4942 C\C(=C/Cl)CC1(CN)CCCCC1 Amb27210055 [0,1,0,0,0,0|2,0,0]=3 294 B13R1.4942 C\C(=C/Cl)CC1(CN)CCCOC1 Amb27210123 [0,1,0,0,0,0|3,0,0]=4 295 B13R1.4942 NCC(=O)NC1(CO)CCCCC1 Amb18992460 [0,1,0,0,0,0|3,0,0]=4 296 B13R1.4942 NCC(O)CC1(CN)CCCCC1 Amb32656687 [0,1,0,0,0,0|1,0,1]=3 297 B13R1.4942 NCC1(CC(O)CF)CCCCC1 Amb33220203 [0,1,0,0,0,0|1,0,1]=3 298 B13R1.4942 NCC1(CC(O)CF)CCCCO1 Amb33220041 [0,1,0,0,0,0|2,0,1]=4 299 B13R1.4942 NCC1(CC(O)CF)CCCOC1 Amb33220202 [0,1,0,0,0,0|2,0,1]=4 300 B13R1.4942 NCC1(CC(O)CF)CCOCC1 Amb33220208 [0,1,0,0,0,0|2,0,1]=4 301 B13R1.4942 NCC1(CC(O)CF)CCSCC1 Amb33220369 [0,1,0,0,0,0|2,0,1]=4 302 B13R1.4942 [C-]#[N+]C1(CC(=O)OC)CCCCC1 Amb2688939 [0,1,0,0,0,0|2,0,0]=3 303 B13R1.5953 C=C(C)CC1(CN)CCC(C)CC1 Amb28382159 [0,1,0,0,0,0|2,0,0]=3 304 B13R1.5953 C=CC1(CC(=O)O)CCC(C)CC1 Amb33097591 [0,1,0,0,0,0|1,0,1]=3 305 B13R1.5953 C=CC1(CC(=O)O)CCN(C)CC1 Amb32757290 [0,1,0,0,0,0|2,0,1]=4 306 B13R1.5953 CC(=O)NC1(CBr)CCC(C)CC1 Amb27254403 [0,1,0,0,0,0|3,0,0]=4 307 B13R1.5953 CC(=O)NC1(CO)CCC(C)CC1 Amb18328962 [0,1,0,0,0,0|3,0,0]=4 308 B13R1.5953 CC(=O)OC1(CN)CCN(C)CC1 Amb18129636 [0,1,0,0,0,0|3,0,0]=4 309 B13R1.5953 CC(C)CC1(CN)CCC(C)CC1 Amb26619171 [0,1,0,0,0,0|2,0,1]=4 310 B13R1.5953 CC(C)CC1(CN)CCC(O)CC1 Amb26366207 [0,1,0,0,0,0|2,0,1]=4 311 B13R1.5953 CC1CCC(CC(=O)O)(ON)CC1 Amb33098050 [0,1,0,0,0,0|1,0,0]=2 312 B13R1.5953 CC1CCC(CN)(CC(=O)O)CO1 Amb29850470 [0,1,0,0,0,0|1,0,0]=2 313 B13R1.5953 CC1CCC(CN)(CC(=O)O)CS1 Amb35725401 [0,1,0,0,0,0|1,0,0]=2 314 B13R1.5953 CC1CCC(CN)(CC(F)F)CC1 Amb27769087 [0,1,0,0,0,0|2,0,1]=4 315 B13R1.5953 CC1CCC(CN)(NC(N)=O)CC1 Amb27848920 [0,1,0,0,0,0|2,0,0]=3 316 B13R1.5953 CC1CCC(CO)(NC(N)=O)CC1 Amb18329302 [0,1,0,0,0,0|3,0,0]=4 317 B13R1.5953 CC[C@]1(OC(N)=O)CC[C@H](O)CC1 Amb27179218 [0,1,0,0,0,0|3,0,0]=4 318 B13R1.5953 CN1CCC(CC(=O)O)(ON)CC1 Amb33072017 [0,1,0,0,0,0|2,0,0]=3 319 B13R1.5953 CN1CCC(CN)(CC(=O)O)CC1 Amb18191218 [0,1,0,0,0,0|1,0,0]=2 320 B13R1.5953 CNC1(CC(=O)O)CCC(C)OC1 Amb30011040 [0,1,0,0,0,0|3,0,0]=4 321 B13R1.5953 CNC1(CC(N)=O)CCC(C)CC1 Amb27180237 [0,1,0,0,0,0|3,0,0]=4 322 B13R1.5953 C[C@H]1CC[C@](CN)(CC(=O)O)CC1 Amb27444172 [0,1,0,0,0,0|0,0,0]=1 323 B13R1.5953 NCC1(CC(F)F)CCC(O)CC1 Amb35742861 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.5990 C=C(C)CC1(CN)CCCC(C)C1 Amb27769011 [0,1,0,0,0,0|2,0,0]=3 325 B13R1.5990 C=CC1(CC(=O)O)CCCC(C)C1 Amb33097598 [0,1,0,0,0,0|1,0,1]=3 326 B13R1.5990 CC(C)CC1(CN)CCCC(C)C1 Amb27639816 [0,1,0,0,0,0|2,0,1]=4 327 B13R1.5990 CC1CC(CN)(CC(=O)O)CCO1 Amb27180814 [0,1,0,0,0,0|1,0,0]=2 328 B13R1.5990 CC1CCCC(CC(=O)O)(ON)C1 Amb33072024 [0,1,0,0,0,0|1,0,0]=2 329 B13R1.5990 CC1CCCC(CN)(CC(F)F)C1 Amb27769012 [0,1,0,0,0,0|2,0,1]=4 330 B13R1.5990 CN1CCCC(CN)(CC(=O)O)C1 Amb18821996 [0,1,0,0,0,0|1,0,0]=2 331 B13R1.5990 C[C@@H]1CCC[C@](CN)(CC(=O)O)C1 Amb27433918 [0,1,0,0,0,0|0,0,0]=1 332 B13R1.5990 C[C@@H]1CCC[C@](CO)(CC(=O)O)C1 Amb27477821 [0,1,0,0,0,0|1,0,0]=2 333 B13R1.5992 C=C(C)C(O)C1(CN)CCCCC1 Amb35586936 [0,1,0,0,0,0|2,0,0]=3 334 B13R1.5992 C=C(C)C(O)C1(CN)CCOCC1 Amb35625103 [0,1,0,0,0,0|3,0,0]=4 335 B13R1.5992 CC(=O)N(C)C1(CN)CCOCC1 Amb33098924 [0,1,0,0,0,0|3,0,0]=4 336 B13R1.5992 CC(C)C(O)C1(CN)CCCCC1 Amb28318059 [0,1,0,0,0,0|2,0,1]=4 337 B13R1.5992 CC(O)C(C)C1(CN)CCCCC1 Amb28075060 [0,1,0,0,0,0|1,0,1]=3 338 B13R1.5992 CCC1(C(N)C(=O)O)CCCCC1 Amb27985863 [0,1,0,0,0,0|1,0,0]=2 339 B13R1.5992 COC1(C(O)C(N)=O)CCCCC1 Amb28386397 [0,1,0,0,0,0|3,0,0]=4 340 B13R1.5992 NCC1(C(O)C(=O)O)CCCCC1 Amb27401511 [0,1,0,0,0,0|0,0,0]=1 341 B13R1.5992 NCC1(C(O)C(=O)O)CCCOC1 Amb25067614 [0,1,0,0,0,0|1,0,0]=2 342 B13R1.5992 NCC1(C(O)C(=O)O)CCOCC1 Amb24489915 [0,1,0,0,0,0|1,0,0]=2 343 B13R1.6672 CC(C)(C)CC1(CN)CCCCC1 Amb33226547 [0,1,0,0,0,0|2,0,1]=4 344 B13R1.6672 CS(=O)(=O)CC1(CBr)CCCCC1 Amb28243243 [0,1,0,0,0,0|2,0,1]=4 345 B13R1.6672 CS(=O)(=O)CC1(CN)CCCCC1 Amb33055754 [0,1,0,0,0,0|1,0,1]=3 346 B13R1.6672 CS(=O)(=O)CC1(CN)CCOCC1 Amb25968834 [0,1,0,0,0,0|2,0,1]=4 347 B13R1.6672 CS(=O)(=O)CC1(CN)CCOCC1 Amb28600406 [0,1,0,0,0,0|2,0,1]=4 348 B13R1.6672 CS(=O)(=O)NC1(CN)CCCCC1 Amb19260390 [0,1,0,0,0,0|2,0,1]=4 349 B13R1.6672 CS(=O)(=O)NC1(CN)CCCCC1 Amb2371860 [0,1,0,0,0,0|2,0,1]=4 350 B13R1.6672 NCC1(CC(F)(F)F)CCCCC1 Amb19893204 [0,1,0,0,0,0|2,0,1]=4 351 B13R1.6672 NCC1(CP(=O)(O)O)CCCCC1 Amb27464404 [0,1,0,0,0,0|1,0,0]=2 352 B13R1.6672 NCC1(CS(=O)(=O)F)CCCCC1 Amb33463926 [0,1,0,0,0,0|1,0,1]=3 353 B13R1.6672 NCC1(CS(=O)(=O)F)CCOCC1 Amb33463819 [0,1,0,0,0,0|2,0,1]=4 354 B13R1.6672 NCC1(CS(N)(=O)=O)CCCCC1 Amb27469814 [0,1,0,0,0,0|1,0,1]=3 355 B13R1.6672 O=S(=O)(Cl)CC1(CF)CCCCC1 Amb27481932 [0,1,0,0,0,0|2,0,1]=4 356 B13R1.7334 C#CCC1(OC(N)=O)CCCCC1 Amb28287236 [0,1,0,0,0,0|3,0,0]=4 357 B13R1.7334 CNOC1(CC(=O)O)CCCCC1 Amb33098065 [0,1,0,0,0,0|1,0,0]=2 358 B13R1.7334 CNOC1(CC(=O)O)CCNCC1 Amb33098071 [0,1,0,0,0,0|2,0,0]=3 359 B13R1.7334 CNOC1(CC(=O)O)CCOCC1 Amb33098085 [0,1,0,0,0,0|2,0,0]=3 360 B13R1.7334 COCC1(CC(=O)O)CCCCO1 Amb33341902 [0,1,0,0,0,0|2,0,0]=3 361 B13R1.7334 COCC1(CC(=O)O)CCOCC1 Amb33457391 [0,1,0,0,0,0|2,0,0]=3 362 B13R1.7334 COCC1(CC(C)=O)CCCCO1 Amb33341236 [0,1,0,0,0,0|3,0,0]=4 363 B13R1.7334 N#CNC1(CC(=O)O)CCCCC1 Amb29870418 [0,1,0,0,0,0|0,0,2]=3 364 B13R1.7334 N#CNC1(CC(=O)O)CCOCC1 Amb29880889 [0,1,0,0,0,0|1,0,2]=4 365 B13R1.7334 NCCC1(CC(=O)O)CCCCC1 Amb32661778 [0,1,0,0,0,0|0,0,0]=1 366 B13R1.7334 NCCC1(CC(=O)O)CCCCC1 Amb32661779 [0,1,0,0,0,0|0,0,0]=1 367 B13R1.7334 O=CNC1(CC(=O)O)CCCCC1 Amb24401793 [0,1,0,0,0,0|1,0,1]=3 368 B13R1.7334 O=CNC1(CC(=O)O)CCCOC1 Amb33255352 [0,1,0,0,0,0|2,0,1]=4 369 B13R1.7334 O=CNC1(CC(=O)O)CCCSC1 Amb33254140 [0,1,0,0,0,0|2,0,1]=4 370 B13R1.7334 O=CNC1(CC(=O)O)CCNCC1 Amb33254247 [0,1,0,0,0,0|2,0,1]=4 371 B13R1.7334 O=CNC1(CC(=O)O)CCOCC1 Amb30034397 [0,1,0,0,0,0|2,0,1]=4 372 B13R1.7334 O=CNC1(CC(=O)O)CCSCC1 Amb33251606 [0,1,0,0,0,0|2,0,1]=4 373 B13R1.8842 C=C(Cl)CC1(C(N)=O)CCCCC1 Amb27391705 [0,1,0,0,0,0|2,0,1]=4 374 B13R1.8842 C=C(F)C1(CC(=O)O)CCCCC1 Amb33346996 [0,1,0,0,0,0|1,0,1]=3 375 B13R1.8842 C=C(F)C1(CC(=O)O)CCCOC1 Amb33347005 [0,1,0,0,0,0|2,0,1]=4 376 B13R1.8842 C=C(F)C1(CC(=O)O)CCOCC1 Amb32992420 [0,1,0,0,0,0|2,0,1]=4 377 B13R1.8842 C=C(F)C1(CC(=O)O)CCSCC1 Amb33347000 [0,1,0,0,0,0|2,0,1]=4 378 B13R1.8842 CC(=O)C1(CC(=O)O)CCCCC1 Amb27228089 [0,1,0,0,0,0|1,0,1]=3 379 B13R1.8842 CC(=O)NC1(C(F)F)CCCCC1 Amb25221289 [0,1,0,0,0,0|3,0,0]=4 380 B13R1.8842 CC(=O)NC1(C(N)=O)CCCCC1 Amb26847852 [0,1,0,0,0,0|2,0,1]=4 381 B13R1.8842 CC(N)C1(CC(=O)O)CCCCC1 Amb28251748 [0,1,0,0,0,0|0,0,0]=1 382 B13R1.8842 CC(N)C1(CC(=O)O)CCOCC1 Amb27472848 [0,1,0,0,0,0|1,0,0]=2 383 B13R1.8842 CN(C)C1(CC(=O)O)CCCOC1 Amb27849618 [0,1,0,0,0,0|3,0,0]=4 384 B13R1.8842 CN(C)C1(CC(=O)O)CCCSC1 Amb28314309 [0,1,0,0,0,0|3,0,0]=4 385 B13R1.8842 CN(C)C1(CC(N)=O)CCCCC1 Amb27180318 [0,1,0,0,0,0|3,0,0]=4 386 B13R1.8842 N=C(N)C1(NC(N)=O)CCCCC1 Amb28139358 [0,1,0,0,0,0|2,0,1]=4 387 B13R1.8842 NC(=O)CC1(C(N)=O)CCCCC1 Amb27179269 [0,1,0,0,0,0|1,0,1]=3 388 B13R1.8842 NC(=O)NC1(C(F)F)CCCCC1 Amb27980118 [0,1,0,0,0,0|3,0,0]=4 389 B13R1.8842 O=C(O)CC1(C(=O)O)CCCCC1 Amb2613295 [0,1,0,0,0,0|1,0,1]=3 390 B13R1.8842 O=C(O)CC1(C(=O)O)CCOCC1 Amb16233339 [0,1,0,0,0,0|2,0,1]=4 391 B11R0.77 CCC\C=C\C(CN)CC(=O)O Amb32953524 [0,0,1,0,0,0|0,0,2]=3 392 B11R0.216 CCCCC(N)(CC)CC(=O)O Amb33255462 [0,0,1,0,0,0|2,0,0]=3 393 B11R0.216 CCCCC(N)(CC)CC(N)=O Amb33255017 [0,0,1,0,0,0|3,0,0]=4 394 B11R0.216 CCCCC(O)(CN)CC(=O)O Amb33346940 [0,0,1,0,0,0|1,0,0]=2 395 B11R0.216 CCOCC(N)(CN)CC(=O)O Amb32787721 [0,0,1,0,0,0|2,0,0]=3 396 B11R0.216 CCOCC(N)(CN)CC(N)=O Amb32787663 [0,0,1,0,0,0|3,0,0]=4 397 B13R2.437 CC(=O)C1CCC12CCCCC2 Amb29874095 [0,0,0,1,0,0|2,0,0]=3 398 B13R2.437 CC(=O)N1CCC12CCCCC2 Amb28319865 [0,0,0,1,0,0|3,0,0]=4 399 B13R2.437 CC(C)C1NCC12CCCCC2 Amb25843481 [0,0,0,1,0,0|2,0,1]=4 400 B13R2.437 CC(O)C1CCC12CCCCC2 Amb35619208 [0,0,0,1,0,0|2,0,1]=4 401 B13R2.437 NC(=O)C1NCC12CCOCC2 Amb28434444 [0,0,0,1,0,0|2,0,0]=3 402 B13R2.437 NC(=O)N1CCC12CCCCC2 Amb27829225 [0,0,0,1,0,0|3,0,0]=4 403 B13R2.437 O=C(O)C1CCC12CCCCC2 Amb27983816 [0,0,0,1,0,0|1,0,0]=2 404 B13R2.437 O=C(O)C1CCC12CCOCC2 Amb32667467 [0,0,0,1,0,0|2,0,0]=3 405 B13R2.437 O=C(O)C1NCC12CCOCC2 Amb32667356 [0,0,0,1,0,0|1,0,0]=2 406 B13R2.437 O=C(O)C1NCC12CCOCC2 Amb32667357 [0,0,0,1,0,0|1,0,0]=2 407 B13R2.683 O=C(O)C[C@]12CCCC[C@H]1NC2 Amb27231785 [0,0,0,1,0,0|0,0,0]=1 408 B13R2.2363 C=C[C@]12CCCC[C@H]1CC(=O)C2 Amb27212539 [0,0,0,1,0,0|2,0,1]=4 409 B13R2.2363 CC1CC2(CBr)CCCCC2O1 Amb32660081 [0,0,0,1,0,0|2,0,1]=4 410 B13R2.2363 CC1CC2(CN)CCCCC2O1 Amb32660070 [0,0,0,1,0,0|1,0,1]=3 411 B13R2.2363 CC1CC2(CO)CCCCC2O1 Amb32660076 [0,0,0,1,0,0|2,0,1]=4 412 B13R2.2363 CC[C@@]12CCCCC1=CC(=O)C2 Amb27802739 [0,0,0,1,0,0|2,0,1]=4 413 B13R2.2363 O=C1CC2(CO)CCCCC2N1 Amb27445872 [0,0,0,1,0,0|2,0,0]=3 414 B13R2.2363 O=C1CC2CCCCC2(CI)O1 Amb25036237 [0,0,0,1,0,0|3,0,0]=4 415 B13R2.2363 O=C1C[C@@H]2CCCC[C@]2(CI)O1 Amb32667415 [0,0,0,1,0,0|3,0,0]=4 416 B13R2.2363 O=C1C[C@H]2CCCC[C@]2(CI)O1 Amb34915333 [0,0,0,1,0,0|3,0,0]=4 417 B13R2.3074 C=C1C(C(C)=O)C12CCCCC2 Amb26936478 [0,0,0,1,0,0|2,0,1]=4 418 B13R2.3074 CC1C(C(=O)O)C12CCNCC2 Amb27812251 [0,0,0,1,0,0|2,0,0]=3 419 B13R2.4014 C=C1OC(=O)OC12CCCCC2 Amb1035862 [0,0,0,1,0,0|2,0,1]=4 420 B13R2.4014 CC1CC(=O)NC12CCCCC2 Amb25277252 [0,0,0,1,0,0|3,0,0]=4 421 B13R2.4014 CC1NC(=O)CC12CCCCC2 Amb25717286 [0,0,0,1,0,0|2,0,0]=3 422 B13R2.4014 CC1NC(=O)CC12CCCOC2 Amb28256202 [0,0,0,1,0,0|3,0,0]=4 423 B13R2.4014 CC1NC(=O)CC12CCCSC2 Amb28381616 [0,0,0,1,0,0|3,0,0]=4 424 B13R2.4014 CC1NC(=O)CC12CCOCC2 Amb27664512 [0,0,0,1,0,0|3,0,0]=4 425 B13R2.4014 CC1NC(=O)CC12CCSCC2 Amb26022661 [0,0,0,1,0,0|3,0,0]=4 426 B13R2.4014 CN1CC(N)C2(CCCCC2)C1 Amb32723524 [0,0,0,1,0,0|3,0,0]=4 427 B13R2.4014 O=C1CC(=O)C2(CCCCC2)C1 Amb27432703 [0,0,0,1,0,0|2,0,1]=4 428 B13R2.4014 O=C1CC2(CCCCC2)C(=O)N1 Amb444977 [0,0,0,1,0,0|2,0,1]=4 429 B13R2.4014 O=C1CC2(CCCCC2)C(=O)O1 Amb439625 [0,0,0,1,0,0|1,0,1]=3 430 B13R2.4014 O=C1CC2(CCCOC2)C(=O)O1 Amb27882598 [0,0,0,1,0,0|2,0,1]=4 431 B13R2.4014 O=C1CC2(CCOCC2)C(=O)O1 Amb9472958 [0,0,0,1,0,0|2,0,1]=4 432 B13R2.4014 O=C1NC2(CCCCC2)C(=O)O1 Amb26068458 [0,0,0,1,0,0|2,0,1]=4 433 B13R2.7485 C=CC12CCCC(CC(=O)C1)C2 Amb27974636 [0,0,0,1,0,0|2,0,1]=4 434 B13R2.7485 N#CC12CCCC(CC(=O)C1)C2 Amb18645918 [0,0,0,1,0,0|1,0,2]=4 435 B13R2.7673 C=C(C)CC1(CBr)CC2CC2C1 Amb32689637 [0,0,0,1,0,0|3,0,0]=4 436 B13R2.7673 C=C(C)CC1(CCl)CC2CC2C1 Amb32689631 [0,0,0,1,0,0|3,0,0]=4 437 B13R2.7673 C=C(Cl)CC1(CBr)CC2CC2C1 Amb32689688 [0,0,0,1,0,0|3,0,0]=4 438 B13R2.7673 C=C(Cl)CC1(CCl)CC2CC2C1 Amb32689682 [0,0,0,1,0,0|3,0,0]=4 439 B13R2.7673 NCC1(CC(=O)O)C[C@@H]2C[C@H]2C1 Amb28411566 [0,0,0,1,0,0|0,0,0]=1 440 B13R2.7673 NCC1(CC(F)F)CC2CC2C1 Amb35742859 [0,0,0,1,0,0|2,0,1]=4 441 B13R2.7673 NC[C@]1(CC(=O)O)C[C@@H]2C[C@@H]2C1 Amb27477816 [0,0,0,1,0,0|0,0,0]=1 442 B13R2.8494 CC1CC1C2(CN)CCCCC2 Amb33145405 [0,0,0,1,0,0|2,0,1]=4 443 B13R2.8499 NC[C@@]1(CC(=O)O)CC[C@@H]2C[C@@H]21 Amb27216483 [0,0,0,1,0,0|0,0,0]=1 444 B13R2.8499 NC[C@]1(CC(=O)O)CC[C@@H]2C[C@@H]21 Amb27640566 [0,0,0,1,0,0|0,0,0]=1 445 B13R2.11128 O=C1C=COC2(CCCCC2)C1 Amb24649510 [0,0,0,1,0,0|3,0,0]=4 446 B13R2.11128 O=C1CC2(CCCCC2)CCN1 Amb28288238 [0,0,0,1,0,0|2,0,0]=3 447 B13R2.11128 O=C1CC2(CCCCC2)CCO1 Amb24737335 [0,0,0,1,0,0|1,0,0]=2 448 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb18559404 [0,0,0,1,0,0|3,0,0]=4 449 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb24179151 [0,0,0,1,0,0|3,0,0]=4 450 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb33714472 [0,0,0,1,0,0|3,0,0]=4 451 B13R2.11128 O=C1CCCC2(CCCCC2)C1 Amb4009192 [0,0,0,1,0,0|2,0,0]=3 452 B13R2.11128 O=C1CCCC2(CCCCC2)N1 Amb25150848 [0,0,0,1,0,0|3,0,0]=4 453 B13R2.11128 O=C1CCNC2(CCCCC2)C1 Amb18826926 [0,0,0,1,0,0|3,0,0]=4 454 B13R2.11128 O=C1CCOC2(CCCCC2)C1 Amb18826491 [0,0,0,1,0,0|3,0,0]=4 455 B13R2.11128 O=C1CCSC2(CCCCC2)C1 Amb18822698 [0,0,0,1,0,0|3,0,0]=4 456 B13R2.11128 O=C1NC2(CCCNC2)CCO1 Amb25756619 [0,0,0,1,0,0|3,0,0]=4 457 B13R2.11128 O=C1NC2(CCNCC2)CCO1 Amb23440221 [0,0,0,1,0,0|3,0,0]=4 458 B13R2.11128 O=C1NCCC2(CCCCC2)N1 Amb27186676 [0,0,0,1,0,0|3,0,0]=4 459 B13R2.11128 O=C1NCCC2(CCCCC2)O1 Amb26587318 [0,0,0,1,0,0|3,0,0]=4 460 B13R2.11128 OC1CNCC2(CCOCC2)C1 Amb32675278 [0,0,0,1,0,0|2,0,1]=4 461 B13R2.11128 OC1CNCC2(CCOCC2)C1 Amb32679559 [0,0,0,1,0,0|2,0,1]=4 462 B13R2.11462 O=S1(=O)CC2(CCOCC2)CN1 Amb35788443 [0,0,0,1,0,0|2,0,1]=4 463 B13R2.17946 NCC1(CC2CC2)CCCCC1 Amb27194892 [0,0,0,1,0,0|2,0,1]=4 464 B13R2.17946 OCC1(CC2CO2)CCCCC1 Amb32673946 [0,0,0,1,0,0|2,0,1]=4 465 B13R2.23344 CC(=O)CC12CCC(CC1)CC2 Amb27177579 [0,0,0,1,0,0|2,0,0]=3 466 B13R2.23344 NS(=O)CC12CCC(CC1)CC2 Amb32720778 [0,0,0,1,0,0|3,0,0]=4 467 B13R2.23344 O=C(O)CC12CCC(CC1)CC2 Amb33295158 [0,0,0,1,0,0|1,0,0]=2 468 B13R2.23344 O=C(O)CC12CCC(CC1)CO2 Amb33041544 [0,0,0,1,0,0|2,0,0]=3 469 B13R2.23344 O=S(Cl)CC12CCC(CC1)CC2 Amb32720777 [0,0,0,1,0,0|3,0,0]=4 470 B13R2.23344 O=S(O)CC12CCN(CC1)CC2 Amb33070978 [0,0,0,1,0,0|3,0,0]=4 471 B13R2.23344 O=S([O-])CC12CCC(CC1)CC2 Amb32755042 [0,0,0,1,0,0|2,0,1]=4 472 B11R1.1062 C=C(C)CC1(CBr)CCCC1 Amb32689623 [0,0,0,0,1,0|3,0,0]=4 473 B11R1.1062 C=C(C)CC1(CCl)CCCC1 Amb32689615 [0,0,0,0,1,0|3,0,0]=4 474 B11R1.1062 C=C(C)CC1(CN)CCCS1 Amb27480685 [0,0,0,0,1,0|3,0,0]=4 475 B11R1.1062 C=C(Cl)CC1(CBr)CCCC1 Amb32689674 [0,0,0,0,1,0|3,0,0]=4 476 B11R1.1062 C=C(Cl)CC1(CCl)CCCC1 Amb32689666 [0,0,0,0,1,0|3,0,0]=4 477 B11R1.1062 C=CC1(CC(=O)O)CCCC1 Amb26491432 [0,0,0,0,1,0|1,0,1]=3 478 B11R1.1062 C=CC1(CC(=O)O)CCOC1 Amb33097618 [0,0,0,0,1,0|2,0,1]=4 479 B11R1.1062 CC(=O)CC1(C=O)CCCC1 Amb28208364 [0,0,0,0,1,0|2,0,1]=4 480 B11R1.1062 CC(=O)NC1(CN)CCCC1 Amb2606124 [0,0,0,0,1,0|2,0,0]=3 481 B11R1.1062 CC(C)CC1(CN)CCCC1 Amb18996172 [0,0,0,0,1,0|2,0,1]=4 482 B11R1.1062 CC(O)CC1(CN)CCCS1 Amb27257806 [0,0,0,0,1,0|2,0,1]=4 483 B11R1.1062 CCC1(CC(=O)O)CCCC1 Amb27795146 [0,0,0,0,1,0|1,0,0]=2 484 B11R1.1062 CCC1(NC(=O)Cl)CCCC1 Amb35633537 [0,0,0,0,1,0|3,0,0]=4 485 B11R1.1062 CCC1(NC(N)=O)CCCC1 Amb27437771 [0,0,0,0,1,0|3,0,0]=4 486 B11R1.1062 CCC1(OC(=O)Cl)CCCC1 Amb33297278 [0,0,0,0,1,0|3,0,0]=4 487 B11R1.1062 CN(C)CC1(CN)CCCC1 Amb17334404 [0,0,0,0,1,0|3,0,0]=4 488 B11R1.1062 CNC1(CC(=O)O)CCOC1 Amb28241622 [0,0,0,0,1,0|3,0,0]=4 489 B11R1.1062 COC1(CC(=O)O)CCCC1 Amb28133014 [0,0,0,0,1,0|2,0,0]=3 490 B11R1.1062 CS(=O)CC1(CN)CCCC1 Amb30014492 [0,0,0,0,1,0|2,0,0]=3 491 B11R1.1062 CS(=O)NC1(CN)CCCC1 Amb27613466 [0,0,0,0,1,0|3,0,0]=4 492 B11R1.1062 NCC1(CC(=O)O)CCCC1 Amb18830607 [0,0,0,0,1,0|0,0,0]=1 493 B11R1.1062 NCC1(CC(=O)O)CCCC1 Amb33547662 [0,0,0,0,1,0|0,0,0]=1 494 B11R1.1062 NCC1(CC(N)=O)CCOC1 Amb27666006 [0,0,0,0,1,0|2,0,0]=3 495 B11R1.1062 NCC1(NC(N)=O)CCCC1 Amb18251518 [0,0,0,0,1,0|2,0,0]=3 496 B11R1.1062 NOC1(CC(=O)O)CCCC1 Amb33072016 [0,0,0,0,1,0|1,0,0]=2 497 B11R1.1062 NOC1(CC(=O)O)CCOC1 Amb33072038 [0,0,0,0,1,0|2,0,0]=3 498 B11R1.1062 O=C(O)CC1(CCl)OCCO1 Amb27658950 [0,0,0,0,1,0|3,0,0]=4 499 B11R1.1062 O=C(O)CC1(CO)CCCC1 Amb33457475 [0,0,0,0,1,0|1,0,0]=2 500 B11R1.1062 O=C([O-])CC1(CO)CCCC1 Amb33457271 [0,0,0,0,1,0|1,0,1]=3 501 B11R1.1074 C#CC1(C(=O)O)CCCCC1 Amb27862593 [0,0,0,0,1,0|1,0,1]=3 502 B11R1.1074 C#CC1(C(C)=O)CCCCC1 Amb24529793 [0,0,0,0,1,0|2,0,1]=4 503 B11R1.1074 C#CC1(C(N)=O)CCCCC1 Amb25845290 [0,0,0,0,1,0|2,0,1]=4 504 B11R1.1074 C=C(C)C1(CN)CCCCC1 Amb33199961 [0,0,0,0,1,0|2,0,0]=3 505 B11R1.1074 C=C(C)C1(CO)CCCCC1 Amb28321319 [0,0,0,0,1,0|3,0,0]=4 506 B11R1.1074 C=CC1(C(=O)O)CCCOC1 Amb27816630 [0,0,0,0,1,0|2,0,1]=4 507 B11R1.1074 C=CC1(C(=O)O)CCOCC1 Amb35752081 [0,0,0,0,1,0|2,0,1]=4 508 B11R1.1074 CC(=O)C1(CN)CCCCC1 Amb24445563 [0,0,0,0,1,0|1,0,0]=2 509 B11R1.1074 CC(=O)C1(CN)CCCOC1 Amb33307697 [0,0,0,0,1,0|2,0,0]=3 510 B11R1.1074 CC(=O)C1(CN)CCOCC1 Amb33447094 [0,0,0,0,1,0|2,0,0]=3 511 B11R1.1074 CC(=O)C1(CO)CCCCC1 Amb27961461 [0,0,0,0,1,0|2,0,0]=3 512 B11R1.1074 CC(=O)C1(OCl)CCCCC1 Amb28122366 [0,0,0,0,1,0|3,0,0]=4 513 B11R1.1074 CC(C)C1(CN)CCCCC1 Amb26991286 [0,0,0,0,1,0|2,0,1]=4 514 B11R1.1074 CC(O)C1(CN)CCCCC1 Amb24446080 [0,0,0,0,1,0|1,0,1]=3 515 B11R1.1074 CC(O)C1(CN)CCCOC1 Amb25737357 [0,0,0,0,1,0|2,0,1]=4 516 B11R1.1074 CC(O)C1(CN)CCOCC1 Amb27619579 [0,0,0,0,1,0|2,0,1]=4 517 B11R1.1074 CCC1(C(=O)O)CC=CCC1 Amb26058329 [0,0,0,0,1,0|1,0,2]=4 518 B11R1.1074 CCC1(C(=O)O)CCCCC1 Amb1016524 [0,0,0,0,1,0|1,0,0]=2 519 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb15701483 [0,0,0,0,1,0|2,0,0]=3 520 B11R1.1074 CCC1(C(=O)O)CCCCN1 Amb19892167 [0,0,0,0,1,0|2,0,0]=3 521 B11R1.1074 CCC1(C(=O)O)CCCCO1 Amb26529853 [0,0,0,0,1,0|2,0,0]=3 522 B11R1.1074 CCC1(C(=O)O)CCCNC1 Amb19516876 [0,0,0,0,1,0|2,0,0]=3 523 B11R1.1074 CCC1(C(=O)O)CCCNC1 Amb21960031 [0,0,0,0,1,0|2,0,0]=3 524 B11R1.1074 CCC1(C(=O)O)CCCOC1 Amb18288385 [0,0,0,0,1,0|2,0,0]=3 525 B11R1.1074 CCC1(C(=O)O)CCNCC1 Amb15701262 [0,0,0,0,1,0|2,0,0]=3 526 B11R1.1074 CCC1(C(=O)O)CCNCC1 Amb17622113 [0,0,0,0,1,0|2,0,0]=3 527 B11R1.1074 CCC1(C(=O)O)CCOCC1 Amb18288039 [0,0,0,0,1,0|2,0,0]=3 528 B11R1.1074 CCC1(C(=O)O)CNCCO1 Amb33231292 [0,0,0,0,1,0|3,0,0]=4 529 B11R1.1074 CCC1(C(=O)O)COCCN1 Amb25848403 [0,0,0,0,1,0|3,0,0]=4 530 B11R1.1074 CCC1(C(=O)O)COCOC1 Amb24725142 [0,0,0,0,1,0|3,0,0]=4 531 B11R1.1074 CCC1(C(=O)O)SCCCS1 Amb27233501 [0,0,0,0,1,0|3,0,0]=4 532 B11R1.1074 CCC1(C(C)=O)CCCNC1 Amb24509473 [0,0,0,0,1,0|3,0,0]=4 533 B11R1.1074 CCC1(C(C)=O)CCNCC1 Amb25865677 [0,0,0,0,1,0|3,0,0]=4 534 B11R1.1074 CCC1(C(N)=O)CCCCC1 Amb26447680 [0,0,0,0,1,0|2,0,0]=3 535 B11R1.1074 CCC1(C(N)=O)CCCNC1 Amb19517053 [0,0,0,0,1,0|3,0,0]=4 536 B11R1.1074 CCC1(C(N)=O)CCCNC1 Amb22587485 [0,0,0,0,1,0|3,0,0]=4 537 B11R1.1074 CCC1(C(N)=O)CCNCC1 Amb19516742 [0,0,0,0,1,0|3,0,0]=4 538 B11R1.1074 CCC1(C(N)=O)CCNCC1 Amb22498835 [0,0,0,0,1,0|3,0,0]=4 539 B11R1.1074 CN(C)C1(CN)CCCCC1 Amb13949086 [0,0,0,0,1,0|3,0,0]=4 540 B11R1.1074 CN(C)C1(CN)CCCCC1 Amb439914 [0,0,0,0,1,0|3,0,0]=4 541 B11R1.1074 CNC1(C(=O)O)CCCCC1 Amb9619738 [0,0,0,0,1,0|2,0,0]=3 542 B11R1.1074 CNC1(C(=O)O)CCOCC1 Amb32653408 [0,0,0,0,1,0|3,0,0]=4 543 B11R1.1074 CNC1(C(=O)O)CCOCC1 Amb9619632 [0,0,0,0,1,0|3,0,0]=4 544 B11R1.1074 CNC1(C(=O)O)CCSCC1 Amb18282840 [0,0,0,0,1,0|3,0,0]=4 545 B11R1.1074 CNC1(C(C)=O)CCCCC1 Amb24406380 [0,0,0,0,1,0|3,0,0]=4 546 B11R1.1074 CNC1(C(N)=O)CCCCC1 Amb18950561 [0,0,0,0,1,0|3,0,0]=4 547 B11R1.1074 COC1(C(=O)Cl)CCCCC1 Amb25264353 [0,0,0,0,1,0|3,0,0]=4 548 B11R1.1074 COC1(C(=O)O)CCCCC1 Amb18953825 [0,0,0,0,1,0|2,0,0]=3 549 B11R1.1074 COC1(C(=O)O)CCCNC1 Amb32675007 [0,0,0,0,1,0|3,0,0]=4 550 B11R1.1074 COC1(C(=O)O)CCCOC1 Amb25884892 [0,0,0,0,1,0|3,0,0]=4 551 B11R1.1074 COC1(C(=O)O)CCCSC1 Amb18287490 [0,0,0,0,1,0|3,0,0]=4 552 B11R1.1074 COC1(C(=O)O)CCNCC1 Amb24329197 [0,0,0,0,1,0|3,0,0]=4 553 B11R1.1074 COC1(C(=O)O)CCNCC1 Amb24330498 [0,0,0,0,1,0|3,0,0]=4 554 B11R1.1074 COC1(C(=O)O)CCOCC1 Amb16233481 [0,0,0,0,1,0|3,0,0]=4 555 B11R1.1074 COC1(C(C)=O)CCCCC1 Amb25730283 [0,0,0,0,1,0|3,0,0]=4 556 B11R1.1074 COC1(C(N)=O)CCCCC1 Amb28118929 [0,0,0,0,1,0|3,0,0]=4 557 B11R1.1074 CSC1(C(=O)O)CCCOC1 Amb29872480 [0,0,0,0,1,0|3,0,0]=4 558 B11R1.1074 CSC1(C(=O)O)CCNCC1 Amb26924819 [0,0,0,0,1,0|3,0,0]=4 559 B11R1.1074 CSC1(C(=O)O)CCOCC1 Amb18953838 [0,0,0,0,1,0|3,0,0]=4 560 B11R1.1074 CSC1(C(C)=O)CCCCC1 Amb27859434 [0,0,0,0,1,0|3,0,0]=4 561 B11R1.1074 N#CC1(C(=O)O)CCCCC1 Amb33529310 [0,0,0,0,1,0|0,0,2]=3 562 B11R1.1074 N#CC1(C(=O)O)CCCOC1 Amb33550120 [0,0,0,0,1,0|1,0,2]=4 563 B11R1.1074 N#CC1(C(=O)O)CCNCC1 Amb27656940 [0,0,0,0,1,0|1,0,2]=4 564 B11R1.1074 N#CC1(C(=O)O)CCNCC1 Amb33482580 [0,0,0,0,1,0|1,0,2]=4 565 B11R1.1074 N#CC1(C(=O)O)CCOCC1 Amb33529311 [0,0,0,0,1,0|1,0,2]=4 566 B11R1.1074 N#CC1(C(=O)O)CCSCC1 Amb25796559 [0,0,0,0,1,0|1,0,2]=4 567 B11R1.1074 N#CC1(C(N)=O)CCCCC1 Amb18179436 [0,0,0,0,1,0|1,0,2]=4 568 B11R1.1074 NC(=O)C1(CF)CCOCC1 Amb29837951 [0,0,0,0,1,0|3,0,0]=4 569 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb18959883 [0,0,0,0,1,0|0,0,0]=1 570 B11R1.1074 NCC1(C(=O)O)CCCCC1 Amb22371113 [0,0,0,0,1,0|0,0,0]=1 571 B11R1.1074 NCC1(C(=O)O)CCCNC1 Amb27630487 [0,0,0,0,1,0|1,0,0]=2 572 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb26021711 [0,0,0,0,1,0|1,0,0]=2 573 B11R1.1074 NCC1(C(=O)O)CCCOC1 Amb30584733 [0,0,0,0,1,0|1,0,0]=2 574 B11R1.1074 NCC1(C(=O)O)CCNCC1 Amb26341115 [0,0,0,0,1,0|1,0,0]=2 575 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb24077508 [0,0,0,0,1,0|1,0,0]=2 576 B11R1.1074 NCC1(C(=O)O)CCOCC1 Amb8631333 [0,0,0,0,1,0|1,0,0]=2 577 B11R1.1074 NCC1(C(F)F)CCCCC1 Amb33436890 [0,0,0,0,1,0|2,0,1]=4 578 B11R1.1074 NCC1(C(N)=O)CCOCC1 Amb13951237 [0,0,0,0,1,0|2,0,0]=3 579 B11R1.1074 NCC1(C(N)=O)CCOCC1 Amb7969483 [0,0,0,0,1,0|2,0,0]=3 580 B11R1.1074 NNC1(C(=O)O)CCCCC1 Amb19515065 [0,0,0,0,1,0|1,0,0]=2 581 B11R1.1074 O=C(O)C1(CBr)CCCCC1 Amb27803027 [0,0,0,0,1,0|1,0,0]=2 582 B11R1.1074 O=C(O)C1(CBr)CCOCC1 Amb28456754 [0,0,0,0,1,0|2,0,0]=3 583 B11R1.1074 O=C(O)C1(CCl)CC=CCC1 Amb28385681 [0,0,0,0,1,0|1,0,2]=4 584 B11R1.1074 O=C(O)C1(CCl)CCCCC1 Amb27439666 [0,0,0,0,1,0|1,0,0]=2 585 B11R1.1074 O=C(O)C1(CF)CCCCO1 Amb27647178 [0,0,0,0,1,0|2,0,0]=3 586 B11R1.1074 O=C(O)C1(CF)CCNCC1 Amb27242582 [0,0,0,0,1,0|2,0,0]=3 587 B11R1.1074 O=C(O)C1(CF)CCOCC1 Amb25348064 [0,0,0,0,1,0|2,0,0]=3 588 B11R1.1074 O=C(O)C1(CO)CCCCC1 Amb17400032 [0,0,0,0,1,0|1,0,0]=2 589 B11R1.1074 O=C(O)C1(CO)CCCNC1 Amb26000833 [0,0,0,0,1,0|2,0,0]=3 590 B11R1.1074 O=C(O)C1(CO)CCCOC1 Amb26454809 [0,0,0,0,1,0|2,0,0]=3 591 B11R1.1074 O=C(O)C1(CO)CCCSC1 Amb32946227 [0,0,0,0,1,0|2,0,0]=3 592 B11R1.1074 O=C(O)C1(CO)CCNCC1 Amb28397256 [0,0,0,0,1,0|2,0,0]=3 593 B11R1.1074 O=C(O)C1(CO)CCOCC1 Amb17400061 [0,0,0,0,1,0|2,0,0]=3 594 B11R1.1074 O=C(O)C1(CO)CCSCC1 Amb32946216 [0,0,0,0,1,0|2,0,0]=3 595 B11R1.1074 O=CC1(C(=O)O)CCCCC1 Amb27641173 [0,0,0,0,1,0|1,0,1]=3 596 B11R1.1074 [C-]#[N+]C1(C(=O)O)CCNCC1 Amb27481345 [0,0,0,0,1,0|3,0,0]=4 597 B13R1.5993 C#CC1(OCC(=O)O)CCCCC1 Amb32946389 [0,0,0,0,0,1|1,0,1]=3 598 B13R1.5993 CC(=O)NCC1(CN)CCCCC1 Amb27764985 [0,0,0,0,0,1|1,0,0]=2 599 B13R1.5993 CC(=O)NCC1(CO)CCOCC1 Amb24661004 [0,0,0,0,0,1|3,0,0]=4 600 B13R1.5993 CC(C)OCC1(CN)CCCCC1 Amb33171726 [0,0,0,0,0,1|2,0,1]=4 601 B13R1.5993 CCC1(CNC(=O)Cl)CCOCC1 Amb35633446 [0,0,0,0,0,1|3,0,0]=4 602 B13R1.5993 CN(C)CCC1(CN)CCCCC1 Amb32938545 [0,0,0,0,0,1|3,0,0]=4 603 B13R1.5993 COC1(CNC(C)=O)CCCCC1 Amb28051014 [0,0,0,0,0,1|3,0,0]=4 604 B13R1.5993 CSC1(CNC(=O)Cl)CCCCC1 Amb35633557 [0,0,0,0,0,1|3,0,0]=4 605 B13R1.5993 CSC1(CNC(N)=O)CCCCC1 Amb28367642 [0,0,0,0,0,1|3,0,0]=4 606 B13R1.5993 NCC1(CC=C(Cl)Cl)CCCCC1 Amb30019313 [0,0,0,0,0,1|2,0,0]=3 607 B13R1.5993 NCC1(CC=C(Cl)Cl)CCCOC1 Amb30019316 [0,0,0,0,0,1|3,0,0]=4 608 B13R1.5993 NCC1(CC=C(Cl)Cl)CCOCC1 Amb30019314 [0,0,0,0,0,1|3,0,0]=4 609 B13R1.5993 NCC1(CNC(N)=O)CCCCC1 Amb27776668 [0,0,0,0,0,1|1,0,0]=2 610 B13R1.5993 NCC1(NNC(N)=O)CCCCC1 Amb27657721 [0,0,0,0,0,1|2,0,0]=3 611 B13R1.6670 C=CC1(CC(=O)O)CCCCCC1 Amb33097592 [0,0,0,0,0,1|1,0,1]=3 612 B13R1.6670 CC(O)CC1(CN)CCCCCC1 Amb27768974 [0,0,0,0,0,1|1,0,1]=3 613 B13R1.6670 CNC1(CC(=O)O)CCCCCC1 Amb27853296 [0,0,0,0,0,1|2,0,0]=3 614 B13R1.6670 CNC1(CC(=O)O)CCCOCC1 Amb27180112 [0,0,0,0,0,1|2,0,0]=3 615 B13R1.6670 CNC1(CC(N)=O)CCCOCC1 Amb27466952 [0,0,0,0,0,1|3,0,0]=4 616 B13R1.6670 NCC1(CC(=O)O)CCCOCC1 Amb27465634 [0,0,0,0,0,1|0,0,0]=1 617 B13R1.6670 NCC1(CC(=O)O)CCCSCC1 Amb35692700 [0,0,0,0,0,1|0,0,0]=1 618 B13R1.6670 NCC1(CC(=O)O)COCCOC1 Amb27875978 [0,0,0,0,0,1|1,0,0]=2 619 B13R1.6670 NCC1(NC(N)=O)CCCCCC1 Amb18252915 [0,0,0,0,0,1|2,0,0]=3 620 B13R1.6670 NOC1(CC(=O)O)CCCCCC1 Amb33098051 [0,0,0,0,0,1|1,0,0]=2 621 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [1,0,1,0,0,0|0,0,0]=2 622 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [1,0,1,0,0,0|0,0,0]=2 623 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [1,0,1,0,0,0|0,0,0]=2 624 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [1,0,1,0,0,0|1,0,0]=3 625 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [1,0,1,0,0,0|1,0,0]=3 626 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [1,0,1,0,0,0|1,0,0]=3 627 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [1,0,1,0,0,0|1,0,0]=3 628 B10R0.6 CCCSCC(N)CC(=O)O Amb32687888 [1,0,1,0,0,0|1,0,0]=3 629 B10R0.6 CCC\C=C\C(C)CC(=O)O Amb33448450 [1,0,1,0,0,0|0,0,2]=4 630 B10R0.6 CCC\C=C\C(N)CC(=O)O Amb33429157 [1,0,1,0,0,0|0,0,2]=4 631 B10R0.6 CCSCCC(N)CC(=O)O Amb33254745 [1,0,1,0,0,0|1,0,0]=3 632 B10R0.6 CCSCCC(N)CC(N)=O Amb33308127 [1,0,1,0,0,0|2,0,0]=4 633 B10R0.6 CSCCCC(N)CC(=O)O Amb33308380 [1,0,1,0,0,0|1,0,0]=3 634 B10R0.6 CSCCCC(N)CC(N)=O Amb32787351 [1,0,1,0,0,0|2,0,0]=4 635 B10R0.6 NCCCC[C@@H](N)CC(=O)O Amb22746256 [1,0,1,0,0,0|1,0,0]=3 636 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb16184018 [1,0,1,0,0,0|1,0,0]=3 637 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb22369388 [1,0,1,0,0,0|1,0,0]=3 638 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb33929234 [1,0,1,0,0,0|1,0,0]=3 639 B10R0.6 NCCCC[C@H](N)CC(N)=O Amb32650909 [1,0,1,0,0,0|2,0,0]=4 640 B10R0.24 C=CCC(CBr)CCCCC Amb32689430 [1,0,1,0,0,0|2,0,0]=4 641 B10R0.24 C=CCC(CCl)CCCCC Amb32689474 [1,0,1,0,0,0|2,0,0]=4 642 B10R0.87 CCCCC(CC)CC(=O)O Amb18797358 [1,0,1,0,0,0|1,0,0]=3 643 B10R0.87 CCCCC(CN)CC(=O)O Amb33171809 [1,0,1,0,0,0|0,0,0]=2 644 B10R0.87 CCSCC(CN)CC(=O)O Amb33224190 [1,0,1,0,0,0|1,0,0]=3 645 B10R0.87 CC\C=C\C(CN)CC(=O)O Amb33080084 [1,0,1,0,0,0|0,0,2]=4 646 B10R0.87 COCCC(CN)CC(=O)O Amb33377833 [1,0,1,0,0,0|1,0,0]=3 647 B10R0.87 CSCCC(CN)CC(=O)O Amb33199122 [1,0,1,0,0,0|1,0,0]=3 648 B10R0.10 CCC(CC)(CN)CC(=O)O Amb18645212 [1,0,1,0,0,0|0,0,0]=2 649 B10R0.102 CCC(N)(COC)CC(N)=O Amb33254803 [1,0,1,0,0,0|2,0,0]=4 650 B10R0.102 CCCC(N)(CC)CC(=O)O Amb32787782 [1,0,1,0,0,0|0,0,0]=2 651 B10R0.102 CCCC(N)(CC)CC(N)=O Amb32787961 [1,0,1,0,0,0|1,0,0]=3 652 B10R0.102 CCCC(O)(CN)CC(=O)O Amb33346942 [1,0,1,0,0,0|1,0,0]=3 653 B10R0.102 COCC(N)(CN)CC(=O)O Amb32787978 [1,0,1,0,0,0|2,0,0]=4 654 B10R0.122 CCCCC(C)(C)NC(C)=O Amb27673403 [1,0,1,0,0,0|2,0,0]=4 655 B10R0.122 CCCCC(C)(N)CC(=O)O Amb33254302 [1,0,1,0,0,0|0,0,0]=2 656 B10R0.122 CCCCC(C)(N)CC(N)=O Amb33255922 [1,0,1,0,0,0|1,0,0]=3 657 B10R0.122 CCCCC(C)(O)CC(=O)O Amb33036225 [1,0,1,0,0,0|1,0,0]=3 658 B10R0.122 CCCC[N+](C)(C)CC(=O)[O-] Amb33292513 [1,0,1,0,0,0|1,0,1]=4 659 B10R0.122 CCOCC(C)(N)CC(=O)O Amb33254607 [1,0,1,0,0,0|1,0,0]=3 660 B10R0.122 CCOCC(C)(N)CC(N)=O Amb33254100 [1,0,1,0,0,0|2,0,0]=4 661 B10R0.122 CCOCC(C)(O)CC(=O)O Amb33036224 [1,0,1,0,0,0|2,0,0]=4 662 B10R0.122 CCSCC(C)(C)CC(=O)O Amb33324033 [1,0,1,0,0,0|1,0,0]=3 663 B10R0.122 CCSCC(C)(N)CC(=O)O Amb33254871 [1,0,1,0,0,0|1,0,0]=3 664 B10R0.122 CCSCC(C)(N)CC(N)=O Amb33255555 [1,0,1,0,0,0|2,0,0]=4 665 B10R0.122 CCSCC(C)(O)CC(=O)O Amb33036263 [1,0,1,0,0,0|2,0,0]=4 666 B10R0.122 CC\C=C\C(C)(C)CC(=O)O Amb33268279 [1,0,1,0,0,0|0,0,2]=4 667 B10R0.122 COCCC(C)(C)CC(=O)O Amb32990133 [1,0,1,0,0,0|1,0,0]=3 668 B10R0.122 COCCC(C)(N)CC(=O)O Amb33254523 [1,0,1,0,0,0|1,0,0]=3 669 B10R0.122 COCCC(C)(N)CC(N)=O Amb32787600 [1,0,1,0,0,0|2,0,0]=4 670 B10R0.122 CSCCC(C)(C)CC(=O)O Amb32954253 [1,0,1,0,0,0|1,0,0]=3 671 B10R1.18 C=C(Br)CC1CCCCC1 Amb17938627 [2,0,0,0,0,0|2,0,0]=4 672 B10R1.18 CC(=O)CC1CCCCC1 Amb4034580 [2,0,0,0,0,0|1,0,0]=3 673 B10R1.18 CC(=O)CC1CCCCN1 Amb10607341 [2,0,0,0,0,0|2,0,0]=4 674 B10R1.18 CC(=O)CC1CCCCO1 Amb25298544 [2,0,0,0,0,0|2,0,0]=4 675 B10R1.18 CC(=O)CC1CCCNC1 Amb26047010 [2,0,0,0,0,0|2,0,0]=4 676 B10R1.18 CC(=O)CC1CCCOC1 Amb26842438 [2,0,0,0,0,0|2,0,0]=4 677 B10R1.18 CC(=O)CC1CCCSC1 Amb32726331 [2,0,0,0,0,0|2,0,0]=4 678 B10R1.18 CC(=O)CC1CCNCC1 Amb22227662 [2,0,0,0,0,0|2,0,0]=4 679 B10R1.18 CC(=O)CC1CCNCC1 Amb27395398 [2,0,0,0,0,0|2,0,0]=4 680 B10R1.18 CC(=O)CC1CCOCC1 Amb19374940 [2,0,0,0,0,0|2,0,0]=4 681 B10R1.18 CC(=O)CN1CCCCC1 Amb8427989 [2,0,0,0,0,0|2,0,0]=4 682 B10R1.18 CC(=O)C[C@H]1CCCCN1 Amb27807842 [2,0,0,0,0,0|2,0,0]=4 683 B10R1.18 CC(=O)NC1CCCCC1 Amb2237063 [2,0,0,0,0,0|2,0,0]=4 684 B10R1.18 CC(O)CC1CCCCC1 Amb26513002 [2,0,0,0,0,0|1,0,1]=4 685 B10R1.18 CN(O)CC1CCCCC1 Amb33362038 [2,0,0,0,0,0|2,0,0]=4 686 B10R1.18 CS(=O)CC1CCCCC1 Amb28197111 [2,0,0,0,0,0|2,0,0]=4 687 B10R1.18 C[C@@H](O)CC1CCCCC1 Amb26381356 [2,0,0,0,0,0|1,0,1]=4 688 B10R1.18 C[C@H](O)CC1CCCCC1 Amb27839520 [2,0,0,0,0,0|1,0,1]=4 689 B10R1.18 N=C(N)CC1CCCCC1 Amb6279225 [2,0,0,0,0,0|2,0,0]=4 690 B10R1.18 N=C(N)CC1CCCCC1 Amb8630603 [2,0,0,0,0,0|2,0,0]=4 691 B10R1.18 NC(=O)CC1CCCCC1 Amb33551594 [2,0,0,0,0,0|1,0,0]=3 692 B10R1.18 NC(=O)CC1CCCCN1 Amb1076649 [2,0,0,0,0,0|2,0,0]=4 693 B10R1.18 NC(=O)CC1CCCCN1 Amb22283730 [2,0,0,0,0,0|2,0,0]=4 694 B10R1.18 NC(=O)CC1CCCCO1 Amb27439121 [2,0,0,0,0,0|2,0,0]=4 695 B10R1.18 NC(=O)CC1CCCNC1 Amb18962911 [2,0,0,0,0,0|2,0,0]=4 696 B10R1.18 NC(=O)CC1CCCNC1 Amb20623575 [2,0,0,0,0,0|2,0,0]=4 697 B10R1.18 NC(=O)CC1CCNCC1 Amb22001615 [2,0,0,0,0,0|2,0,0]=4 698 B10R1.18 NC(=O)CC1CCNCC1 Amb6267154 [2,0,0,0,0,0|2,0,0]=4 699 B10R1.18 NC(=O)CC1CCOCC1 Amb22546405 [2,0,0,0,0,0|2,0,0]=4 700 B10R1.18 NC(=O)CC1CCSCC1 Amb27830749 [2,0,0,0,0,0|2,0,0]=4 701 B10R1.18 NC(=O)CN1CCCCC1 Amb17142861 [2,0,0,0,0,0|2,0,0]=4 702 B10R1.18 NC(=O)C[C@@H]1CCCCO1 Amb28341399 [2,0,0,0,0,0|2,0,0]=4 703 B10R1.18 NC(=O)NC1CCCCC1 Amb1151266 [2,0,0,0,0,0|2,0,0]=4 704 B10R1.18 NC(=O)OC1CCCCC1 Amb4012086 [2,0,0,0,0,0|2,0,0]=4 705 B10R1.18 NC(=O)SC1CCCCC1 Amb27607116 [2,0,0,0,0,0|2,0,0]=4 706 B10R1.18 NC(=S)CC1CCCCC1 Amb6264814 [2,0,0,0,0,0|1,1,0]=4 707 B10R1.18 NS(=O)CC1CCCCC1 Amb32720317 [2,0,0,0,0,0|2,0,0]=4 708 B10R1.18 O=C(Cl)CC1CCCCC1 Amb33528414 [2,0,0,0,0,0|1,0,0]=3 709 B10R1.18 O=C(Cl)CC1CCOCC1 Amb6572390 [2,0,0,0,0,0|2,0,0]=4 710 B10R1.18 O=C(Cl)NC1CCCCC1 Amb26068583 [2,0,0,0,0,0|2,0,0]=4 711 B10R1.18 O=C(Cl)OC1CCCCC1 Amb8390640 [2,0,0,0,0,0|2,0,0]=4 712 B10R1.18 O=C(Cl)SC1CCCCC1 Amb32679652 [2,0,0,0,0,0|2,0,0]=4 713 B10R1.18 O=C(F)NC1CCCCC1 Amb27242067 [2,0,0,0,0,0|2,0,0]=4 714 B10R1.18 O=C(O)C=C1CCCCC1 Amb2429191 [2,0,0,0,0,0|0,0,2]=4 715 B10R1.18 O=C(O)CC1=CCCCC1 Amb2721175 [2,0,0,0,0,0|0,0,2]=4 716 B10R1.18 O=C(O)CC1C=CCCC1 Amb18124573 [2,0,0,0,0,0|0,0,2]=4 717 B10R1.18 O=C(O)CC1CC=CCC1 Amb18643595 [2,0,0,0,0,0|0,0,2]=4 718 B10R1.18 O=C(O)CC1CCCCC1 Amb3939015 [2,0,0,0,0,0|0,0,0]=2 719 B10R1.18 O=C(O)CC1CCCCN1 Amb10576328 [2,0,0,0,0,0|1,0,0]=3 720 B10R1.18 O=C(O)CC1CCCCN1 Amb1083025 [2,0,0,0,0,0|1,0,0]=3 721 B10R1.18 O=C(O)CC1CCCCN1 Amb22587703 [2,0,0,0,0,0|1,0,0]=3 722 B10R1.18 O=C(O)CC1CCCCO1 Amb1091980 [2,0,0,0,0,0|1,0,0]=3 723 B10R1.18 O=C(O)CC1CCCNC1 Amb13952813 [2,0,0,0,0,0|1,0,0]=3 724 B10R1.18 O=C(O)CC1CCCNC1 Amb2684000 [2,0,0,0,0,0|1,0,0]=3 725 B10R1.18 O=C(O)CC1CCCOC1 Amb33544408 [2,0,0,0,0,0|1,0,0]=3 726 B10R1.18 O=C(O)CC1CCCSC1 Amb18199274 [2,0,0,0,0,0|1,0,0]=3 727 B10R1.18 O=C(O)CC1CCC[NH2+]C1 Amb2695000 [2,0,0,0,0,0|1,0,0]=3 728 B10R1.18 O=C(O)CC1CCNCC1 Amb2683992 [2,0,0,0,0,0|1,0,0]=3 729 B10R1.18 O=C(O)CC1CCNCC1 Amb33544417 [2,0,0,0,0,0|1,0,0]=3 730 B10R1.18 O=C(O)CC1CCOCC1 Amb2684134 [2,0,0,0,0,0|1,0,0]=3 731 B10R1.18 O=C(O)CC1CCSCC1 Amb18283322 [2,0,0,0,0,0|1,0,0]=3 732 B10R1.18 O=C(O)CC1CNCCN1 Amb8630816 [2,0,0,0,0,0|2,0,0]=4 733 B10R1.18 O=C(O)CC1CNCCO1 Amb21959647 [2,0,0,0,0,0|2,0,0]=4 734 B10R1.18 O=C(O)CC1CNCCO1 Amb2695419 [2,0,0,0,0,0|2,0,0]=4 735 B10R1.18 O=C(O)CC1CNCCS1 Amb27447972 [2,0,0,0,0,0|2,0,0]=4 736 B10R1.18 O=C(O)CC1COCCN1 Amb21964558 [2,0,0,0,0,0|2,0,0]=4 737 B10R1.18 O=C(O)CC1COCCN1 Amb2699908 [2,0,0,0,0,0|2,0,0]=4 738 B10R1.18 O=C(O)CC1COCCO1 Amb17507064 [2,0,0,0,0,0|2,0,0]=4 739 B10R1.18 O=C(O)CC1CSCCN1 Amb18199026 [2,0,0,0,0,0|2,0,0]=4 740 B10R1.18 O=C(O)CC1CSCCO1 Amb27444857 [2,0,0,0,0,0|2,0,0]=4 741 B10R1.18 O=C(O)CC1CSCCS1 Amb28068478 [2,0,0,0,0,0|2,0,0]=4 742 B10R1.18 O=C(O)CC1NCCCS1 Amb18645532 [2,0,0,0,0,0|2,0,0]=4 743 B10R1.18 O=C(O)CC1OCCCO1 Amb26656959 [2,0,0,0,0,0|2,0,0]=4 744 B10R1.18 O=C(O)CN1CCCCC1 Amb1098973 [2,0,0,0,0,0|1,0,0]=3 745 B10R1.18 O=C(O)CN1CCCCC1 Amb8503500 [2,0,0,0,0,0|1,0,0]=3 746 B10R1.18 O=C(O)CN1CCNCC1 Amb22728245 [2,0,0,0,0,0|2,0,0]=4 747 B10R1.18 O=C(O)CN1CCNCC1 Amb2700795 [2,0,0,0,0,0|2,0,0]=4 748 B10R1.18 O=C(O)CN1CCOCC1 Amb1099394 [2,0,0,0,0,0|2,0,0]=4 749 B10R1.18 O=C(O)CN1CCOCC1 Amb8513036 [2,0,0,0,0,0|2,0,0]=4 750 B10R1.18 O=C(O)CN1CCSCC1 Amb10072976 [2,0,0,0,0,0|2,0,0]=4 751 B10R1.18 O=C(O)CN1CCSCC1 Amb6307186 [2,0,0,0,0,0|2,0,0]=4 752 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 Amb25921210 [2,0,0,0,0,0|0,0,2]=4 753 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb13885774 [2,0,0,0,0,0|1,0,0]=3 754 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb33296463 [2,0,0,0,0,0|1,0,0]=3 755 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb25889983 [2,0,0,0,0,0|1,0,0]=3 756 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb32407008 [2,0,0,0,0,0|1,0,0]=3 757 B10R1.18 O=C(O)C[C@@H]1CNCCO1 Amb22747184 [2,0,0,0,0,0|2,0,0]=4 758 B10R1.18 O=C(O)C[C@@H]1COCCN1 Amb34913922 [2,0,0,0,0,0|2,0,0]=4 759 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb13885779 [2,0,0,0,0,0|1,0,0]=3 760 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb33456128 [2,0,0,0,0,0|1,0,0]=3 761 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb23401360 [2,0,0,0,0,0|1,0,0]=3 762 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb28077035 [2,0,0,0,0,0|1,0,0]=3 763 B10R1.18 O=C(O)C[C@H]1CNCCO1 Amb27751203 [2,0,0,0,0,0|2,0,0]=4 764 B10R1.18 O=C(O)C[C@H]1CNCCO1 Amb33801282 [2,0,0,0,0,0|2,0,0]=4 765 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb25992590 [2,0,0,0,0,0|2,0,0]=4 766 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb34913503 [2,0,0,0,0,0|2,0,0]=4 767 B10R1.18 O=C(O)C[NH+]1CCCCC1 Amb4255653 [2,0,0,0,0,0|1,0,0]=3 768 B10R1.18 O=C(O)C[S+]1CCSCC1 Amb27176492 [2,0,0,0,0,0|2,0,0]=4 769 B10R1.18 O=C(O)NC1CCCCC1 Amb22039352 [2,0,0,0,0,0|1,0,0]=3 770 B10R1.18 O=C([O-])CC1CCOCC1 Amb33512920 [2,0,0,0,0,0|1,0,1]=4 771 B10R1.18 O=S(Cl)CC1CCCCC1 Amb28195256 [2,0,0,0,0,0|2,0,0]=4 772 B10R1.18 O=S(O)CC1CCCCC1 Amb27452532 [2,0,0,0,0,0|1,0,0]=3 773 B10R1.18 O=S([O-])CC1CCCCC1 Amb24461100 [2,0,0,0,0,0|1,0,1]=4 774 B10R1.18 O=[N+]([O-])CC1CCCCC1 Amb25146243 [2,0,0,0,0,0|1,0,1]=4 775 B10R1.18 OB(O)CC1CCCCC1 Amb13890397 [2,0,0,0,0,0|1,0,1]=4 776 B10R1.377 C#CCC1(C)CCCCC1 Amb33226722 [2,0,0,0,0,0|1,0,1]=4 777 B10R1.377 C#CCC1(N)CCCCC1 Amb32751691 [2,0,0,0,0,0|1,0,1]=4 778 B10R1.377 C#CCC1(N)CCCCC1 Amb32751692 [2,0,0,0,0,0|1,0,1]=4 779 B10R1.377 C=CCC1(C)CCCCN1 Amb27615057 [2,0,0,0,0,0|2,0,0]=4 780 B10R1.377 C=CCC1(N)CCCCC1 Amb24351599 [2,0,0,0,0,0|1,0,0]=3 781 B10R1.377 C=CCC1(N)CCCOC1 Amb35657728 [2,0,0,0,0,0|2,0,0]=4 782 B10R1.377 C=CCC1(N)CCNCC1 Amb25263386 [2,0,0,0,0,0|2,0,0]=4 783 B10R1.377 C=CCC1(N)CCOCC1 Amb24586688 [2,0,0,0,0,0|2,0,0]=4 784 B10R1.377 C=CCC1(O)CCCCC1 Amb4034571 [2,0,0,0,0,0|2,0,0]=4 785 B10R1.377 CC1(CC#N)CCCCC1 Amb26655311 [2,0,0,0,0,0|1,0,1]=4 786 B10R1.377 CC1(CC=O)C=CCCC1 Amb18124518 [2,0,0,0,0,0|0,0,2]=4 787 B10R1.377 CC1(CC=O)CCCCC1 Amb18643651 [2,0,0,0,0,0|0,0,0]=2 788 B10R1.377 CC1(CC=O)CCCCO1 Amb32648988 [2,0,0,0,0,0|1,0,0]=3 789 B10R1.377 CC1(CC=O)CCOCC1 Amb33359314 [2,0,0,0,0,0|1,0,0]=3 790 B10R1.377 CC1(CCBr)CCCCC1 Amb24349263 [2,0,0,0,0,0|1,0,1]=4 791 B10R1.377 CC1(CCN)CCCCC1 Amb18908359 [2,0,0,0,0,0|1,0,1]=4 792 B10R1.377 CC1(CCO)CCCCC1 Amb28313664 [2,0,0,0,0,0|0,0,1]=3 793 B10R1.377 CC1(CCO)CCCCN1 Amb32946529 [2,0,0,0,0,0|1,0,1]=4 794 B10R1.377 CC1(CCO)CCCCO1 Amb25057701 [2,0,0,0,0,0|1,0,1]=4 795 B10R1.377 CC1(CCO)CCNCC1 Amb27440234 [2,0,0,0,0,0|1,0,1]=4 796 B10R1.377 CC1(CCO)CCOCC1 Amb26487153 [2,0,0,0,0,0|1,0,1]=4 797 B10R1.377 CC1(CCS)CCCCC1 Amb33417908 [2,0,0,0,0,0|0,1,1]=4 798 B10R1.377 CC1(CNN)CCCCC1 Amb26637229 [2,0,0,0,0,0|2,0,0]=4 799 B10R1.377 CC1(CNO)CCCCC1 Amb25274298 [2,0,0,0,0,0|1,0,0]=3 800 B10R1.377 CC1(CNO)CCOCC1 Amb33416310 [2,0,0,0,0,0|2,0,0]=4 801 B10R1.377 CC1(CON)CCCCC1 Amb33320633 [2,0,0,0,0,0|2,0,0]=4 802 B10R1.377 CC1(N=C=O)CCCCC1 Amb24502252 [2,0,0,0,0,0|1,0,1]=4 803 B10R1.377 CC1(NC=O)CCNCC1 Amb27793392 [2,0,0,0,0,0|2,0,0]=4 804 B10R1.377 CCCC1(N)CCCCC1 Amb9676116 [2,0,0,0,0,0|1,0,1]=4 805 B10R1.377 CNCC1(C)CCCCC1 Amb18963698 [2,0,0,0,0,0|2,0,0]=4 806 B10R1.377 CNCC1(N)CCCCC1 Amb18951422 [2,0,0,0,0,0|2,0,0]=4 807 B10R1.377 COCC1(N)CCCCC1 Amb19374459 [2,0,0,0,0,0|2,0,0]=4 808 B10R1.377 CSCC1(N)CCCCC1 Amb33272067 [2,0,0,0,0,0|2,0,0]=4 809 B10R1.377 C[C@]1(CCO)CCCCO1 Amb28050601 [2,0,0,0,0,0|1,0,1]=4 810 B10R1.377 N#CCC1(N)CCCCC1 Amb25701220 [2,0,0,0,0,0|1,0,1]=4 811 B10R1.377 NC1(CCF)CCCCC1 Amb24399671 [2,0,0,0,0,0|1,0,1]=4 812 B10R1.377 NC1(CCO)CCCCC1 Amb20622473 [2,0,0,0,0,0|0,0,1]=3 813 B10R1.377 NC1(CCO)CCCCC1 Amb32675064 [2,0,0,0,0,0|0,0,1]=3 814 B10R1.377 NC1(CCO)CCCNC1 Amb32946601 [2,0,0,0,0,0|1,0,1]=4 815 B10R1.377 NC1(CCO)CCCSC1 Amb26516356 [2,0,0,0,0,0|1,0,1]=4 816 B10R1.377 NC1(CCO)CCNCC1 Amb25222695 [2,0,0,0,0,0|1,0,1]=4 817 B10R1.377 NC1(CCO)CCNCC1 Amb33743863 [2,0,0,0,0,0|1,0,1]=4 818 B10R1.377 NC1(CCO)CCOCC1 Amb20669304 [2,0,0,0,0,0|1,0,1]=4 819 B10R1.377 NC1(CCO)CCOCC1 Amb32666940 [2,0,0,0,0,0|1,0,1]=4 820 B10R1.377 NC1(CCO)CCSCC1 Amb27606327 [2,0,0,0,0,0|1,0,1]=4 821 B10R1.377 NC1(CCO)CCSCC1 Amb33483586 [2,0,0,0,0,0|1,0,1]=4 822 B10R1.377 O=CCC1(F)CCSCC1 Amb28199159 [2,0,0,0,0,0|2,0,0]=4 823 B10R1.377 O=CCC1(O)CCCOC1 Amb27979900 [2,0,0,0,0,0|2,0,0]=4 824 B10R1.377 OCCC1(F)CCCCC1 Amb27218890 [2,0,0,0,0,0|1,0,1]=4 825 B10R1.377 OCCC1(O)CCCCC1 Amb532999 [2,0,0,0,0,0|1,0,1]=4 826 B10R1.377 [C-]#[N+]CC1(C)CCCCC1 Amb33318911 [2,0,0,0,0,0|2,0,0]=4 827 B10R1.487 BrCC1(CBr)CCCCC1 Amb17419408 [2,0,0,0,0,0|2,0,0]=4 828 B10R1.487 C#CC1(CO)CCCCC1 Amb28064148 [2,0,0,0,0,0|1,0,1]=4 829 B10R1.487 C=CC1(C=O)CCCCC1 Amb18643318 [2,0,0,0,0,0|1,0,1]=4 830 B10R1.487 CCC1(C=O)CCCCC1 Amb25221788 [2,0,0,0,0,0|1,0,0]=3 831 B10R1.487 CCC1(C=O)CCCCO1 Amb33039756 [2,0,0,0,0,0|2,0,0]=4 832 B10R1.487 CCC1(C=O)CCCOC1 Amb24740034 [2,0,0,0,0,0|2,0,0]=4 833 B10R1.487 CCC1(C=O)CCOCC1 Amb26425840 [2,0,0,0,0,0|2,0,0]=4 834 B10R1.487 CCC1(C=O)CCSCC1 Amb27267942 [2,0,0,0,0,0|2,0,0]=4 835 B10R1.487 CCC1(CBr)CCCCC1 Amb26618197 [2,0,0,0,0,0|1,0,1]=4 836 B10R1.487 CCC1(CCl)CCCCC1 Amb25760970 [2,0,0,0,0,0|1,0,1]=4 837 B10R1.487 CCC1(CN)CCCCC1 Amb18287345 [2,0,0,0,0,0|0,0,1]=3 838 B10R1.487 CCC1(CN)CCCCO1 Amb25249542 [2,0,0,0,0,0|1,0,1]=4 839 B10R1.487 CCC1(CN)CCCNC1 Amb24466535 [2,0,0,0,0,0|1,0,1]=4 840 B10R1.487 CCC1(CN)CCCOC1 Amb18966927 [2,0,0,0,0,0|1,0,1]=4 841 B10R1.487 CCC1(CN)CCNCC1 Amb27808124 [2,0,0,0,0,0|1,0,1]=4 842 B10R1.487 CCC1(CN)CCOCC1 Amb30592919 [2,0,0,0,0,0|1,0,1]=4 843 B10R1.487 CCC1(CN)CCOCC1 Amb9901864 [2,0,0,0,0,0|1,0,1]=4 844 B10R1.487 CCC1(CO)CCCCO1 Amb26361291 [2,0,0,0,0,0|2,0,0]=4 845 B10R1.487 CCC1(CO)CCCNC1 Amb28555499 [2,0,0,0,0,0|2,0,0]=4 846 B10R1.487 CCC1(CO)CCCNC1 Amb8503430 [2,0,0,0,0,0|2,0,0]=4 847 B10R1.487 CCC1(CO)CCNCC1 Amb15701260 [2,0,0,0,0,0|2,0,0]=4 848 B10R1.487 CCC1(CO)CCNCC1 Amb21960046 [2,0,0,0,0,0|2,0,0]=4 849 B10R1.487 CCC1(CO)CCOCC1 Amb26564767 [2,0,0,0,0,0|2,0,0]=4 850 B10R1.487 CNC1(CN)CCCCC1 Amb18284353 [2,0,0,0,0,0|1,0,1]=4 851 B10R1.487 CNC1(CN)CCCCC1 Amb20668051 [2,0,0,0,0,0|1,0,1]=4 852 B10R1.487 CNC1(CO)CCCCC1 Amb18951173 [2,0,0,0,0,0|2,0,0]=4 853 B10R1.487 CNC1(CO)CCCCC1 Amb19373222 [2,0,0,0,0,0|2,0,0]=4 854 B10R1.487 COC1(C=O)CCCCC1 Amb28049850 [2,0,0,0,0,0|2,0,0]=4 855 B10R1.487 COC1(CN)CCCCC1 Amb18284751 [2,0,0,0,0,0|1,0,1]=4 856 B10R1.487 COC1(CN)CCCCC1 Amb33249666 [2,0,0,0,0,0|1,0,1]=4 857 B10R1.487 COC1(CO)CCCCC1 Amb26605799 [2,0,0,0,0,0|2,0,0]=4 858 B10R1.487 CSC1(C=O)CCCCC1 Amb25803600 [2,0,0,0,0,0|2,0,0]=4 859 B10R1.487 CSC1(CN)CCCCC1 Amb18251566 [2,0,0,0,0,0|1,0,1]=4 860 B10R1.487 CSC1(CN)CCCCC1 Amb32680429 [2,0,0,0,0,0|1,0,1]=4 861 B10R1.487 N#CC1(CN)CCCCC1 Amb18251175 [2,0,0,0,0,0|1,0,1]=4 862 B10R1.487 N#CC1(CN)CCCCC1 Amb28645148 [2,0,0,0,0,0|1,0,1]=4 863 B10R1.487 N#CC1(CO)CCCCC1 Amb17334169 [2,0,0,0,0,0|0,0,2]=4 864 B10R1.487 NCC1(CF)CCCCC1 Amb25127605 [2,0,0,0,0,0|1,0,0]=3 865 B10R1.487 NCC1(CF)CCOCC1 Amb27411437 [2,0,0,0,0,0|2,0,0]=4 866 B10R1.487 NCC1(CF)CCOCC1 Amb28896025 [2,0,0,0,0,0|2,0,0]=4 867 B10R1.487 NCC1(CN)CCCCC1 Amb33526693 [2,0,0,0,0,0|1,0,0]=3 868 B10R1.487 NCC1(CN)CCOCC1 Amb25727741 [2,0,0,0,0,0|2,0,0]=4 869 B10R1.487 NCC1(CN)CCOCC1 Amb28555550 [2,0,0,0,0,0|2,0,0]=4 870 B10R1.487 NCC1(CO)CCCCC1 Amb17061015 [2,0,0,0,0,0|0,0,0]=2 871 B10R1.487 NCC1(CO)CCCCC1 Amb20622823 [2,0,0,0,0,0|0,0,0]=2 872 B10R1.487 NCC1(CO)CCCOC1 Amb24384746 [2,0,0,0,0,0|1,0,0]=3 873 B10R1.487 NCC1(CO)CCOCC1 Amb10607861 [2,0,0,0,0,0|1,0,0]=3 874 B10R1.487 NCC1(CO)COCCN1 Amb32670717 [2,0,0,0,0,0|2,0,0]=4 875 B10R1.487 O=CC1(CCl)CCCCC1 Amb25162181 [2,0,0,0,0,0|1,0,0]=3 876 B10R1.487 O=CC1(CCl)CCCCO1 Amb32943430 [2,0,0,0,0,0|2,0,0]=4 877 B10R1.487 O=CC1(CCl)CCCOC1 Amb24740001 [2,0,0,0,0,0|2,0,0]=4 878 B10R1.487 O=CC1(CCl)CCOCC1 Amb25061548 [2,0,0,0,0,0|2,0,0]=4 879 B10R1.487 O=CC1(CCl)CCSCC1 Amb32943574 [2,0,0,0,0,0|2,0,0]=4 880 B10R1.487 O=CC1(CF)CCCCC1 Amb27633434 [2,0,0,0,0,0|1,0,0]=3 881 B10R1.487 O=CC1(CO)CCCCC1 Amb18643889 [2,0,0,0,0,0|1,0,0]=3 882 B10R1.487 O=CC1(CO)CCCCO1 Amb33495089 [2,0,0,0,0,0|2,0,0]=4 883 B10R1.487 O=CC1(CO)CCCOC1 Amb25860700 [2,0,0,0,0,0|2,0,0]=4 884 B10R1.487 O=CC1(CO)CCOCC1 Amb25274309 [2,0,0,0,0,0|2,0,0]=4 885 B10R1.487 O=CC1(CO)CCSCC1 Amb33494877 [2,0,0,0,0,0|2,0,0]=4 886 B10R1.487 OCC1(CF)CCOCC1 Amb28144254 [2,0,0,0,0,0|2,0,0]=4 887 B10R1.487 OCC1(CO)CCCCC1 Amb17399885 [2,0,0,0,0,0|1,0,0]=3 888 B10R1.487 OCC1(CO)CCCCN1 Amb32658754 [2,0,0,0,0,0|2,0,0]=4 889 B10R1.487 OCC1(CO)CCCCO1 Amb4020573 [2,0,0,0,0,0|2,0,0]=4 890 B10R1.487 OCC1(CO)CCCNC1 Amb25794522 [2,0,0,0,0,0|2,0,0]=4 891 B10R1.487 OCC1(CO)CCNCC1 Amb15701277 [2,0,0,0,0,0|2,0,0]=4 892 B10R1.487 OCC1(CO)CCNCC1 Amb22587234 [2,0,0,0,0,0|2,0,0]=4 893 B10R1.487 OCC1(CO)CCOCC1 Amb13783609 [2,0,0,0,0,0|2,0,0]=4 894 B10R1.487 OCC1(CS)CCCCC1 Amb27485876 [2,0,0,0,0,0|1,0,0]=3 895 B10R1.487 [O-]C[N+]1(CO)CCCCC1 Amb28050607 [2,0,0,0,0,0|2,0,0]=4 896 B12R0.126 CCC\C=C\C(CN)CC(=O)OC Amb33424813 [0,1,1,0,0,0|0,0,2]=4 897 B12R0.256 CCCCCC(CC(=O)O)NC=O Amb33255054 [0,1,1,0,0,0|1,0,1]=4 898 B12R0.256 CCCOCC(CCN)CC(=O)O Amb32654957 [0,1,1,0,0,0|1,0,0]=3 899 B12R0.642 CCCCCC(O)(CN)CC(=O)O Amb33346948 [0,1,1,0,0,0|0,0,0]=2 900 B12R0.758 CCCC(CC)(CC(=O)O)NC=O Amb33255807 [0,1,1,0,0,0|1,0,1]=4 901 B12R0.347 CC(C)CCC(O)(CN)CC(=O)O Amb33346962 [0,1,1,0,0,0|1,0,0]=3 902 B12R0.360 CCCCC(N)(CC)CC(=O)OC Amb33254497 [0,1,1,0,0,0|2,0,0]=4 903 B12R0.360 CCOCC(N)(CN)CC(=O)OC Amb32787572 [0,1,1,0,0,0|2,0,0]=4 904 B12R0.360 COC(=O)CC(C)(CN)OCCO Amb33068815 [0,1,1,0,0,0|2,0,0]=4 905 B12R0.414 CCCC(C)C(O)(CN)CC(=O)O Amb33346959 [0,1,1,0,0,0|1,0,0]=3 906 B12R0.480 CCC(C)CC(N)(CC)CC(=O)O Amb33255402 [0,1,1,0,0,0|2,0,0]=4 907 B12R0.480 CCC(C)CC(O)(CN)CC(=O)O Amb33346966 [0,1,1,0,0,0|1,0,0]=3 908 B12R0.803 CCCCC(C)(CC(=O)O)NC=O Amb32787262 [0,1,1,0,0,0|1,0,1]=4 909 B12R1.123 C=C(C)CC1(N)CCCCC1C Amb30030525 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.123 CC(=O)CC1(C)CCCCC1=O Amb27950642 [1,1,0,0,0,0|1,0,1]=4 911 B12R1.123 CC(=O)C[C@]1(C)CCCCC1=O Amb27177991 [1,1,0,0,0,0|1,0,1]=4 912 B12R1.123 CC(=O)NC1(C)CCCCC1Cl Amb27816480 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.123 CC(=O)OC1(C)CCCCC1N Amb27828037 [1,1,0,0,0,0|2,0,0]=4 914 B12R1.123 CC(=O)O[C@@]1(C)CCCC[C@H]1O Amb27980380 [1,1,0,0,0,0|2,0,0]=4 915 B12R1.123 CC(O)CC1(C)CCCCC1O Amb27661029 [1,1,0,0,0,0|1,0,1]=4 916 B12R1.123 CC(O)CC1(N)CCCCC1C Amb30030897 [1,1,0,0,0,0|1,0,1]=4 917 B12R1.123 CC1(CC(=O)O)CCCCC1=O Amb18647359 [1,1,0,0,0,0|0,0,1]=3 918 B12R1.123 CC1(CC(=O)O)CCCNC1=O Amb27144412 [1,1,0,0,0,0|1,0,1]=4 919 B12R1.123 CC1CCCCC1(C)CC(=O)O Amb27457155 [1,1,0,0,0,0|0,0,0]=2 920 B12R1.123 CC1CCCCC1(C)NC(=O)Cl Amb35633384 [1,1,0,0,0,0|2,0,0]=4 921 B12R1.123 CC1CCCCC1(N)CC(=O)O Amb26038273 [1,1,0,0,0,0|0,0,0]=2 922 B12R1.123 CC1CCCCC1(N)CC(N)=O Amb33255752 [1,1,0,0,0,0|1,0,0]=3 923 B12R1.123 CC1CCCCC1(O)CC(=O)O Amb18961447 [1,1,0,0,0,0|1,0,0]=3 924 B12R1.123 CC1CNCCC1(N)CC(=O)O Amb25054506 [1,1,0,0,0,0|1,0,0]=3 925 B12R1.123 CC1CNCCC1(N)CC(N)=O Amb33308453 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.123 CC1COCCC1(N)CC(=O)O Amb25132674 [1,1,0,0,0,0|1,0,0]=3 927 B12R1.123 CC1COCCC1(N)CC(N)=O Amb33254378 [1,1,0,0,0,0|2,0,0]=4 928 B12R1.123 CC1NCCCC1(N)CC(=O)O Amb27202911 [1,1,0,0,0,0|1,0,0]=3 929 B12R1.123 CC1NCCCC1(N)CC(N)=O Amb33254698 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.123 CC1SCCCC1(N)CC(=O)O Amb33255928 [1,1,0,0,0,0|1,0,0]=3 931 B12R1.123 CC1SCCCC1(N)CC(N)=O Amb33254246 [1,1,0,0,0,0|2,0,0]=4 932 B12R1.123 C[C@@H](O)C[C@@]1(C)CCCC[C@@H]1O Amb27197195 [1,1,0,0,0,0|1,0,1]=4 933 B12R1.123 C[C@H](O)C[C@@]1(C)CCCC[C@@H]1O Amb27184277 [1,1,0,0,0,0|1,0,1]=4 934 B12R1.123 N[C@H]1CCCC[C@@]1(N)CC(=O)O Amb27666896 [1,1,0,0,0,0|0,0,0]=2 935 B12R1.123 O=C(O)C[C@@]1(O)CCCC[C@@H]1Cl Amb27216481 [1,1,0,0,0,0|1,0,0]=3 936 B12R1.349 C=C(C)CC1(N)CCC(C)CC1 Amb35634475 [1,1,0,0,0,0|2,0,0]=4 937 B12R1.349 C=C(C)CC1(N)CCC(O)CC1 Amb30029525 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.349 CC(=O)CC1(O)CCC(C)CC1 Amb32943655 [1,1,0,0,0,0|2,0,0]=4 939 B12R1.349 CC(=O)NC1(C)CCC(C)CC1 Amb27804662 [1,1,0,0,0,0|2,0,0]=4 940 B12R1.349 CC(=O)NC1(C)CCC(N)CC1 Amb32993809 [1,1,0,0,0,0|2,0,0]=4 941 B12R1.349 CC(=O)NC1(C)CCC(O)CC1 Amb27174330 [1,1,0,0,0,0|2,0,0]=4 942 B12R1.349 CC(O)CC1(N)CCC(C)CC1 Amb29883691 [1,1,0,0,0,0|1,0,1]=4 943 B12R1.349 CC(O)CC1(N)CCC(O)CC1 Amb29869990 [1,1,0,0,0,0|1,0,1]=4 944 B12R1.349 CC1(CC(=O)O)CCC(=O)CC1 Amb27641871 [1,1,0,0,0,0|0,0,1]=3 945 B12R1.349 CC1CCC(C)(CC(=O)O)CC1 Amb28291615 [1,1,0,0,0,0|0,0,0]=2 946 B12R1.349 CC1CCC(C)(NC(N)=O)CC1 Amb27651156 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.349 CC1CCC(F)(CC(=O)O)CC1 Amb27462439 [1,1,0,0,0,0|1,0,0]=3 948 B12R1.349 CC1CCC(N)(CC(=O)O)CC1 Amb22550920 [1,1,0,0,0,0|0,0,0]=2 949 B12R1.349 CC1CCC(N)(CC(=O)O)CC1 Amb22723464 [1,1,0,0,0,0|0,0,0]=2 950 B12R1.349 CC1CCC(N)(CC(=O)O)CN1 Amb28346030 [1,1,0,0,0,0|1,0,0]=3 951 B12R1.349 CC1CCC(N)(CC(=O)O)CO1 Amb33254807 [1,1,0,0,0,0|1,0,0]=3 952 B12R1.349 CC1CCC(N)(CC(=O)O)CS1 Amb33255223 [1,1,0,0,0,0|1,0,0]=3 953 B12R1.349 CC1CCC(N)(CC(N)=O)CC1 Amb32787235 [1,1,0,0,0,0|1,0,0]=3 954 B12R1.349 CC1CCC(N)(CC(N)=O)CN1 Amb33255643 [1,1,0,0,0,0|2,0,0]=4 955 B12R1.349 CC1CCC(N)(CC(N)=O)CO1 Amb33308411 [1,1,0,0,0,0|2,0,0]=4 956 B12R1.349 CC1CCC(N)(CC(N)=O)CS1 Amb33255362 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.349 CC1CCC(O)(CC(=O)O)CC1 Amb18285917 [1,1,0,0,0,0|1,0,0]=3 958 B12R1.349 CC1CCC(O)(CC(=O)O)CO1 Amb29849990 [1,1,0,0,0,0|2,0,0]=4 959 B12R1.349 CC1CCC(O)(CC(=O)O)CS1 Amb35717590 [1,1,0,0,0,0|2,0,0]=4 960 B12R1.349 CN1CCC(N)(CC(=O)O)CC1 Amb25680992 [1,1,0,0,0,0|1,0,0]=3 961 B12R1.349 CN1CCC(N)(CC(=O)O)CC1 Amb32992827 [1,1,0,0,0,0|1,0,0]=3 962 B12R1.349 CN1CCC(N)(CC(N)=O)CC1 Amb33254795 [1,1,0,0,0,0|2,0,0]=4 963 B12R1.349 CN1CCC(O)(CC(=O)O)CC1 Amb19374965 [1,1,0,0,0,0|2,0,0]=4 964 B12R1.349 NC(=O)CC1(N)CCC(N)CC1 Amb32787599 [1,1,0,0,0,0|1,0,0]=3 965 B12R1.349 NC1CCC(N)(CC(=O)O)CC1 Amb33255281 [1,1,0,0,0,0|0,0,0]=2 966 B12R1.349 O=C(O)CC1(O)CCC(O)CC1 Amb24532545 [1,1,0,0,0,0|1,0,0]=3 967 B12R1.349 O=C(O)C[C@]1(O)CC[C@@H](O)CC1 Amb23604022 [1,1,0,0,0,0|1,0,0]=3 968 B12R1.349 O=C(O)C[C@]1(O)CC[C@H](O)CC1 Amb23604021 [1,1,0,0,0,0|1,0,0]=3 969 B12R1.1257 C=C(C)CC1(N)CCCC(C)C1 Amb35634477 [1,1,0,0,0,0|2,0,0]=4 970 B12R1.1257 CC(=O)CC1(C)CCCC(=O)C1 Amb27177700 [1,1,0,0,0,0|1,0,1]=4 971 B12R1.1257 CC(=O)CC1(O)CCCC(C)C1 Amb32943772 [1,1,0,0,0,0|2,0,0]=4 972 B12R1.1257 CC(O)CC1(N)CCCC(C)C1 Amb29883662 [1,1,0,0,0,0|1,0,1]=4 973 B12R1.1257 CC1(CC(=O)O)CCCC(=O)C1 Amb18647356 [1,1,0,0,0,0|0,0,1]=3 974 B12R1.1257 CC1=CC(C)(CC(=O)O)CCC1 Amb28365553 [1,1,0,0,0,0|0,0,2]=4 975 B12R1.1257 CC1CC(N)(CC(=O)O)CCN1 Amb33255895 [1,1,0,0,0,0|1,0,0]=3 976 B12R1.1257 CC1CC(N)(CC(=O)O)CCO1 Amb25284723 [1,1,0,0,0,0|1,0,0]=3 977 B12R1.1257 CC1CC(N)(CC(N)=O)CCN1 Amb32787306 [1,1,0,0,0,0|2,0,0]=4 978 B12R1.1257 CC1CC(N)(CC(N)=O)CCO1 Amb32787393 [1,1,0,0,0,0|2,0,0]=4 979 B12R1.1257 CC1CCCC(N)(CC(=O)O)C1 Amb27980737 [1,1,0,0,0,0|0,0,0]=2 980 B12R1.1257 CC1CCCC(N)(CC(N)=O)C1 Amb33255255 [1,1,0,0,0,0|1,0,0]=3 981 B12R1.1257 CC1CCCC(O)(CC(=O)O)C1 Amb18961448 [1,1,0,0,0,0|1,0,0]=3 982 B12R1.1257 CC1CNCC(N)(CC(=O)O)C1 Amb32787948 [1,1,0,0,0,0|1,0,0]=3 983 B12R1.1257 CC1CNCC(N)(CC(N)=O)C1 Amb33254985 [1,1,0,0,0,0|2,0,0]=4 984 B12R1.1257 CN1CCCC(F)(CC(=O)O)C1 Amb27623604 [1,1,0,0,0,0|2,0,0]=4 985 B12R1.1257 CN1CCCC(N)(CC(=O)O)C1 Amb32674344 [1,1,0,0,0,0|1,0,0]=3 986 B12R1.1257 CN1CCCC(N)(CC(N)=O)C1 Amb33254875 [1,1,0,0,0,0|2,0,0]=4 987 B12R1.1257 CN1CCCC(O)(CC(=O)O)C1 Amb18197977 [1,1,0,0,0,0|2,0,0]=4 988 B12R1.1257 CN1CCCC(O)(CC(=O)O)C1 Amb33532444 [1,1,0,0,0,0|2,0,0]=4 989 B12R1.1257 C[C@@]1(CC(=O)O)CCCC(=O)C1 Amb25144060 [1,1,0,0,0,0|0,0,1]=3 990 B12R1.1257 NC(=O)CC1(N)CCCC(N)C1 Amb32787869 [1,1,0,0,0,0|1,0,0]=3 991 B12R1.1257 NC1CCCC(N)(CC(=O)O)C1 Amb33255721 [1,1,0,0,0,0|0,0,0]=2 992 B12R1.2206 C=C(C(=O)O)C1(C)CCCCC1 Amb33226720 [1,1,0,0,0,0|0,0,1]=3 993 B12R1.2206 C=C(C(=O)O)C1(C)CCOCC1 Amb33415487 [1,1,0,0,0,0|1,0,1]=4 994 B12R1.2206 C=C(C)C(O)C1(N)CCCCC1 Amb29875437 [1,1,0,0,0,0|2,0,0]=4 995 B12R1.2206 CC(=O)C(F)C1(C)CCCCC1 Amb27177657 [1,1,0,0,0,0|1,0,0]=3 996 B12R1.2206 CC(C(=O)O)C1(C)C=CCCC1 Amb27863655 [1,1,0,0,0,0|0,0,2]=4 997 B12R1.2206 CC(C(=O)O)C1(C)CCCCC1 Amb33318956 [1,1,0,0,0,0|0,0,0]=2 998 B12R1.2206 CC(C(=O)O)C1(C)CCOCC1 Amb33415998 [1,1,0,0,0,0|1,0,0]=3 999 B12R1.2206 CC(O)C(C)C1(N)CCCCC1 Amb29883858 [1,1,0,0,0,0|1,0,1]=4 1000 B12R1.2206 CC1(C(=O)C(=O)O)CCCCC1 Amb28121053 [1,1,0,0,0,0|0,0,1]=3 1001 B12R1.2206 CC1(C(=O)C(=O)O)CCOCC1 Amb33415990 [1,1,0,0,0,0|1,0,1]=4 1002 B12R1.2206 CC1(C(Cl)C(N)=O)CCCCC1 Amb28437063 [1,1,0,0,0,0|1,0,0]=3 1003 B12R1.2206 CC1(C(N)C(=O)O)CCCCC1 Amb24635685 [1,1,0,0,0,0|0,0,0]=2 1004 B12R1.2206 CC1(C(N)C(=O)O)CCCCC1 Amb28600231 [1,1,0,0,0,0|0,0,0]=2 1005 B12R1.2206 CC1(C(N)C(=O)O)CCOCC1 Amb25875608 [1,1,0,0,0,0|1,0,0]=3 1006 B12R1.2206 CC1(C(O)C(=O)O)CCCCC1 Amb28381589 [1,1,0,0,0,0|0,0,0]=2 1007 B12R1.2206 CC1(C(O)C(=O)O)CCOCC1 Amb33415989 [1,1,0,0,0,0|1,0,0]=3 1008 B12R1.2206 CC1([C@@H](N)C(=O)O)CCCCC1 Amb17933178 [1,1,0,0,0,0|0,0,0]=2 1009 B12R1.2206 CC1([C@@H](N)C(=O)O)CCOCC1 Amb27799729 [1,1,0,0,0,0|1,0,0]=3 1010 B12R1.2206 CC1([C@H](N)C(=O)O)CCCCC1 Amb25109328 [1,1,0,0,0,0|0,0,0]=2 1011 B12R1.2206 C[C@@H](C(=O)O)C1(C)CCCCC1 Amb33728218 [1,1,0,0,0,0|0,0,0]=2 1012 B12R1.2206 C[C@H](C(=O)O)C1(C)CCCCC1 Amb33745938 [1,1,0,0,0,0|0,0,0]=2 1013 B12R1.2206 NC(=O)C(O)C1(N)CCCCC1 Amb27631262 [1,1,0,0,0,0|1,0,0]=3 1014 B12R1.2206 NC1(C(O)C(=O)O)CCCCC1 Amb32946644 [1,1,0,0,0,0|0,0,0]=2 1015 B12R1.2206 NC1(C(O)C(=O)O)CCCOC1 Amb32946684 [1,1,0,0,0,0|1,0,0]=3 1016 B12R1.2206 NC1(C(O)C(=O)O)CCCSC1 Amb32946680 [1,1,0,0,0,0|1,0,0]=3 1017 B12R1.2206 NC1(C(O)C(=O)O)CCNCC1 Amb32946654 [1,1,0,0,0,0|1,0,0]=3 1018 B12R1.2206 NC1(C(O)C(=O)O)CCOCC1 Amb32946674 [1,1,0,0,0,0|1,0,0]=3 1019 B12R1.2206 NC1(C(O)C(=O)O)CCSCC1 Amb32946656 [1,1,0,0,0,0|1,0,0]=3 1020 B12R1.2206 O=C(O)C(O)C1(O)CCCCC1 Amb28396586 [1,1,0,0,0,0|1,0,0]=3 1021 B12R1.2206 O=C(O)C(O)C1(O)CCCOC1 Amb32946627 [1,1,0,0,0,0|2,0,0]=4 1022 B12R1.2206 O=C(O)C(O)C1(O)CCCSC1 Amb32946624 [1,1,0,0,0,0|2,0,0]=4 1023 B12R1.2206 O=C(O)C(O)C1(O)CCNCC1 Amb32946572 [1,1,0,0,0,0|2,0,0]=4 1024 B12R1.2206 O=C(O)C(O)C1(O)CCOCC1 Amb32992388 [1,1,0,0,0,0|2,0,0]=4 1025 B12R1.2206 O=C(O)C(O)C1(O)CCSCC1 Amb32946573 [1,1,0,0,0,0|2,0,0]=4 1026 B12R1.2823 CC(C)(O)CC1(C)CCCCC1 Amb33319299 [1,1,0,0,0,0|1,0,1]=4 1027 B12R1.2823 CC(C)(O)CC1(N)CCCCC1 Amb35615105 [1,1,0,0,0,0|1,0,1]=4 1028 B12R1.2823 CC1(CS(=O)(=O)Cl)CCCCC1 Amb26941238 [1,1,0,0,0,0|1,0,1]=4 1029 B12R1.2823 CC1(CS(=O)(=O)F)CCCCC1 Amb32717543 [1,1,0,0,0,0|1,0,1]=4 1030 B12R1.2823 CC1(CS(N)(=O)=O)CCCCC1 Amb28242612 [1,1,0,0,0,0|1,0,1]=4 1031 B12R1.2823 CS(=O)(=O)CC1(N)CCCCC1 Amb33054928 [1,1,0,0,0,0|1,0,1]=4 1032 B12R1.2823 NC1(CS(=O)(=O)F)CCCCC1 Amb33463780 [1,1,0,0,0,0|1,0,1]=4 1033 B12R1.2823 NC1(CS(=O)(=O)O)CCCCC1 Amb24485553 [1,1,0,0,0,0|1,0,0]=3 1034 B12R1.3524 C#CC(=O)CC1(N)CCOCC1 Amb30034168 [1,1,0,0,0,0|2,0,0]=4 1035 B12R1.3524 C#CC(=O)NC1(C)CCCCC1 Amb28453935 [1,1,0,0,0,0|2,0,0]=4 1036 B12R1.3524 C#CC(O)CC1(N)CCCCC1 Amb29875122 [1,1,0,0,0,0|1,0,1]=4 1037 B12R1.3524 C=C(CC)CC1(N)CCCCC1 Amb29883699 [1,1,0,0,0,0|2,0,0]=4 1038 B12R1.3524 C=CC(=O)CC1(N)CCCCC1 Amb27170586 [1,1,0,0,0,0|1,0,0]=3 1039 B12R1.3524 C=CC(=O)CC1(N)CCOCC1 Amb30034358 [1,1,0,0,0,0|2,0,0]=4 1040 B12R1.3524 C=CC(=O)OC1(C)CCCCC1 Amb25148559 [1,1,0,0,0,0|2,0,0]=4 1041 B12R1.3524 C=CC(O)CC1(N)CCCCC1 Amb29875064 [1,1,0,0,0,0|1,0,1]=4 1042 B12R1.3524 CC(CO)CC1(N)CCCCC1 Amb35627062 [1,1,0,0,0,0|1,0,1]=4 1043 B12R1.3524 CC1(CC(N)CO)CCCCC1 Amb33318907 [1,1,0,0,0,0|1,0,1]=4 1044 B12R1.3524 CC1(CC(O)CN)CCCCC1 Amb33319296 [1,1,0,0,0,0|1,0,1]=4 1045 B12R1.3524 CC1(NC(=O)CN)CCCCC1 Amb18957387 [1,1,0,0,0,0|2,0,0]=4 1046 B12R1.3524 CC1(NC(=O)CO)CCCOC1 Amb28185630 [1,1,0,0,0,0|2,0,0]=4 1047 B12R1.3524 CC1(NC(=O)CS)CCCCC1 Amb27652637 [1,1,0,0,0,0|1,1,0]=4 1048 B12R1.3524 CCC(=O)CC1(N)CCCCC1 Amb27404750 [1,1,0,0,0,0|1,0,0]=3 1049 B12R1.3524 CCC(=O)CC1(N)CCOCC1 Amb30034359 [1,1,0,0,0,0|2,0,0]=4 1050 B12R1.3524 CCC(=O)CC1(O)CCCCC1 Amb27191971 [1,1,0,0,0,0|2,0,0]=4 1051 B12R1.3524 CCC(O)CC1(N)CCCCC1 Amb35626977 [1,1,0,0,0,0|1,0,1]=4 1052 B12R1.3524 CNC(=O)CC1(C)CCCCC1 Amb27180098 [1,1,0,0,0,0|1,0,0]=3 1053 B12R1.3524 CNC(=O)NC1(C)CCCCC1 Amb27970007 [1,1,0,0,0,0|2,0,0]=4 1054 B12R1.3524 COC(=O)CC1(N)CCCCC1 Amb10601917 [1,1,0,0,0,0|0,0,0]=2 1055 B12R1.3524 COC(=O)CC1(N)CCCCC1 Amb10601918 [1,1,0,0,0,0|0,0,0]=2 1056 B12R1.3524 COC(=O)CC1(N)CCCOC1 Amb24437799 [1,1,0,0,0,0|1,0,0]=3 1057 B12R1.3524 COC(=O)CC1(N)CCCSC1 Amb25034152 [1,1,0,0,0,0|1,0,0]=3 1058 B12R1.3524 COC(=O)CC1(N)CCNCC1 Amb24525117 [1,1,0,0,0,0|1,0,0]=3 1059 B12R1.3524 COC(=O)CC1(N)CCOCC1 Amb19888383 [1,1,0,0,0,0|1,0,0]=3 1060 B12R1.3524 COC(=O)CC1(N)CCOCC1 Amb23399607 [1,1,0,0,0,0|1,0,0]=3 1061 B12R1.3524 COC(=O)CC1(N)CCSCC1 Amb22408763 [1,1,0,0,0,0|1,0,0]=3 1062 B12R1.3524 COC(=O)CC1(N)CCSCC1 Amb22549347 [1,1,0,0,0,0|1,0,0]=3 1063 B12R1.3524 COC(=O)CC1(O)CCCNC1 Amb33802737 [1,1,0,0,0,0|2,0,0]=4 1064 B12R1.3524 COC(=O)CC1(O)CCNCC1 Amb33803636 [1,1,0,0,0,0|2,0,0]=4 1065 B12R1.3524 COC(=O)C[N+]1(C)CCOCC1 Amb26567811 [1,1,0,0,0,0|2,0,0]=4 1066 B12R1.3524 C\C(=C/Cl)CC1(N)CCCCC1 Amb35642898 [1,1,0,0,0,0|2,0,0]=4 1067 B12R1.3524 NC1(CC(=O)NO)CCCCC1 Amb27171790 [1,1,0,0,0,0|0,0,0]=2 1068 B12R1.3524 NC1(CC(=O)NO)CCOCC1 Amb30034567 [1,1,0,0,0,0|1,0,0]=3 1069 B12R1.3524 NC1(CC(O)CF)CCCCC1 Amb33220393 [1,1,0,0,0,0|1,0,1]=4 1070 B12R1.3524 NC1(CC(O)CO)CCCCC1 Amb35642698 [1,1,0,0,0,0|0,0,2]=4 1071 B12R1.3524 NNC(=O)CC1(N)CCOCC1 Amb30034617 [1,1,0,0,0,0|2,0,0]=4 1072 B12R1.3524 O=C(CC1(O)CCCCC1)NO Amb27946563 [1,1,0,0,0,0|1,0,0]=3 1073 B12R1.1471 C=CCC1(CN)CCCCC1O Amb27257826 [1,1,0,0,0,0|1,0,0]=3 1074 B12R1.1471 C=CCC1(CO)CCCCC1O Amb27650356 [1,1,0,0,0,0|2,0,0]=4 1075 B12R1.1471 CC1CCCCC1(CN)CCCl Amb27862831 [1,1,0,0,0,0|1,0,1]=4 1076 B12R1.1471 CC1CCCCC1(CN)CCF Amb27227758 [1,1,0,0,0,0|1,0,1]=4 1077 B12R1.1471 CCCC1(CN)CCCCC1C Amb28286062 [1,1,0,0,0,0|1,0,1]=4 1078 B12R1.1471 COCC1(CN)CCCCC1O Amb28184434 [1,1,0,0,0,0|2,0,0]=4 1079 B12R1.1471 NCC1(CCO)CCCCC1O Amb28184435 [1,1,0,0,0,0|0,0,1]=3 1080 B12R1.2279 C=CCCC1(CBr)CCCCC1 Amb32689718 [1,1,0,0,0,0|2,0,0]=4 1081 B12R1.2279 C=CCCC1(CCl)CCCCC1 Amb32689711 [1,1,0,0,0,0|2,0,0]=4 1082 B12R1.2279 C=CCCC1(CN)CCOCC1 Amb33457366 [1,1,0,0,0,0|2,0,0]=4 1083 B12R1.2279 CC#CCC1(CN)CCCCC1 Amb27646639 [1,1,0,0,0,0|1,0,1]=4 1084 B12R1.2279 CCCCC1(CN)CCCCC1 Amb18801690 [1,1,0,0,0,0|1,0,1]=4 1085 B12R1.2279 CCCOC1(CN)CCCCC1 Amb18794194 [1,1,0,0,0,0|1,0,1]=4 1086 B12R1.2279 CCCOC1(CN)CCCCC1 Amb20623996 [1,1,0,0,0,0|1,0,1]=4 1087 B12R1.2279 CCSCC1(CN)CCCCC1 Amb33324084 [1,1,0,0,0,0|1,0,1]=4 1088 B12R1.2279 CC\C=C\C1(CN)CCCCC1 Amb33268721 [1,1,0,0,0,0|1,0,1]=4 1089 B12R1.2279 COCCC1(CBr)CCCCC1 Amb32689138 [1,1,0,0,0,0|1,0,1]=4 1090 B12R1.2279 COCCC1(CCl)CCCCC1 Amb32689095 [1,1,0,0,0,0|1,0,1]=4 1091 B12R1.2279 COCCC1(CN)CCCCC1 Amb19029461 [1,1,0,0,0,0|0,0,1]=3 1092 B12R1.2279 COCCC1(CN)CCOCC1 Amb9901865 [1,1,0,0,0,0|1,0,1]=4 1093 B12R1.2279 CSCCC1(CN)CCCCC1 Amb33448442 [1,1,0,0,0,0|0,1,1]=4 1094 B12R1.2279 NCC1(C\C=C\Cl)CCCCC1 Amb27587774 [1,1,0,0,0,0|1,0,0]=3 1095 B12R1.2279 NCC1(OCCO)CCCCC1 Amb32651821 [1,1,0,0,0,0|0,0,1]=3 1096 B12R1.2279 NCC1(OCCO)CCCOC1 Amb33068876 [1,1,0,0,0,0|1,0,1]=4 1097 B12R1.2279 NCC1(OCCO)CCCSC1 Amb33034617 [1,1,0,0,0,0|1,0,1]=4 1098 B12R1.2279 NCC1(OCCO)CCOCC1 Amb33547806 [1,1,0,0,0,0|1,0,1]=4 1099 B12R1.2279 NCC1(OCCO)CCSCC1 Amb30585050 [1,1,0,0,0,0|1,0,1]=4 1100 B12R1.2587 C=CCC1(CN)CCC(C)CC1 Amb27758148 [1,1,0,0,0,0|1,0,0]=3 1101 B12R1.2587 C=CCC1(CO)CCC(O)CC1 Amb27944950 [1,1,0,0,0,0|2,0,0]=4 1102 B12R1.2587 CC1CCC(CN)(CCO)CC1 Amb27458152 [1,1,0,0,0,0|0,0,1]=3 1103 B12R1.2587 CC1CCC(CN)(CCO)CO1 Amb35686980 [1,1,0,0,0,0|1,0,1]=4 1104 B12R1.2587 CC1CCC(CN)(CCO)CS1 Amb35725366 [1,1,0,0,0,0|1,0,1]=4 1105 B12R1.2587 CCCC1(CN)CCC(C)CC1 Amb27171002 [1,1,0,0,0,0|1,0,1]=4 1106 B12R1.2587 CCCC1(CN)CCC(O)CC1 Amb25800860 [1,1,0,0,0,0|1,0,1]=4 1107 B12R1.2587 CNCC1(CN)CCC(C)CC1 Amb27471138 [1,1,0,0,0,0|2,0,0]=4 1108 B12R1.2587 COCC1(CN)CCC(C)CC1 Amb27587775 [1,1,0,0,0,0|2,0,0]=4 1109 B12R1.2587 COCC1(CN)CCC(O)CC1 Amb27187739 [1,1,0,0,0,0|2,0,0]=4 1110 B12R1.2587 CSCC1(CN)CCC(O)CC1 Amb33269646 [1,1,0,0,0,0|2,0,0]=4 1111 B12R1.2587 NCC1(CCF)CCC(O)CC1 Amb33195735 [1,1,0,0,0,0|1,0,1]=4 1112 B12R1.2623 CC1CCCC(CN)(CCCl)C1 Amb27801353 [1,1,0,0,0,0|1,0,1]=4 1113 B12R1.2623 CC1CCCC(CN)(CCF)C1 Amb28127684 [1,1,0,0,0,0|1,0,1]=4 1114 B12R1.2623 CCC1(CC=O)CCCC(=O)C1 Amb28203810 [1,1,0,0,0,0|1,0,1]=4 1115 B12R1.2623 COCC1(CN)CCCC(C)C1 Amb28366542 [1,1,0,0,0,0|2,0,0]=4 1116 B12R1.2629 COCC1(CC=O)CCCCO1 Amb33341808 [1,1,0,0,0,0|2,0,0]=4 1117 B12R1.2629 OCCC1(CCO)CCCCC1 Amb2613269 [1,1,0,0,0,0|1,0,1]=4 1118 B12R1.3454 C#CC(O)C1(CN)CCCCC1 Amb35586934 [1,1,0,0,0,0|1,0,1]=4 1119 B12R1.3454 C=CC(O)C1(CN)CCOCC1 Amb35622071 [1,1,0,0,0,0|2,0,0]=4 1120 B12R1.3454 C=CC(O)C1(CO)CCCCC1 Amb27456407 [1,1,0,0,0,0|2,0,0]=4 1121 B12R1.3454 CC(CO)C1(CN)CCCCC1 Amb27645888 [1,1,0,0,0,0|0,0,1]=3 1122 B12R1.3454 CCC(C)C1(CN)CCCCC1 Amb25949854 [1,1,0,0,0,0|1,0,1]=4 1123 B12R1.3454 CCC(O)C1(CN)CCCCC1 Amb24668407 [1,1,0,0,0,0|1,0,1]=4 1124 B12R1.3454 N#CC1(C(O)C=O)CCCCC1 Amb28369450 [1,1,0,0,0,0|0,0,2]=4 1125 B12R1.3454 NCC1(C(O)C=O)CCCCC1 Amb24449805 [1,1,0,0,0,0|0,0,0]=2 1126 B12R1.3454 NCC1(C(O)C=O)CCCOC1 Amb27763410 [1,1,0,0,0,0|1,0,0]=3 1127 B12R1.3454 NCC1(C(O)C=O)CCOCC1 Amb26358069 [1,1,0,0,0,0|1,0,0]=3 1128 B12R1.684 C=CC1(CC(=O)O)CCC(C)C1 Amb33097603 [0,1,0,0,1,0|1,0,1]=4 1129 B12R1.684 CC1CC(CN)(CC(=O)O)CO1 Amb29850474 [0,1,0,0,1,0|1,0,0]=3 1130 B12R1.684 CC1CCC(CC(=O)O)(ON)C1 Amb33072029 [0,1,0,0,1,0|1,0,0]=3 1131 B12R1.684 CC1CCC(CN)(CC(=O)O)C1 Amb27974220 [0,1,0,0,1,0|0,0,0]=2 1132 B12R1.684 CC1CCC(CN)(CC(=O)O)C1 Amb33551308 [0,1,0,0,1,0|0,0,0]=2 1133 B12R1.684 C[C@@H]1CC[C@@](CN)(CC(=O)O)C1 Amb27477852 [0,1,0,0,1,0|0,0,0]=2 1134 B12R1.684 C[C@H]1CC[C@@](CN)(CC(=O)O)C1 Amb27968994 [0,1,0,0,1,0|0,0,0]=2 1135 B12R1.2612 CNOC1(CC(=O)O)CCCC1 Amb33098063 [0,1,0,0,1,0|1,0,0]=3 1136 B12R1.2612 CNOC1(CC(=O)O)CCOC1 Amb33098091 [0,1,0,0,1,0|2,0,0]=4 1137 B12R1.2612 COCC1(CC(=O)O)CCCC1 Amb33496178 [0,1,0,0,1,0|1,0,0]=3 1138 B12R1.2612 N#CNC1(CC(=O)O)CCCC1 Amb30031678 [0,1,0,0,1,0|0,0,2]=4 1139 B12R1.2612 O=CNC1(CC(=O)O)CCCC1 Amb25203973 [0,1,0,0,1,0|1,0,1]=4 1140 B12R1.3171 C=C(F)C1(CC(=O)O)CCCC1 Amb33346995 [0,1,0,0,1,0|1,0,1]=4 1141 B12R1.3171 CC(N)C1(CC(=O)O)CCCC1 Amb27806721 [0,1,0,0,1,0|0,0,0]=2 1142 B12R1.3171 CN(C)C1(CC(=O)O)CCCC1 Amb30584922 [0,1,0,0,1,0|2,0,0]=4 1143 B12R1.3171 O=C(O)CC1(C(=O)O)CCCC1 Amb2726377 [0,1,0,0,1,0|1,0,1]=4 1144 B12R1.3534 C=CC(=O)NC1(CN)CCCC1 Amb18252001 [0,1,0,0,1,0|2,0,0]=4 1145 B12R1.3534 CNC(=O)NC1(CN)CCCC1 Amb18252156 [0,1,0,0,1,0|2,0,0]=4 1146 B12R1.3534 COC(=O)CC1(CN)CCCC1 Amb32652051 [0,1,0,0,1,0|0,0,0]=2 1147 B12R1.3534 COC(=O)CC1(CN)CCCC1 Amb32652052 [0,1,0,0,1,0|0,0,0]=2 1148 B12R1.3534 COC(=O)NC1(CN)CCOC1 Amb27208475 [0,1,0,0,1,0|2,0,0]=4 1149 B12R1.3534 C\C(=C/Cl)CC1(CN)CCCC1 Amb28388398 [0,1,0,0,1,0|2,0,0]=4 1150 B12R1.3534 NCC(O)CC1(CN)CCCC1 Amb32656683 [0,1,0,0,1,0|1,0,1]=4 1151 B12R1.3534 NCC1(CC(O)CF)CCCC1 Amb33220206 [0,1,0,0,1,0|1,0,1]=4 1152 B12R1.3534 NCC1(NC(=O)CCl)CCCC1 Amb10606082 [0,1,0,0,1,0|2,0,0]=4 1153 B12R1.3843 C=C(C)CC1(CN)CCCC1O Amb27392562 [0,1,0,0,1,0|2,0,0]=4 1154 B12R1.3843 CC1CCCC1(CC(=O)O)ON Amb33098055 [0,1,0,0,1,0|1,0,0]=3 1155 B12R1.3843 CC1COCC1(CN)CC(=O)O Amb35646991 [0,1,0,0,1,0|1,0,0]=3 1156 B12R1.3843 CC1CSCC1(CN)CC(=O)O Amb27391992 [0,1,0,0,1,0|1,0,0]=3 1157 B12R1.3844 C=C(C)C(O)C1(CN)CCCC1 Amb35622280 [0,1,0,0,1,0|2,0,0]=4 1158 B12R1.3844 COC1(C(O)C(=O)O)CCCC1 Amb27455420 [0,1,0,0,1,0|2,0,0]=4 1159 B12R1.3844 NCC1(C(O)C(=O)O)CCCC1 Amb26862042 [0,1,0,0,1,0|0,0,0]=2 1160 B12R1.3844 NCC1(C(O)C(=O)O)CCOC1 Amb26358067 [0,1,0,0,1,0|1,0,0]=3 1161 B12R1.3864 CS(=O)(=O)CC1(CN)CCCC1 Amb23584966 [0,1,0,0,1,0|1,0,1]=4 1162 B12R1.3864 NCC1(CS(=O)(=O)F)CCCC1 Amb33463818 [0,1,0,0,1,0|1,0,1]=4 1163 B12R1.668 CC(O)C1(CN)CCCCC1C Amb27860449 [0,1,0,0,1,0|1,0,1]=4 1164 B12R1.668 CC1CCCCC1(C#N)C(=O)O Amb27758642 [0,1,0,0,1,0|0,0,2]=4 1165 B12R1.668 CC1CCCCC1(CN)C(=O)O Amb26450574 [0,1,0,0,1,0|0,0,0]=2 1166 B12R1.668 CC1CCCCC1(CO)C(=O)O Amb24545535 [0,1,0,0,1,0|1,0,0]=3 1167 B12R1.668 CC1CCNCC1(CO)C(=O)O Amb35640248 [0,1,0,0,1,0|2,0,0]=4 1168 B12R1.668 CCC1(C(=O)O)CCCCC1C Amb28322679 [0,1,0,0,1,0|1,0,0]=3 1169 B12R1.668 CCC1(C(=O)O)CCCCC1N Amb27438252 [0,1,0,0,1,0|1,0,0]=3 1170 B12R1.668 CCC1(C(=O)O)CCSCC1F Amb27795005 [0,1,0,0,1,0|2,0,0]=4 1171 B12R1.668 CCC1(C(=O)O)CNCCC1C Amb35640246 [0,1,0,0,1,0|2,0,0]=4 1172 B12R1.668 CCC1(C(=O)O)COCCC1F Amb28057996 [0,1,0,0,1,0|2,0,0]=4 1173 B12R1.668 CCC1(C(=O)O)CSCCC1F Amb28323352 [0,1,0,0,1,0|2,0,0]=4 1174 B12R1.668 COC1(C(=O)O)CCCCC1C Amb18953815 [0,1,0,0,1,0|2,0,0]=4 1175 B12R1.3098 C=C(C)C1(C(=O)O)CCCCC1 Amb28048397 [0,1,0,0,1,0|1,0,1]=4 1176 B12R1.3098 CC(=O)C1(C(N)=O)CCCCC1 Amb26555026 [0,1,0,0,1,0|1,0,1]=4 1177 B12R1.3098 CC(C)C1(C(=O)O)CCCCC1 Amb17594272 [0,1,0,0,1,0|1,0,0]=3 1178 B12R1.3098 CC(C)C1(C(=O)O)CCCOC1 Amb27171749 [0,1,0,0,1,0|2,0,0]=4 1179 B12R1.3098 CC(C)C1(C(=O)O)CCNCC1 Amb23589284 [0,1,0,0,1,0|2,0,0]=4 1180 B12R1.3098 CC(C)C1(C(=O)O)CCOCC1 Amb26339503 [0,1,0,0,1,0|2,0,0]=4 1181 B12R1.3098 CC(N)C1(C(=O)O)CCOCC1 Amb33804012 [0,1,0,0,1,0|1,0,0]=3 1182 B12R1.3098 CC(N)C1(C(N)=O)CCOCC1 Amb32674965 [0,1,0,0,1,0|2,0,0]=4 1183 B12R1.3098 NC(=O)C1(C(=O)O)CCCCC1 Amb21927503 [0,1,0,0,1,0|0,0,1]=3 1184 B12R1.3098 NC(=O)C1(C(=O)O)CCOCC1 Amb35672848 [0,1,0,0,1,0|1,0,1]=4 1185 B12R1.3098 NC(=O)C1(C(N)=S)CCCCC1 Amb19075922 [0,1,0,0,1,0|1,0,1]=4 1186 B12R1.3098 O=C(O)C1(C(=O)O)CCCCC1 Amb4012269 [0,1,0,0,1,0|1,0,1]=4 1187 B12R1.3098 O=C(O)C1(C(F)F)CCCCC1 Amb32416706 [0,1,0,0,1,0|1,0,0]=3 1188 B12R1.3098 O=C(O)C1(C(F)F)CCCNC1 Amb33100137 [0,1,0,0,1,0|2,0,0]=4 1189 B12R1.3098 O=C(O)C1(C(F)F)CCNCC1 Amb33100136 [0,1,0,0,1,0|2,0,0]=4 1190 B12R1.3098 O=C(O)C1(C(F)F)CCNCC1 Amb33299335 [0,1,0,0,1,0|2,0,0]=4 1191 B12R1.3098 O=C(O)C1(C(F)F)CCOCC1 Amb25730375 [0,1,0,0,1,0|2,0,0]=4 1192 B12R1.3098 O=C(O)C1(N(Cl)Cl)CCCCC1 Amb28243858 [0,1,0,0,1,0|2,0,0]=4 1193 B12R1.3098 O=C(O)C1([SH](=O)=O)CCCCC1 Amb27614695 [0,1,0,0,1,0|2,0,0]=4 1194 B12R1.3824 C=C(C)C1(CN)CCC(O)CC1 Amb33199182 [0,1,0,0,1,0|2,0,0]=4 1195 B12R1.3824 CC(=O)C1(CN)CCC(C)CC1 Amb27264372 [0,1,0,0,1,0|1,0,0]=3 1196 B12R1.3824 CC1CCC(C#N)(C(=O)O)CC1 Amb28454030 [0,1,0,0,1,0|0,0,2]=4 1197 B12R1.3824 CC1CCC(CN)(C(=O)O)CC1 Amb26543143 [0,1,0,0,1,0|0,0,0]=2 1198 B12R1.3824 CC1CCC(CN)(C(C)O)CC1 Amb26024353 [0,1,0,0,1,0|1,0,1]=4 1199 B12R1.3824 CC1CCC(CO)(C(=O)O)CC1 Amb27794028 [0,1,0,0,1,0|1,0,0]=3 1200 B12R1.3824 CCC1(C(=O)O)CCC(=O)CC1 Amb26967030 [0,1,0,0,1,0|1,0,1]=4 1201 B12R1.3824 CCC1(C(=O)O)CCC(C)CC1 Amb25764766 [0,1,0,0,1,0|1,0,0]=3 1202 B12R1.3824 CCC1(C(=O)O)CCC(N)CC1 Amb26570530 [0,1,0,0,1,0|1,0,0]=3 1203 B12R1.3824 CCC1(C(=O)O)CCC(O)CC1 Amb23589763 [0,1,0,0,1,0|1,0,0]=3 1204 B12R1.3824 CCC1(C(=O)O)CCN(C)CC1 Amb23589290 [0,1,0,0,1,0|2,0,0]=4 1205 B12R1.3824 CN1CCC(CO)(C(=O)O)CC1 Amb17570148 [0,1,0,0,1,0|2,0,0]=4 1206 B12R1.3824 COC1(C(=O)O)CCC(C)CC1 Amb18953817 [0,1,0,0,1,0|2,0,0]=4 1207 B12R1.3824 NC1CCC(CF)(C(=O)O)CC1 Amb33378693 [0,1,0,0,1,0|1,0,0]=3 1208 B12R1.3824 O=C(O)C1(CF)CCC(O)CC1 Amb33378695 [0,1,0,0,1,0|1,0,0]=3 1209 B12R1.3824 O=C1CCC(CF)(C(=O)O)CC1 Amb33378694 [0,1,0,0,1,0|1,0,1]=4 1210 B12R1.3858 CC1CCCC(C#N)(C(=O)O)C1 Amb28127281 [0,1,0,0,1,0|0,0,2]=4 1211 B12R1.3858 CC1CCCC(CN)(C(=O)O)C1 Amb25776737 [0,1,0,0,1,0|0,0,0]=2 1212 B12R1.3858 CC1CCCC(CN)(C(C)O)C1 Amb26346983 [0,1,0,0,1,0|1,0,1]=4 1213 B12R1.3858 CC1CCCC(CO)(C(=O)O)C1 Amb25105179 [0,1,0,0,1,0|1,0,0]=3 1214 B12R1.3858 CCC1(C(=O)O)CCCC(C)C1 Amb27796832 [0,1,0,0,1,0|1,0,0]=3 1215 B12R1.3858 CNC1(C(=O)O)CCCC(O)C1 Amb29867585 [0,1,0,0,1,0|2,0,0]=4 1216 B12R1.3858 COC1(C(=O)O)CCCC(C)C1 Amb18953816 [0,1,0,0,1,0|2,0,0]=4 1217 B12R1.3861 CC(C)(O)C1(CN)CCCCC1 Amb25268245 [0,1,0,0,1,0|1,0,1]=4 1218 B12R1.3861 CS(=O)(=O)C1(CN)CCCCC1 Amb18961787 [0,1,0,0,1,0|1,0,1]=4 1219 B12R1.3861 CS(=O)(=O)C1(CN)CCCCC1 Amb28555728 [0,1,0,0,1,0|1,0,1]=4 1220 B14R1.3696 CC(C)=CCC1(CN)CCCCC1O Amb27488023 [0,1,0,0,0,1|2,0,0]=4 1221 B14R1.3696 CC1CCCCC1(CN)CC=C(Cl)Cl Amb29866768 [0,1,0,0,0,1|2,0,0]=4 1222 B14R1.3696 NCC1(CC=C(Cl)Cl)CCCCC1O Amb30019322 [0,1,0,0,0,1|2,0,0]=4 1223 B14R1.9640 CC1CCC(CN)(CC=C(Cl)Cl)CC1 Amb30019321 [0,1,0,0,0,1|2,0,0]=4 1224 B14R1.9707 CC1CCCC(CN)(CC=C(Cl)Cl)C1 Amb30019319 [0,1,0,0,0,1|2,0,0]=4 1225 B14R1.11377 CC(C)=CC(O)C1(CN)CCCCC1 Amb35586933 [0,1,0,0,0,1|2,0,0]=4 1226 B14R1.11378 CCC1(NC(=O)C(=O)O)CCCCC1 Amb28193214 [0,1,0,0,0,1|1,0,1]=4 1227 B14R1.11378 O=C(O)C(=O)NC1(CO)CCCCC1 Amb28291824 [0,1,0,0,0,1|1,0,1]=4 1228 B14R1.12777 COCC1(CCC(=O)O)CCCCO1 Amb33341901 [0,1,0,0,0,1|2,0,0]=4 1229 B14R1.12777 COCC1(OCC(=O)O)CCCCO1 Amb33341612 [0,1,0,0,0,1|2,0,0]=4 1230 B14R1.12777 NCCC1(CCC(=O)O)CCCCC1 Amb18811006 [0,1,0,0,0,1|0,0,0]=2 1231 B14R1.16404 O=C(O)CCC1([N+](=O)[O-])CCCCC1 Amb1771356 [0,1,0,0,0,1|2,0,0]=4 1232 B14R1.16404 O=C(O)COC1(C(=O)O)CCCCC1 Amb32946114 [0,1,0,0,0,1|1,0,1]=4 1233 B14R1.19612 COC(=O)CNC1(C#N)CCCCC1 Amb17045043 [0,1,0,0,0,1|0,0,2]=4 1234 B14R1.23507 CS(=O)(=O)CCC1(CN)CCCCC1 Amb19029464 [0,1,0,0,0,1|1,0,1]=4 1235 B14R1.23507 CS(C)(=O)=NCC1(CN)CCCCC1 Amb28072128 [0,1,0,0,0,1|2,0,0]=4 1236 B14R1.23507 NCC1(CCS(=O)(=O)F)CCCCC1 Amb33463965 [0,1,0,0,0,1|1,0,1]=4 1237 B14R1.3703 CC1CCCCCC1(CN)CC(=O)O Amb35734034 [0,1,0,0,0,1|0,0,0]=2 1238 B14R1.3703 CNC1(CC(=O)O)CCCCCC1C Amb35733997 [0,1,0,0,0,1|2,0,0]=4 1239 B14R1.11374 C=C(C)C(O)C1(CN)CCCCCC1 Amb35624753 [0,1,0,0,0,1|2,0,0]=4 1240 B14R1.11374 CC(O)C(C)C1(CN)CCCCCC1 Amb28203193 [0,1,0,0,0,1|1,0,1]=4 1241 B14R1.11374 N#CC1(C(O)C(=O)O)CCCCCC1 Amb27387380 [0,1,0,0,0,1|0,0,2]=4 1242 B14R1.17343 CNOC1(CC(=O)O)CCCCCC1 Amb33098062 [0,1,0,0,0,1|1,0,0]=3 1243 B14R1.20918 CC(N)C1(CC(=O)O)CCCSCC1 Amb35692701 [0,1,0,0,0,1|0,0,0]=2 1244 B14R1.20918 CC(N)C1(CC(=O)O)COCCOC1 Amb27168528 [0,1,0,0,0,1|1,0,0]=3 1245 B14R1.20918 CN(C)C1(CC(=O)O)CCCCCC1 Amb27870641 [0,1,0,0,0,1|2,0,0]=4 1246 B14R1.20918 CN(C)C1(CC(=O)O)CCCSCC1 Amb35691459 [0,1,0,0,0,1|2,0,0]=4 1247 B14R1.4946 C[C@@H]1CCCC[C@@]1(CC(=O)O)C(=O)O Amb28207372 [0,2,0,0,0,0|1,0,1]=4 1248 B14R1.9637 CNC1(CC(=O)O)CCC(C)CC1C Amb27978121 [0,2,0,0,0,0|2,0,0]=4 1249 B14R1.11381 CNC1(CC(=O)O)CCCC(C)C1C Amb27218659 [0,2,0,0,0,0|2,0,0]=4 1250 B14R1.11540 CC1CCCCC1(CN)CC(C)(C)O Amb27777948 [0,2,0,0,0,0|1,0,1]=4 1251 B14R1.11581 CC1(C)CCSCC1(CN)CC(=O)O Amb28324901 [0,2,0,0,0,0|1,0,0]=3 1252 B14R1.20278 CNC(=O)NC1(CN)CCCCC1C Amb28200376 [0,2,0,0,0,0|2,0,0]=4 1253 B14R1.20278 C\C(=C/Cl)CC1(CN)CCCCC1C Amb27444788 [0,2,0,0,0,0|2,0,0]=4 1254 B14R1.20278 C\C(=C/Cl)CC1(CN)CCCCC1O Amb27827685 [0,2,0,0,0,0|2,0,0]=4 1255 B14R1.8670 CNC(=O)N(C)C1(CN)CCCCC1 Amb27612558 [0,2,0,0,0,0|2,0,0]=4 1256 B14R1.8670 COC(=O)C(O)C1(C#N)CCCCC1 Amb28410755 [0,2,0,0,0,0|0,0,2]=4 1257 B14R1.17346 COC(=O)CC1(CCN)CCCCC1 Amb33732022 [0,2,0,0,0,0|0,0,0]=2 1258 B14R1.19189 CCOC(=O)CC1(CN)CCCCC1 Amb19084983 [0,2,0,0,0,0|0,0,0]=2 1259 B14R1.19189 CCOC(=O)CC1(CN)CCCCC1 Amb19893214 [0,2,0,0,0,0|0,0,0]=2 1260 B14R1.19189 CCOC(=O)CC1(CN)CCOCC1 Amb33738391 [0,2,0,0,0,0|1,0,0]=3 1261 B14R1.19189 CCOC(=O)CC1(NC)CCCCC1 Amb19371788 [0,2,0,0,0,0|2,0,0]=4 1262 B14R1.19189 CCOC(=O)CC1(NC)CCCCC1 Amb22059602 [0,2,0,0,0,0|2,0,0]=4 1263 B14R1.19189 CNCC(O)CC1(CN)CCCCC1 Amb32656688 [0,2,0,0,0,0|1,0,1]=4 1264 B14R1.20221 COC(=O)NC1(CN)CCC(C)CC1 Amb28186295 [0,2,0,0,0,0|1,0,0]=3 1265 B14R1.20221 COC(=O)NC1(CN)CCN(C)CC1 Amb28045394 [0,2,0,0,0,0|2,0,0]=4 1266 B14R1.20221 COC(=O)NC1(CO)CCC(C)CC1 Amb19091532 [0,2,0,0,0,0|2,0,0]=4 1267 B14R1.20221 C\C(=C/Cl)CC1(CN)CCC(C)CC1 Amb27165330 [0,2,0,0,0,0|2,0,0]=4 1268 B14R1.20274 C[C@@H]1CCC[C@@](CN)(CC(=O)NO)C1 Amb27841272 [0,2,0,0,0,0|0,0,0]=2 1269 B14R1.20274 C\C(=C/Cl)CC1(CN)CCCC(C)C1 Amb28043300 [0,2,0,0,0,0|2,0,0]=4 1270 B14R1.20277 C=C(F)C1(CC(=O)OC)CCCCC1 Amb33347014 [0,2,0,0,0,0|1,0,1]=4 1271 B14R1.20277 COC(=O)NC1(C(N)=S)CCCCC1 Amb27603969 [0,2,0,0,0,0|1,0,1]=4 1272 B14R1.24971 COC(C)(C)CC1(CN)CCCCC1 Amb33198501 [0,2,0,0,0,0|1,0,1]=4 1273 B14R1.681 C=C(F)C1(CC(=O)O)CCC(C)CC1 Amb33346994 [0,2,0,0,0,0|1,0,1]=4 1274 B14R1.681 CC(C)C1(CC(=O)O)CCN(C)CC1 Amb27205400 [0,2,0,0,0,0|2,0,0]=4 1275 B14R1.681 CC1CCC(CC(=O)O)(C(C)N)CO1 Amb29850472 [0,2,0,0,0,0|1,0,0]=3 1276 B14R1.681 CC1CCC(CC(=O)O)(C(C)N)CS1 Amb35725402 [0,2,0,0,0,0|1,0,0]=3 1277 B14R1.681 CC1CCC(CC(=O)O)(N(C)C)CC1 Amb27644350 [0,2,0,0,0,0|2,0,0]=4 1278 B14R1.681 C[C@H]1CC[C@@](CC(=O)O)(C(=O)O)CC1 Amb28130408 [0,2,0,0,0,0|1,0,1]=4 1279 B14R1.681 C[C@H]1CC[C@](CC(=O)O)(C(=O)O)CC1 Amb27224721 [0,2,0,0,0,0|1,0,1]=4 1280 B14R1.681 O=C(O)C[C@]1(C(=O)O)CC[C@@H](O)CC1 Amb27957869 [0,2,0,0,0,0|1,0,1]=4 1281 B14R1.3268 C=CC1(CC(=O)O)CCC(CC)CC1 Amb33097594 [0,2,0,0,0,0|1,0,1]=4 1282 B14R1.3268 CCC1CCC(CC(=O)O)(ON)CC1 Amb33072019 [0,2,0,0,0,0|1,0,0]=3 1283 B14R1.3268 CCC1CCC(CN)(NC(N)=O)CC1 Amb28457154 [0,2,0,0,0,0|2,0,0]=4 1284 B14R1.3268 CCN1CCC(CC(=O)O)(ON)CC1 Amb33072023 [0,2,0,0,0,0|2,0,0]=4 1285 B14R1.9639 C=C(C)C(O)C1(CN)CCC(C)CC1 Amb35624671 [0,2,0,0,0,0|2,0,0]=4 1286 B14R1.9639 CC1CCC(CN)(C(O)C(=O)O)CC1 Amb27773757 [0,2,0,0,0,0|0,0,0]=2 1287 B14R1.9645 C=CC1(CC(=O)O)CCC(C)C(C)C1 Amb33097610 [0,2,0,0,0,0|1,0,1]=4 1288 B14R1.9645 CC1CCC(CC(=O)O)(ON)CC1C Amb33072033 [0,2,0,0,0,0|1,0,0]=3 1289 B14R1.9645 CNC1(CC(=O)O)CCC(C)C(C)C1 Amb28401309 [0,2,0,0,0,0|2,0,0]=4 1290 B14R1.12718 CNOC1(CC(=O)O)CCC(C)CC1 Amb33098061 [0,2,0,0,0,0|1,0,0]=3 1291 B14R1.12718 CNOC1(CC(=O)O)CCN(C)CC1 Amb33098064 [0,2,0,0,0,0|2,0,0]=4 1292 B14R1.23126 C=CC1(CC(=O)O)CCC(C)(C)CC1 Amb33097615 [0,2,0,0,0,0|1,0,1]=4 1293 B14R1.23126 C=CC1(CC(=O)O)CCC(F)(F)CC1 Amb33097612 [0,2,0,0,0,0|1,0,1]=4 1294 B14R1.23126 CC1(C)CCC(CC(=O)O)(ON)CC1 Amb33098058 [0,2,0,0,0,0|1,0,0]=3 1295 B14R1.23126 CC1(C)CCC(CN)(CC(=O)O)CC1 Amb27470500 [0,2,0,0,0,0|0,0,0]=2 1296 B14R1.23126 CNC1(CC(=O)O)CCC(F)(F)CC1 Amb30027802 [0,2,0,0,0,0|2,0,0]=4 1297 B14R1.23126 NCC1(CC(=O)O)CCC(F)(F)CC1 Amb30027804 [0,2,0,0,0,0|0,0,0]=2 1298 B14R1.23126 NCC1(CC(=O)O)CCS(=O)(=O)CC1 Amb24644694 [0,2,0,0,0,0|1,0,0]=3 1299 B14R1.23126 NCC1(CC(=O)O)CCS(=O)(=O)CC1 Amb32916305 [0,2,0,0,0,0|1,0,0]=3 1300 B14R1.23126 NOC1(CC(=O)O)CCC(F)(F)CC1 Amb33098056 [0,2,0,0,0,0|1,0,0]=3 1301 B14R1.23126 NOC1(CC(=O)O)CCS(=O)(=O)CC1 Amb33072026 [0,2,0,0,0,0|2,0,0]=4 1302 B14R1.23128 CS(=O)(=O)CC1(CN)CCC(O)CC1 Amb33055723 [0,2,0,0,0,0|1,0,1]=4 1303 B14R1.5960 C=C(F)C1(CC(=O)O)CCCC(C)C1 Amb33346999 [0,2,0,0,0,0|1,0,1]=4 1304 B14R1.9652 C=CC1(CC(=O)O)CC(C)CC(C)C1 Amb33097609 [0,2,0,0,0,0|1,0,1]=4 1305 B14R1.9652 CC1CC(C)CC(CC(=O)O)(ON)C1 Amb33072032 [0,2,0,0,0,0|1,0,0]=3 1306 B14R1.9652 CNC1(CC(=O)O)CC(C)CC(C)C1 Amb27665558 [0,2,0,0,0,0|2,0,0]=4 1307 B14R1.9652 C[C@H]1C[C@@H](C)C[C@@](CN)(CC(=O)O)C1 Amb27985889 [0,2,0,0,0,0|0,0,0]=2 1308 B14R1.9706 CC1CCCC(CN)(C(O)C(=O)O)C1 Amb27387499 [0,2,0,0,0,0|0,0,0]=2 1309 B14R1.9706 CC1CCCC(CN)(N(C)C(N)=O)C1 Amb27852665 [0,2,0,0,0,0|2,0,0]=4 1310 B14R1.12774 CNOC1(CC(=O)O)CCCC(C)C1 Amb33098070 [0,2,0,0,0,0|1,0,0]=3 1311 B14R1.23460 C=CC1(CC(=O)O)CCCC(C)(C)C1 Amb33097606 [0,2,0,0,0,0|1,0,1]=4 1312 B14R1.23460 CC1(C)CCCC(CC(=O)O)(ON)C1 Amb33098053 [0,2,0,0,0,0|1,0,0]=3 1313 B14R1.23460 CC1(C)CCCC(CN)(CC(=O)O)C1 Amb27773824 [0,2,0,0,0,0|0,0,0]=2 1314 B14R1.23462 CC1CCCC(CN)(CC(C)(C)O)C1 Amb28121388 [0,2,0,0,0,0|1,0,1]=4 1315 B14R1.23462 CC1CCCC(CN)(CS(=O)(=O)O)C1 Amb27485981 [0,2,0,0,0,0|1,0,0]=3 1316 B14R1.23462 C[C@@H]1CCC[C@@](CN)(CS(=O)(=O)O)C1 Amb28400890 [0,2,0,0,0,0|1,0,0]=3 1317 B14R1.12776 COCC1(C(C)C(=O)O)CCCCO1 Amb33341226 [0,2,0,0,0,0|2,0,0]=4 1318 B14R1.12776 COCC1(C(N)C(=O)O)CCCCO1 Amb33341910 [0,2,0,0,0,0|2,0,0]=4 1319 B14R1.12776 COCC1(C(O)C(=O)O)CCCCO1 Amb33341903 [0,2,0,0,0,0|2,0,0]=4 1320 B14R1.23922 CC(C(=O)O)C1(C(=O)O)CCCCC1 Amb27495347 [0,2,0,0,0,0|1,0,1]=4 1321 B14R1.24969 COC1(C(F)(F)C(=O)O)CCCCC1 Amb31188280 [0,2,0,0,0,0|2,0,0]=4 1322 B14R1.10691 CC(=O)NC1(CCCN)CCCCC1 Amb32724095 [0,2,0,0,0,0|2,0,0]=4 1323 B14R1.16771 CC(=O)NC1(CC(=O)O)CCCCC1 Amb7088944 [0,2,0,0,0,0|1,0,1]=4 1324 B14R1.16771 NC(=O)CC1(CC(=O)O)CCCCC1 Amb534598 [0,2,0,0,0,0|0,0,0]=2 1325 B14R1.16771 NC(=O)NC1(CC(=O)O)CCOCC1 Amb30032768 [0,2,0,0,0,0|1,0,1]=4 1326 B14R1.16771 O=C(O)CC1(CC(=O)O)CCCCC1 Amb1158876 [0,2,0,0,0,0|1,0,0]=3 1327 B14R1.16771 O=C(O)CC1(CC(=O)O)CCNCC1 Amb6752537 [0,2,0,0,0,0|2,0,0]=4 1328 B14R1.16771 O=C(O)CC1(CC(=O)O)CCOCC1 Amb18653749 [0,2,0,0,0,0|2,0,0]=4 1329 B14R1.19512 CN(C#N)C1(CC(=O)O)CCCCC1 Amb29870764 [0,2,0,0,0,0|0,0,2]=4 1330 B14R1.19512 COC(=O)C1(CC(=O)O)CCCCC1 Amb2613294 [0,2,0,0,0,0|1,0,1]=4 1331 B12R1.4 CCC1CCC(CC(=O)O)CC1 Amb6749257 [0,0,1,1,0,0|1,0,0]=3 1332 B12R1.4 CCC1CCC(CC(C)=O)CC1 Amb27450581 [0,0,1,1,0,0|2,0,0]=4 1333 B12R1.4 CCC1CCN(CC(=O)O)CC1 Amb18977965 [0,0,1,1,0,0|2,0,0]=4 1334 B12R1.4 CCN1CCC(CC(=O)O)CC1 Amb22586893 [0,0,1,1,0,0|2,0,0]=4 1335 B12R1.4 CCN1CCC(CC(=O)O)CC1 Amb6749255 [0,0,1,1,0,0|2,0,0]=4 1336 B12R1.4 CCN1CCC(CC(=O)O)CC1 Amb8503351 [0,0,1,1,0,0|2,0,0]=4 1337 B12R1.4 CC[C@H]1CO[C@H](CC(=O)O)CN1 Amb27818046 [0,0,1,1,0,0|1,0,0]=3 1338 B12R1.4 COC1CCC(CC(=O)O)CC1 Amb17843159 [0,0,1,1,0,0|2,0,0]=4 1339 B12R1.4 CO[C@H]1CC[C@@H](CC(=O)O)CC1 Amb27760398 [0,0,1,1,0,0|2,0,0]=4 1340 B12R1.4 NCC1CCC(CC(=O)O)CC1 Amb20620280 [0,0,1,1,0,0|2,0,0]=4 1341 B12R1.4 NC[C@H]1CC[C@H](CC(=O)O)CC1 Amb28240760 [0,0,1,1,0,0|2,0,0]=4 1342 B12R1.4 NC[C@H]1CC[C@H](CC(=O)O)CC1 Amb33812384 [0,0,1,1,0,0|2,0,0]=4 1343 B12R1.210 CC(=O)CC1CCCCCC1Cl Amb28047319 [0,0,1,1,0,0|2,0,0]=4 1344 B12R1.210 CC(=O)C[C@H]1CCCCC[C@@H]1Cl Amb27844358 [0,0,1,1,0,0|2,0,0]=4 1345 B12R1.210 CC(=O)NC1CCCCCC1N Amb27266098 [0,0,1,1,0,0|2,0,0]=4 1346 B12R1.210 CC1CCCCCC1CC(=O)O Amb29865063 [0,0,1,1,0,0|1,0,0]=3 1347 B12R1.210 CC1NCCCCC1CC(=O)O Amb27792876 [0,0,1,1,0,0|2,0,0]=4 1348 B12R1.210 CN1CCCCCC1CC(=O)O Amb28250660 [0,0,1,1,0,0|2,0,0]=4 1349 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(=O)O Amb18198536 [0,0,1,1,0,0|2,0,0]=4 1350 B12R1.210 C[C@H]1NCCCC[C@@H]1CC(=O)O Amb27420235 [0,0,1,1,0,0|2,0,0]=4 1351 B12R1.210 NC(=O)NC1CCCCCC1N Amb27249850 [0,0,1,1,0,0|2,0,0]=4 1352 B12R1.210 NC1CCCCCC1CC(=O)O Amb27178104 [0,0,1,1,0,0|0,0,0]=2 1353 B12R1.210 N[C@@H]1CCCCC[C@@H]1CC(=O)O Amb27816143 [0,0,1,1,0,0|0,0,0]=2 1354 B12R1.210 O=C(O)CC1CCCCCC1=O Amb18825694 [0,0,1,1,0,0|1,0,1]=4 1355 B12R1.210 O=C(O)CC1CCCCCC1O Amb18198284 [0,0,1,1,0,0|1,0,0]=3 1356 B12R1.210 O=C(O)CC1CCOCCC1F Amb27620258 [0,0,1,1,0,0|2,0,0]=4 1357 B12R1.210 O=C(O)CC1CCSCCC1F Amb28133029 [0,0,1,1,0,0|2,0,0]=4 1358 B12R1.224 NC1CCCC(CC(=O)O)C1O Amb27605801 [0,0,1,1,0,0|2,0,0]=4 1359 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,0,1,1,0,0|2,0,0]=4 1360 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(=O)O Amb18198539 [0,0,1,1,0,0|2,0,0]=4 1361 B12R1.405 CC[C@H]1NCCCC[C@@H]1C(=O)O Amb28247202 [0,0,1,1,0,0|2,0,0]=4 1362 B12R1.405 CO[C@H]1CCCCC[C@H]1C(=O)O Amb27489023 [0,0,1,1,0,0|2,0,0]=4 1363 B12R1.405 CS(=O)C1CCCCCC1CN Amb27181216 [0,0,1,1,0,0|2,0,0]=4 1364 B12R1.405 CSC1CCCCCC1C(=O)O Amb18967402 [0,0,1,1,0,0|2,0,0]=4 1365 B12R1.437 CC1CCCC(C=O)C1C(=O)O Amb28245773 [0,0,1,1,0,0|1,0,1]=4 1366 B12R1.437 CC1CCCC(CO)C1C(=O)O Amb28076893 [0,0,1,1,0,0|1,0,0]=3 1367 B12R1.437 CC[C@H]1CCCN(C)[C@@H]1C(=O)O Amb27810945 [0,0,1,1,0,0|2,0,0]=4 1368 B12R1.476 CC(=O)NC(CN)C1CCCC1 Amb27978644 [0,0,1,1,0,0|2,0,0]=4 1369 B12R1.476 CCC(CC(=O)O)C1CCCC1 Amb18825583 [0,0,1,1,0,0|1,0,0]=3 1370 B12R1.476 CCC(CC(=O)O)C1CCNC1 Amb18825418 [0,0,1,1,0,0|2,0,0]=4 1371 B12R1.476 N#CC(CC(=O)O)C1CCCC1 Amb27480861 [0,0,1,1,0,0|0,0,2]=4 1372 B12R1.476 NCC(CC(=O)O)C1CCCC1 Amb30584985 [0,0,1,1,0,0|0,0,0]=2 1373 B12R1.476 NCC(CC(=O)O)C1CCCC1 Amb32656216 [0,0,1,1,0,0|0,0,0]=2 1374 B12R1.476 NCC(CC(=O)O)C1CCCO1 Amb33079424 [0,0,1,1,0,0|1,0,0]=3 1375 B12R1.476 NCC(CC(=O)O)C1CCCS1 Amb33416243 [0,0,1,1,0,0|1,0,0]=3 1376 B12R1.476 NCC(CC(=O)O)C1CCOC1 Amb33171995 [0,0,1,1,0,0|1,0,0]=3 1377 B12R1.476 NCC(CC(=O)O)C1CCSC1 Amb33141658 [0,0,1,1,0,0|1,0,0]=3 1378 B12R1.476 NCC(NC(N)=O)C1CCCC1 Amb27760987 [0,0,1,1,0,0|2,0,0]=4 1379 B12R1.476 O=C(O)CC(CO)N1CCCC1 Amb18198045 [0,0,1,1,0,0|2,0,0]=4 1380 B12R1.815 CCC1SCC(CC(=O)O)C1N Amb18189901 [0,0,1,1,0,0|1,0,0]=3 1381 B12R1.815 CCN1CC[C@H](CC(=O)O)[C@H]1C Amb18198538 [0,0,1,1,0,0|2,0,0]=4 1382 B12R1.1020 CC1CCCC(CC(=O)O)CC1 Amb25150903 [0,0,1,1,0,0|1,0,0]=3 1383 B12R1.1020 CN1CCCC(CC(=O)O)CC1 Amb18198562 [0,0,1,1,0,0|2,0,0]=4 1384 B12R1.1020 CN1CCCC(CC(=O)O)CC1 Amb33483549 [0,0,1,1,0,0|2,0,0]=4 1385 B12R1.1392 CC(=O)NC1CCCCCNC1 Amb32659965 [0,0,1,1,0,0|2,0,0]=4 1386 B12R1.1392 O=C(O)CC1CCCCCCC1 Amb6749259 [0,0,1,1,0,0|1,0,0]=3 1387 B12R1.1392 O=C(O)CC1CCCCCCO1 Amb27634953 [0,0,1,1,0,0|2,0,0]=4 1388 B12R1.1392 O=C(O)CN1CCCCCCC1 Amb6613276 [0,0,1,1,0,0|2,0,0]=4 1389 B12R1.1392 O=C(O)C[C@H]1CCCCCCN1 Amb27985858 [0,0,1,1,0,0|2,0,0]=4 1390 B12R1.2591 CCCC1(CC)CC(=O)NC1C Amb28351040 [0,0,1,1,0,0|2,0,0]=4 1391 B12R1.3297 CCCC1(CN)CCS(=O)(=O)C1 Amb18995822 [0,0,1,1,0,0|1,0,1]=4 1392 B12R1.3611 CCC1(CC)CC(=O)OC1CI Amb33276704 [0,0,1,1,0,0|2,0,0]=4 1393 B12R1.3611 CCC1(CC)CC(=O)OC1CN Amb33276928 [0,0,1,1,0,0|2,0,0]=4 1394 B12R1.3611 CCC1NC(=O)CC1(CC)CC Amb28323720 [0,0,1,1,0,0|2,0,0]=4 1395 B12R1.3851 CC1CC(CN)(CC(=O)O)C1C Amb27859007 [0,0,1,1,0,0|0,0,0]=2 1396 B12R1.3851 C[C@@H]1C[C@](CN)(CC(=O)O)[C@@H]1C Amb27419937 [0,0,1,1,0,0|0,0,0]=2 1397 B12R1.3851 C[C@H]1C[C@@](CN)(CC(=O)O)[C@@H]1C Amb27419934 [0,0,1,1,0,0|0,0,0]=2 1398 B12R1.3851 C[C@H]1C[C@@](CN)(CC(=O)O)[C@H]1C Amb27419935 [0,0,1,1,0,0|0,0,0]=2 1399 B12R1.669 CC1(CCl)CCCCC1C(N)=O Amb28385634 [0,0,1,1,0,0|2,0,0]=4 1400 B12R1.669 CC1(CF)CCCCC1C(=O)O Amb27791269 [0,0,1,1,0,0|1,0,0]=3 1401 B12R1.669 CCC1(C)CCCCC1C(C)=O Amb27948589 [0,0,1,1,0,0|2,0,0]=4 1402 B12R1.1774 CCCCC1(CC(=O)O)CCC1 Amb33428419 [0,0,1,1,0,0|1,0,0]=3 1403 B12R1.1774 CCSCC1(CC(=O)O)CCC1 Amb33324023 [0,0,1,1,0,0|2,0,0]=4 1404 B12R1.1774 COCCC1(CC(=O)O)CCC1 Amb33377816 [0,0,1,1,0,0|2,0,0]=4 1405 B12R1.1774 CSCCC1(CC(=O)O)CCC1 Amb33198743 [0,0,1,1,0,0|2,0,0]=4 1406 B12R1.1829 NC1(CC(=O)O)CCCCCC1 Amb22641940 [0,0,1,1,0,0|2,0,0]=4 1407 B12R1.1829 NC1(CC(=O)O)CCCCCC1 Amb31307618 [0,0,1,1,0,0|2,0,0]=4 1408 B12R1.1829 O=C(O)CC1(F)CCCCCC1 Amb28196214 [0,0,1,1,0,0|2,0,0]=4 1409 B12R1.1829 O=C(O)CC1(O)CCCCCC1 Amb18285918 [0,0,1,1,0,0|2,0,0]=4 1410 B12R1.2261 CCCCC1(C)CC(=O)NC1C Amb27645749 [0,0,1,1,0,0|2,0,0]=4 1411 B12R1.2277 CCCCC1(O)CCOC(=O)C1 Amb27495709 [0,0,1,1,0,0|2,0,0]=4 1412 B12R1.2277 CCCC[C@]1(C)CCCC(=O)C1 Amb27954111 [0,0,1,1,0,0|2,0,0]=4 1413 B12R1.2330 CCC(N)(CC(=O)O)C1CCC1 Amb33255627 [0,0,1,1,0,0|2,0,0]=4 1414 B12R1.2330 NCC(O)(CC(=O)O)C1CCC1 Amb33346949 [0,0,1,1,0,0|1,0,0]=3 1415 B12R1.2352 CCC1(C)CCCCCC(=O)C1 Amb27177879 [0,0,1,1,0,0|2,0,0]=4 1416 B12R1.2352 CC[C@@]1(C)CCCCCC(=O)C1 Amb27954062 [0,0,1,1,0,0|2,0,0]=4 1417 B12R1.2567 CCC1CC(N)(CC(=O)O)CO1 Amb32788002 [0,0,1,1,0,0|2,0,0]=4 1418 B12R1.2567 CCC1CC(O)(CC(=O)O)CO1 Amb35633950 [0,0,1,1,0,0|2,0,0]=4 1419 B12R1.2567 CCC1CCC(N)(CC(=O)O)C1 Amb26323377 [0,0,1,1,0,0|2,0,0]=4 1420 B12R1.4679 CC1CC1C(O)(CN)CC(=O)O Amb33346956 [0,0,1,1,0,0|1,0,0]=3 1421 B12R1.4679 CCC(N)(CC(=O)O)C1CC1C Amb33255660 [0,0,1,1,0,0|2,0,0]=4 1422 B12R2.19 CC12CCCCC1OC(O)C2 Amb27396929 [1,0,0,1,0,0|0,0,2]=4 1423 B12R2.19 C[C@@]12CCCC[C@@H]1CC(=O)C2 Amb27844101 [1,0,0,1,0,0|1,0,0]=3 1424 B12R2.19 C[C@@]12CCCC[C@H]1CC(=O)C2 Amb27818183 [1,0,0,1,0,0|1,0,0]=3 1425 B12R2.19 C[C@]12CCCC[C@H]1CC(=O)C2 Amb25179810 [1,0,0,1,0,0|1,0,0]=3 1426 B12R2.19 C[C@]12CCCC[C@H]1CC(O)C2 Amb27844224 [1,0,0,1,0,0|1,0,1]=4 1427 B12R2.19 C[C@]12CCCC[C@H]1NC(=O)O2 Amb27841050 [1,0,0,1,0,0|2,0,0]=4 1428 B12R2.19 C[C@]12CCCC[C@H]1OC(=O)N2 Amb26425025 [1,0,0,1,0,0|1,0,0]=3 1429 B12R2.19 NC12CCCCC1NC(=O)C2 Amb32721595 [1,0,0,1,0,0|1,0,0]=3 1430 B12R2.19 N[C@]12CCCC[C@H]1NC(=O)C2 Amb32992772 [1,0,0,1,0,0|1,0,0]=3 1431 B12R2.250 CC(=O)C1CC12CCCCC2 Amb27215552 [1,0,0,1,0,0|1,0,0]=3 1432 B12R2.250 CC(=O)C1CC12CCCNC2 Amb27782525 [1,0,0,1,0,0|2,0,0]=4 1433 B12R2.250 CC(=O)C1CC12CCNCC2 Amb27866581 [1,0,0,1,0,0|2,0,0]=4 1434 B12R2.250 CC(=O)C1OC12CCCCC2 Amb28351539 [1,0,0,1,0,0|2,0,0]=4 1435 B12R2.250 CC(=O)N1CC12CCCCC2 Amb24078312 [1,0,0,1,0,0|2,0,0]=4 1436 B12R2.250 NC(=O)C1CC12CCNCC2 Amb27766779 [1,0,0,1,0,0|2,0,0]=4 1437 B12R2.250 NC(=O)C1OC12CCCCC2 Amb24634187 [1,0,0,1,0,0|2,0,0]=4 1438 B12R2.250 NC(=O)[C@@H]1CC12CCCCC2 Amb25065202 [1,0,0,1,0,0|1,0,0]=3 1439 B12R2.250 NC(=O)[C@H]1CC12CCOCC2 Amb28365478 [1,0,0,1,0,0|2,0,0]=4 1440 B12R2.250 O=C(Cl)C1CC12CCOCC2 Amb35717347 [1,0,0,1,0,0|2,0,0]=4 1441 B12R2.250 O=C(O)C1CC12CCCCC2 Amb10607313 [1,0,0,1,0,0|0,0,0]=2 1442 B12R2.250 O=C(O)C1CC12CCCCN2 Amb27827705 [1,0,0,1,0,0|1,0,0]=3 1443 B12R2.250 O=C(O)C1CC12CCCNC2 Amb23590870 [1,0,0,1,0,0|1,0,0]=3 1444 B12R2.250 O=C(O)C1CC12CCCNC2 Amb30584813 [1,0,0,1,0,0|1,0,0]=3 1445 B12R2.250 O=C(O)C1CC12CCCOC2 Amb26026760 [1,0,0,1,0,0|1,0,0]=3 1446 B12R2.250 O=C(O)C1CC12CCNCC2 Amb16187123 [1,0,0,1,0,0|1,0,0]=3 1447 B12R2.250 O=C(O)C1CC12CCNCC2 Amb21959838 [1,0,0,1,0,0|1,0,0]=3 1448 B12R2.250 O=C(O)C1CC12CCOCC2 Amb17605508 [1,0,0,1,0,0|1,0,0]=3 1449 B12R2.250 O=C(O)C1CC12CCSCC2 Amb18948988 [1,0,0,1,0,0|1,0,0]=3 1450 B12R2.250 O=C(O)C1CC12COCCN2 Amb28246853 [1,0,0,1,0,0|2,0,0]=4 1451 B12R2.250 O=C(O)C1OC12CCCCC2 Amb16230757 [1,0,0,1,0,0|1,0,0]=3 1452 B12R2.250 O=C(O)C1OC12CCCOC2 Amb28074831 [1,0,0,1,0,0|2,0,0]=4 1453 B12R2.250 O=C(O)[C@@H]1CC12CCCCC2 Amb26880141 [1,0,0,1,0,0|0,0,0]=2 1454 B12R2.250 O=C(O)[C@@H]1CC12CCOCC2 Amb25279532 [1,0,0,1,0,0|1,0,0]=3 1455 B12R2.250 O=C(O)[C@@H]1OC12CCCCC2 Amb25933481 [1,0,0,1,0,0|1,0,0]=3 1456 B12R2.250 O=C(O)[C@H]1CC12CCOCC2 Amb25916297 [1,0,0,1,0,0|1,0,0]=3 1457 B12R2.411 C=C1CC1C2(C)CCCCC2 Amb4019200 [1,0,0,1,0,0|2,0,0]=4 1458 B12R2.1153 CC12CCCC(CC(=O)C1)N2 Amb28435181 [1,0,0,1,0,0|2,0,0]=4 1459 B12R2.1153 C[C@]12CCC[C@@H](CC(=O)C1)N2 Amb27818113 [1,0,0,1,0,0|2,0,0]=4 1460 B12R2.1153 C[C@]12CCC[C@H](CC(=O)C1)N2 Amb27250899 [1,0,0,1,0,0|2,0,0]=4 1461 B12R2.1153 O=C1CC2CCCC(Br)(C1)C2 Amb23589685 [1,0,0,1,0,0|2,0,0]=4 1462 B12R2.1153 O=C1CC2CCCC(F)(C1)C2 Amb28253764 [1,0,0,1,0,0|2,0,0]=4 1463 B12R2.1153 O=C1CC2CCCC(O)(C1)C2 Amb23589681 [1,0,0,1,0,0|2,0,0]=4 1464 B12R2.1153 O=C1C[C@@H]2CCC[C@](F)(C1)C2 Amb27195439 [1,0,0,1,0,0|2,0,0]=4 1465 B12R2.1153 O=C1C[C@H]2CCC[C@@](O)(C1)C2 Amb28351512 [1,0,0,1,0,0|2,0,0]=4 1466 B12R2.1412 CC(=O)NC12CCCCC1C2 Amb35724139 [1,0,0,1,0,0|2,0,0]=4 1467 B12R2.1412 NC(=O)NC12CCCCC1C2 Amb35723901 [1,0,0,1,0,0|2,0,0]=4 1468 B12R2.1412 O=C(Cl)NC12CCCCC1C2 Amb35633602 [1,0,0,1,0,0|2,0,0]=4 1469 B12R2.1412 O=C(O)CC12CCCCC1C2 Amb25362080 [1,0,0,1,0,0|0,0,0]=2 1470 B12R2.1664 NC(=O)CC1(N)CCC2CC21 Amb33254221 [1,0,0,1,0,0|1,0,0]=3 1471 B12R2.1664 NC(=O)CC1(N)CC[C@@H]2C[C@@H]21 Amb33308253 [1,0,0,1,0,0|1,0,0]=3 1472 B12R2.1664 NC1(CC(=O)O)CCC2CC21 Amb25789109 [1,0,0,1,0,0|0,0,0]=2 1473 B12R2.1664 NC1(CC(=O)O)CC[C@@H]2C[C@@H]21 Amb33254630 [1,0,0,1,0,0|0,0,0]=2 1474 B12R2.1664 O=C(O)CC1(O)CCC2CC21 Amb33036254 [1,0,0,1,0,0|1,0,0]=3 1475 B12R2.1664 O=C(O)CC1(O)CC[C@@H]2C[C@@H]21 Amb33036192 [1,0,0,1,0,0|1,0,0]=3 1476 B12R2.2918 NC1=NC2(CCCCC2)CO1 Amb26861001 [1,0,0,1,0,0|2,0,0]=4 1477 B12R2.2918 O=C1C=CC2(CCCCC2)C1 Amb28202155 [1,0,0,1,0,0|1,0,1]=4 1478 B12R2.2918 O=C1CC2(CCCCC2)CN1 Amb7990390 [1,0,0,1,0,0|1,0,0]=3 1479 B12R2.2918 O=C1CC2(CCCCC2)CO1 Amb25697017 [1,0,0,1,0,0|0,0,0]=2 1480 B12R2.2918 O=C1CC2(CCCCC2)NN1 Amb25062534 [1,0,0,1,0,0|1,0,0]=3 1481 B12R2.2918 O=C1CC2(CCCCN2)CN1 Amb18200735 [1,0,0,1,0,0|2,0,0]=4 1482 B12R2.2918 O=C1CC2(CCCNC2)CN1 Amb18200736 [1,0,0,1,0,0|2,0,0]=4 1483 B12R2.2918 O=C1CC2(CCCNC2)CN1 Amb22751383 [1,0,0,1,0,0|2,0,0]=4 1484 B12R2.2918 O=C1CC2(CCCOC2)CN1 Amb26887575 [1,0,0,1,0,0|2,0,0]=4 1485 B12R2.2918 O=C1CC2(CCCOC2)NN1 Amb35686200 [1,0,0,1,0,0|2,0,0]=4 1486 B12R2.2918 O=C1CC2(CCCSC2)CN1 Amb27790312 [1,0,0,1,0,0|2,0,0]=4 1487 B12R2.2918 O=C1CC2(CCCSC2)NN1 Amb35701164 [1,0,0,1,0,0|2,0,0]=4 1488 B12R2.2918 O=C1CC2(CCNCC2)CN1 Amb15701326 [1,0,0,1,0,0|2,0,0]=4 1489 B12R2.2918 O=C1CC2(CCNCC2)CN1 Amb20241726 [1,0,0,1,0,0|2,0,0]=4 1490 B12R2.2918 O=C1CC2(CCNCC2)CN1 Amb22587276 [1,0,0,1,0,0|2,0,0]=4 1491 B12R2.2918 O=C1CC2(CCNCC2)NN1 Amb28388430 [1,0,0,1,0,0|2,0,0]=4 1492 B12R2.2918 O=C1CC2(CCOCC2)CN1 Amb19149222 [1,0,0,1,0,0|2,0,0]=4 1493 B12R2.2918 O=C1CC2(CCOCC2)CO1 Amb27392388 [1,0,0,1,0,0|1,0,0]=3 1494 B12R2.2918 O=C1CC2(CCOCC2)NN1 Amb35685803 [1,0,0,1,0,0|2,0,0]=4 1495 B12R2.2918 O=C1CC2(CCSCC2)NN1 Amb30010414 [1,0,0,1,0,0|2,0,0]=4 1496 B12R2.2918 O=C1CCC2(CCCCC2)C1 Amb28253675 [1,0,0,1,0,0|1,0,0]=3 1497 B12R2.2918 O=C1CCC2(CCCCC2)N1 Amb25984890 [1,0,0,1,0,0|2,0,0]=4 1498 B12R2.2918 O=C1CCC2(CCCCC2)O1 Amb574708 [1,0,0,1,0,0|2,0,0]=4 1499 B12R2.2918 O=C1CCC2(CCOCC2)C1 Amb33743523 [1,0,0,1,0,0|2,0,0]=4 1500 B12R2.2918 O=C1CNC2(CCCCC2)N1 Amb15695109 [1,0,0,1,0,0|2,0,0]=4 1501 B12R2.2918 O=C1NC2(CCCNC2)CO1 Amb27473717 [1,0,0,1,0,0|2,0,0]=4 1502 B12R2.2918 O=C1NC2(CCNCC2)CO1 Amb22728858 [1,0,0,1,0,0|2,0,0]=4 1503 B12R2.2918 O=C1NC2(CCNCC2)CO1 Amb28652926 [1,0,0,1,0,0|2,0,0]=4 1504 B12R2.2918 O=C1NC2(CCOCC2)CO1 Amb27640805 [1,0,0,1,0,0|2,0,0]=4 1505 B12R2.2918 O=C1NCC2(CCCCC2)O1 Amb17506327 [1,0,0,1,0,0|2,0,0]=4 1506 B12R2.2918 O=C1OCC2(CCNCC2)O1 Amb15701375 [1,0,0,1,0,0|2,0,0]=4 1507 B12R2.2918 O=C1OCC2(CCNCC2)O1 Amb22587312 [1,0,0,1,0,0|2,0,0]=4 1508 B12R2.2918 OC1CCC2(CCCCC2)C1 Amb27760981 [1,0,0,1,0,0|1,0,1]=4 1509 B12R2.3126 CC12CCCCC1C2C(=O)O Amb27490809 [1,0,0,1,0,0|0,0,0]=2 1510 B12R2.3126 CC12CCCCC1C2C(N)=O Amb25097167 [1,0,0,1,0,0|1,0,0]=3 1511 B12R2.3126 C[C@]12CCCC[C@H]1[C@@H]2C(=O)O Amb27865448 [1,0,0,1,0,0|0,0,0]=2 1512 B12R2.3243 CC1(NC(N)=O)C2CCCC21 Amb27471994 [1,0,0,1,0,0|2,0,0]=4 1513 B12R2.3257 CC(=O)NC12CCC(CC1)C2 Amb27870381 [1,0,0,1,0,0|2,0,0]=4 1514 B12R2.3257 NC(=O)NC12CCC(CC1)C2 Amb28344547 [1,0,0,1,0,0|2,0,0]=4 1515 B12R2.3257 NS(=O)CC12CCC(CC1)C2 Amb32720735 [1,0,0,1,0,0|2,0,0]=4 1516 B12R2.3257 O=C(O)CC12C=CC(CC1)C2 Amb28076859 [1,0,0,1,0,0|0,0,2]=4 1517 B12R2.3257 O=C(O)CC12CCC(CC1)C2 Amb27402859 [1,0,0,1,0,0|0,0,0]=2 1518 B12R2.3257 O=C(O)CC12CCC(CC1)O2 Amb32685173 [1,0,0,1,0,0|1,0,0]=3 1519 B12R2.3257 O=S(Cl)CC12CCC(CC1)C2 Amb32720732 [1,0,0,1,0,0|2,0,0]=4 1520 B12R2.3257 O=S([O-])CC12CCC(CC1)C2 Amb32754940 [1,0,0,1,0,0|1,0,1]=4 1521 B12R2.5619 CC1(CC2CO2)CCCCC1 Amb33417978 [1,0,0,1,0,0|1,0,1]=4 1522 B12R2.8 NC1CCCC12CCCCC2 Amb25882848 [1,0,0,1,0,0|1,0,1]=4 1523 B12R2.8 NC1CCCC12CCCCC2 Amb28652948 [1,0,0,1,0,0|1,0,1]=4 1524 B12R2.8 NC1CNCC12CCCCC2 Amb31031070 [1,0,0,1,0,0|2,0,0]=4 1525 B12R2.8 NC1CNCC12CCCCC2 Amb31196548 [1,0,0,1,0,0|2,0,0]=4 1526 B12R2.35 O=CC1CCC12CCCCC2 Amb28186611 [1,0,0,1,0,0|1,0,0]=3 1527 B12R2.35 OCC1CCC12CCCCC2 Amb35619207 [1,0,0,1,0,0|1,0,1]=4 1528 B12R2.35 ONC1CCC12CCCCC2 Amb35739586 [1,0,0,1,0,0|2,0,0]=4 1529 B12R2.2278 OCCC12CCCCC1NC2 Amb27794783 [1,0,0,1,0,0|0,0,1]=3 1530 B12R2.2278 OCC[C@]12CCCC[C@H]1NC2 Amb28368383 [1,0,0,1,0,0|0,0,1]=3 1531 B12R2.2799 NC1C(=O)SC12CCCCC2 Amb33330910 [1,0,0,1,0,0|1,0,0]=3 1532 B12R2.2799 NC1C(=O)SC12CCCCC2 Amb33482862 [1,0,0,1,0,0|1,0,0]=3 1533 B12R2.3941 NCC12CCCC(C1)C(=O)N2 Amb33328715 [1,0,0,1,0,0|1,0,0]=3 1534 B12R2.3941 O=C1NC2(CI)CCCC1C2 Amb33457889 [1,0,0,1,0,0|2,0,0]=4 1535 B12R2.3971 NCC12CCCCC1NCC2 Amb33229391 [1,0,0,1,0,0|1,0,1]=4 1536 B12R2.3971 NCC12CCOC1CCOC2 Amb32660068 [1,0,0,1,0,0|1,0,1]=4 1537 B12R2.3988 O=C1NC2(CO)CCC1CC2 Amb23439430 [1,0,0,1,0,0|2,0,0]=4 1538 B12R2.4370 C1CCC2(CC1)CCCNC2 Amb2786554 [1,0,0,1,0,0|1,0,1]=4 1539 B12R2.4370 C1CCC2(CC1)CNCOC2 Amb27808783 [1,0,0,1,0,0|2,0,0]=4 1540 B12R2.4504 NCC1(C2CC2)CCCCC1 Amb26869734 [1,0,0,1,0,0|1,0,1]=4 1541 B12R2.4504 NCC1(C2CO2)CCSCC1 Amb27840152 [1,0,0,1,0,0|1,0,1]=4 1542 B12R2.5065 C=CCC1(CBr)CC2CC2C1 Amb24750090 [1,0,0,1,0,0|2,0,0]=4 1543 B12R2.5065 C=CCC1(CCl)CC2CC2C1 Amb28206762 [1,0,0,1,0,0|2,0,0]=4 1544 B12R2.5065 C=CCC1(CO)CC2CC2C1 Amb27944949 [1,0,0,1,0,0|2,0,0]=4 1545 B12R2.254 CC(=O)C1CCC12CCCC2 Amb29874091 [0,0,0,1,1,0|2,0,0]=4 1546 B12R2.254 O=C(O)C1CCC12CCCO2 Amb35752933 [0,0,0,1,1,0|2,0,0]=4 1547 B12R2.254 O=C(O)C1NCC12CCCC2 Amb28921048 [0,0,0,1,1,0|0,0,0]=2 1548 B12R2.254 O=C(O)C1NCC12CCCC2 Amb32667313 [0,0,0,1,1,0|0,0,0]=2 1549 B12R2.783 CC1NC(=O)CC12CCCC2 Amb25874225 [0,0,0,1,1,0|2,0,0]=4 1550 B12R2.783 O=C1CC2(CCCC2)C(=O)O1 Amb1157860 [0,0,0,1,1,0|1,0,1]=4 1551 B12R2.2043 CC1CC2(CN)CCCC2O1 Amb32660072 [0,0,0,1,1,0|1,0,1]=4 1552 B12R2.2043 O=C1CC2CCCC2(CO)C1 Amb28285020 [0,0,0,1,1,0|2,0,0]=4 1553 B12R2.2043 O=C1C[C@@H]2CCC[C@]2(CO)C1 Amb28285828 [0,0,0,1,1,0|2,0,0]=4 1554 B12R2.2043 O=C1N[C@@]2(CO)CCC[C@H]2O1 Amb27628377 [0,0,0,1,1,0|2,0,0]=4 1555 B12R2.2338 CC1C(C(=O)O)C12CCCC2 Amb24711506 [0,0,0,1,1,0|1,0,0]=3 1556 B12R2.2338 CC1C(C(N)=O)C12CCCC2 Amb28239698 [0,0,0,1,1,0|2,0,0]=4 1557 B12R2.3959 COC12CCCC1C2C(=O)O Amb28282832 [0,0,0,1,1,0|2,0,0]=4 1558 B12R2.4053 NCC12CCC(CC(=O)C1)O2 Amb2389227 [0,0,0,1,1,0|2,0,0]=4 1559 B12R2.5121 O=C1CC2(CCCC2)CCN1 Amb26926734 [0,0,0,1,1,0|2,0,0]=4 1560 B12R2.5121 O=C1CNCC2(CCCC2)N1 Amb27434470 [0,0,0,1,1,0|2,0,0]=4 1561 B12R2.5121 O=C1NC2(CCCC2)CCO1 Amb27454592 [0,0,0,1,1,0|2,0,0]=4 1562 B12R2.5121 OC1CNCC2(CCCC2)C1 Amb32675277 [0,0,0,1,1,0|1,0,1]=4 1563 B12R2.5121 OC1CNCC2(CCCC2)C1 Amb33330545 [0,0,0,1,1,0|1,0,1]=4 1564 B12R2.5590 O=S1(=O)CC2(CCCC2)CN1 Amb35789673 [0,0,0,1,1,0|1,0,1]=4 1565 B12R2.13 NC1CC(=O)C12CCCCC2 Amb26968470 [0,0,0,1,1,0|1,0,0]=3 1566 B12R2.13 NC1CC(O)C12CCCCC2 Amb33035205 [0,0,0,1,1,0|1,0,1]=4 1567 B12R2.2564 CN1C2CCC1(C(=O)O)CC2 Amb28056094 [0,0,0,1,1,0|2,0,0]=4 1568 B12R2.2597 CC(=O)[C@@]12CCCC[C@@H]1[C@H]2C Amb28253707 [0,0,0,1,1,0|2,0,0]=4 1569 B12R2.2597 O=C(O)[C@@]12CCCC[C@@H]1[C@H]2Br Amb32680303 [0,0,0,1,1,0|1,0,0]=3 1570 B12R2.3099 O=C(O)C12CCC(CCN1)C2 Amb33276109 [0,0,0,1,1,0|2,0,0]=4 1571 B12R2.3099 O=C(O)C12CCC(CNC1)C2 Amb19148428 [0,0,0,1,1,0|2,0,0]=4 1572 B12R2.3099 O=C(O)C12CCC(CNC1)C2 Amb33482821 [0,0,0,1,1,0|2,0,0]=4 1573 B12R2.3099 O=C(O)C12CCCC(C1)NC2 Amb20669449 [0,0,0,1,1,0|0,0,0]=2 1574 B12R2.3099 O=C(O)C12CCCC(C1)NC2 Amb26481232 [0,0,0,1,1,0|0,0,0]=2 1575 B12R2.3099 O=C(O)C12CCCC(C1)OC2 Amb33276646 [0,0,0,1,1,0|1,0,0]=3 1576 B12R2.3099 O=C(O)C12CCCC(CC1)C2 Amb18125740 [0,0,0,1,1,0|1,0,0]=3 1577 B12R2.3099 O=C(O)C12CCCC(CC1)N2 Amb3319354 [0,0,0,1,1,0|2,0,0]=4 1578 B12R2.3099 O=C(O)C12CCCC(CN1)C2 Amb19148175 [0,0,0,1,1,0|2,0,0]=4 1579 B12R2.3099 O=C(O)C12CCCC(CN1)C2 Amb2372533 [0,0,0,1,1,0|2,0,0]=4 1580 B12R2.3099 O=C(O)C12CCCC(CO1)C2 Amb33482777 [0,0,0,1,1,0|2,0,0]=4 1581 B12R2.3099 O=C(O)C12CCCN(CC1)C2 Amb24078299 [0,0,0,1,1,0|2,0,0]=4 1582 B12R2.3099 O=C(O)C12CCCN(CC1)C2 Amb28652966 [0,0,0,1,1,0|2,0,0]=4 1583 B12R2.3099 O=C(O)[C@@]12CCC[C@@H](CN1)C2 Amb2372649 [0,0,0,1,1,0|2,0,0]=4 1584 B12R2.3099 O=C(O)[C@]12CCC[C@H](CC1)C2 Amb27976700 [0,0,0,1,1,0|1,0,0]=3 1585 B12R2.3099 O=C(O)[C@]12CCC[C@H](CN1)C2 Amb19372883 [0,0,0,1,1,0|2,0,0]=4 1586 B12R2.3099 O=C(O)[C@]12CCC[C@H](CN1)C2 Amb2372050 [0,0,0,1,1,0|2,0,0]=4 1587 B12R2.4185 N#CC1(C(=O)O)CC2CC2C1 Amb33044345 [0,0,0,1,1,0|0,0,2]=4 1588 B12R2.6473 CC(=O)C12CCC(CC1)CC2 Amb25695687 [0,0,0,1,1,0|2,0,0]=4 1589 B12R2.6473 O=C(O)C12CCC(CC1)CC2 Amb10563722 [0,0,0,1,1,0|1,0,0]=3 1590 B12R2.6473 O=C(O)C12CCC(CC1)CN2 Amb24533190 [0,0,0,1,1,0|2,0,0]=4 1591 B12R2.6473 O=C(O)C12CCC(CC1)CN2 Amb33532206 [0,0,0,1,1,0|2,0,0]=4 1592 B12R2.6473 O=C(O)C12CCC(CC1)CO2 Amb25975545 [0,0,0,1,1,0|2,0,0]=4 1593 B12R2.6473 O=C(O)C12CCC(CC1)C[NH2+]2 Amb24112973 [0,0,0,1,1,0|2,0,0]=4 1594 B12R2.6473 O=C(O)C12CCC(CC1)NC2 Amb20669448 [0,0,0,1,1,0|0,0,0]=2 1595 B12R2.6473 O=C(O)C12CCC(CC1)NC2 Amb26866493 [0,0,0,1,1,0|0,0,0]=2 1596 B12R2.6473 O=C(O)C12CCC(CC1)OC2 Amb34138569 [0,0,0,1,1,0|1,0,0]=3 1597 B12R2.6473 O=C(O)C12CCN(CC1)CC2 Amb33544927 [0,0,0,1,1,0|2,0,0]=4 1598 B12R2.6473 O=C(O)C12CCN(CC1)CC2 Amb8010927 [0,0,0,1,1,0|2,0,0]=4 1599 B12R2.6473 O=C(O)C12CC[NH+](CC1)CC2 Amb21952933 [0,0,0,1,1,0|2,0,0]=4 1600 B12R2.6473 O=C(O)C12CC[NH+](CC1)CC2 Amb21952974 [0,0,0,1,1,0|2,0,0]=4 1601 B14R2.766 NC(=O)NC1CCC12CCCCC2 Amb28182913 [0,0,0,1,0,1|2,0,0]=4 1602 B14R2.766 O=C(Cl)NC1CCC12CCCCC2 Amb35619470 [0,0,0,1,0,1|2,0,0]=4 1603 B14R2.766 O=C(O)CC1CCC12CCCCC2 Amb35619428 [0,0,0,1,0,1|1,0,0]=3 1604 B14R2.766 O=C(O)\C=C1\CCC12CCCCC2 Amb30025872 [0,0,0,1,0,1|1,0,1]=4 1605 B14R2.8420 O=C1CCC2(CCCCC2)C(O)C1 Amb27662262 [0,0,0,1,0,1|2,0,0]=4 1606 B14R2.13810 O=C1CCC2(CO)CCCCC2C1 Amb27763815 [0,0,0,1,0,1|2,0,0]=4 1607 B14R2.13810 O=C1CC[C@@]2(CO)CCCC[C@H]2C1 Amb27639269 [0,0,0,1,0,1|2,0,0]=4 1608 B14R2.31228 CC(=O)N1CCC2(CCCCC2)C1 Amb26862170 [0,0,0,1,0,1|2,0,0]=4 1609 B14R2.31228 O=C(O)C1=NOC2(CCCCC2)C1 Amb23399755 [0,0,0,1,0,1|1,0,1]=4 1610 B14R2.31228 O=C(O)C1CC2(CCCCC2)CN1 Amb18129260 [0,0,0,1,0,1|0,0,0]=2 1611 B14R2.31228 O=C(O)C1CC2(CCCCC2)CN1 Amb29083456 [0,0,0,1,0,1|0,0,0]=2 1612 B14R2.31228 O=C(O)C1CC2(CCCCC2)CO1 Amb35788886 [0,0,0,1,0,1|1,0,0]=3 1613 B14R2.31228 O=C(O)C1CC2(CCNCC2)CN1 Amb27629924 [0,0,0,1,0,1|1,0,0]=3 1614 B14R2.31228 O=C(O)C1CC2(CCOCC2)CN1 Amb32724169 [0,0,0,1,0,1|1,0,0]=3 1615 B14R2.31228 O=C(O)C1CC2(CCOCC2)CN1 Amb32965545 [0,0,0,1,0,1|1,0,0]=3 1616 B14R2.31228 O=C(O)C1CC2(CCOCC2)CO1 Amb35749818 [0,0,0,1,0,1|2,0,0]=4 1617 B14R2.31228 O=C(O)C1CC2(CCSCC2)CN1 Amb35750407 [0,0,0,1,0,1|1,0,0]=3 1618 B14R2.31228 O=C(O)C1CC2(CCSCC2)CN1 Amb35750820 [0,0,0,1,0,1|1,0,0]=3 1619 B14R2.31228 O=C(O)C1CCC2(CCCCC2)N1 Amb18191945 [0,0,0,1,0,1|1,0,0]=3 1620 B14R2.31228 O=C(O)C1CCC2(CCOCC2)N1 Amb18822513 [0,0,0,1,0,1|2,0,0]=4 1621 B14R2.31228 O=C(O)C1CCC2(CCOCC2)O1 Amb25137389 [0,0,0,1,0,1|2,0,0]=4 1622 B14R2.31228 O=C(O)C1CCC2(CCSCC2)N1 Amb18177105 [0,0,0,1,0,1|2,0,0]=4 1623 B14R2.31228 O=C(O)C1CSC2(CCCCC2)N1 Amb1144970 [0,0,0,1,0,1|2,0,0]=4 1624 B14R2.31228 O=C(O)[C@@H]1COC2(CCCCC2)O1 Amb27965064 [0,0,0,1,0,1|2,0,0]=4 1625 B14R2.31228 O=C(O)[C@@H]1CSC2(CCCCC2)N1 Amb2717688 [0,0,0,1,0,1|2,0,0]=4 1626 B14R2.31228 O=C(O)[C@H]1CSC2(CCCCC2)N1 Amb583761 [0,0,0,1,0,1|2,0,0]=4 1627 B14R2.6138 CC1NC(=O)CC12CCCCCC2 Amb27800690 [0,0,0,1,0,1|2,0,0]=4 1628 B14R2.6138 CC1NC(=O)CC12CCCOCC2 Amb27177006 [0,0,0,1,0,1|2,0,0]=4 1629 B14R2.6138 CC1NC(=O)CC12CCCSCC2 Amb35610983 [0,0,0,1,0,1|2,0,0]=4 1630 B14R2.6138 O=C1CC2(CCCCCC2)C(=O)O1 Amb445480 [0,0,0,1,0,1|1,0,1]=4 1631 B14R2.6138 O=C1CC2(CCCSCC2)C(=O)O1 Amb35712535 [0,0,0,1,0,1|1,0,1]=4 1632 B14R2.14421 NCC1(CC(=O)O)CC2CCC2C1 Amb28458322 [0,0,0,1,0,1|0,0,0]=2 1633 B14R2.14421 NCC1(CC(=O)O)C[C@@H]2CC[C@H]2C1 Amb28247709 [0,0,0,1,0,1|0,0,0]=2 1634 B14R2.14480 NCC1(CC(=O)O)CC2CCCC21 Amb27601823 [0,0,0,1,0,1|0,0,0]=2 1635 B14R2.14480 NCC1(CC(=O)O)C[C@H]2CCC[C@H]21 Amb27972305 [0,0,0,1,0,1|0,0,0]=2 1636 B14R2.14480 NC[C@]1(CC(=O)O)C[C@H]2CCC[C@H]21 Amb28324059 [0,0,0,1,0,1|0,0,0]=2 1637 B14R2.16876 NCC1(CC(=O)O)CCC2CC2C1 Amb27233757 [0,0,0,1,0,1|0,0,0]=2 1638 B14R2.16876 NC[C@@]1(CC(=O)O)CC[C@@H]2C[C@@H]2C1 Amb27440488 [0,0,0,1,0,1|0,0,0]=2 1639 B14R2.16876 NC[C@@]1(CC(=O)O)CC[C@H]2C[C@@H]2C1 Amb27202808 [0,0,0,1,0,1|0,0,0]=2 1640 B14R2.16876 NC[C@@]1(CC(=O)O)CC[C@H]2C[C@H]2C1 Amb27620408 [0,0,0,1,0,1|0,0,0]=2 1641 B14R2.295 CC1CCCCC12CC(=O)NC2C Amb27177007 [0,1,0,1,0,0|2,0,0]=4 1642 B14R2.14446 C=C(C)CC1(CN)CC2CCC1C2 Amb27588252 [0,1,0,1,0,0|2,0,0]=4 1643 B14R2.14446 NCC1(CC(=O)O)CC2CCC1C2 Amb27864934 [0,1,0,1,0,0|0,0,0]=2 1644 B14R2.14446 NCC1(CC(=O)O)CC2CCC1C2 Amb31168217 [0,1,0,1,0,0|0,0,0]=2 1645 B14R2.20965 O=C1CCC[C@]2(CCCC[C@@H]2O)C1 Amb27184415 [0,1,0,1,0,0|2,0,0]=4 1646 B14R2.20965 O=C1CCC[C@]2(CCCC[C@H]2Cl)C1 Amb27852096 [0,1,0,1,0,0|2,0,0]=4 1647 B14R2.22489 O=C(O)CC12CCCCC1OC2=O Amb17594737 [0,1,0,1,0,0|1,0,1]=4 1648 B14R2.31681 CC(=O)NC12CCCCC1NCC2 Amb33230342 [0,1,0,1,0,0|2,0,0]=4 1649 B14R2.31681 O=C(O)CC12CCC=C1CCCC2 Amb28396600 [0,1,0,1,0,0|1,0,1]=4 1650 B14R2.974 CCC(=O)C1CCC12CCCCC2 Amb29874096 [0,1,0,1,0,0|2,0,0]=4 1651 B14R2.974 COC(=O)C1NCC12CCCCC2 Amb32669378 [0,1,0,1,0,0|0,0,0]=2 1652 B14R2.974 COC(=O)C1NCC12CCOCC2 Amb28921046 [0,1,0,1,0,0|1,0,0]=3 1653 B14R2.974 COC(=O)C1NCC12CCOCC2 Amb32668003 [0,1,0,1,0,0|1,0,0]=3 1654 B14R2.974 COC(C)C1NCC12CCCCC2 Amb27841566 [0,1,0,1,0,0|1,0,1]=4 1655 B14R2.8419 O=C1NCC2(CCCCC2)NC1=O Amb4032820 [0,1,0,1,0,0|1,0,1]=4 1656 B14R2.8419 O=C1NCC2(CCCCC2)OC1=O Amb27248366 [0,1,0,1,0,0|1,0,1]=4 1657 B14R2.13655 C=C1COC(O)C2(CCCCC2)C1 Amb27452412 [0,1,0,1,0,0|2,0,0]=4 1658 B14R2.13655 O=C1CC2(CCCCC2)C(O)CN1 Amb32993151 [0,1,0,1,0,0|2,0,0]=4 1659 B14R2.13655 O=C1CNC(=O)C2(CCCCC2)C1 Amb33329640 [0,1,0,1,0,0|1,0,1]=4 1660 B14R2.23919 O=C1CCCNC2(CCCCC2)C1 Amb27179213 [0,1,0,1,0,0|2,0,0]=4 1661 B14R2.29034 CC1CCC2(CC1)CC(=O)NC2C Amb25670102 [0,1,0,1,0,0|2,0,0]=4 1662 B14R2.62764 NC12CCC(CC(=O)O)(CC1)CC2 Amb24373850 [0,1,0,1,0,0|1,0,0]=3 1663 B14R2.62764 NC12CCC(CC(=O)O)(CC1)CC2 Amb30869774 [0,1,0,1,0,0|1,0,0]=3 1664 B14R2.31751 O=C(O)CC12CCCC(CCC1)C2 Amb27392231 [0,1,0,1,0,0|1,0,0]=3 1665 B14R2.31751 O=C(O)CC12CCCN(CCC1)C2 Amb32656870 [0,1,0,1,0,0|2,0,0]=4 1666 B14R2.43087 CC(=O)N1CC2CCCC1(CN)C2 Amb33097104 [0,1,0,1,0,0|2,0,0]=4 1667 B14R2.56293 CC1CCCC2(CC(=O)NC2C)C1 Amb27593067 [0,1,0,1,0,0|2,0,0]=4 1668 B14R2.55 CC(=O)C1CCCC12CCCCC2 Amb28313311 [0,1,0,1,0,0|2,0,0]=4 1669 B14R2.55 NC(=O)C1CNCC12CCOCC2 Amb24400057 [0,1,0,1,0,0|2,0,0]=4 1670 B14R2.55 O=C(O)C1CCCC12CCCCC2 Amb25374968 [0,1,0,1,0,0|1,0,0]=3 1671 B14R2.55 O=C(O)C1CCCC12CCNCC2 Amb32946743 [0,1,0,1,0,0|2,0,0]=4 1672 B14R2.55 O=C(O)C1CCCC12CCOCC2 Amb25853711 [0,1,0,1,0,0|2,0,0]=4 1673 B14R2.55 O=C(O)C1CCCC12CCSCC2 Amb32946744 [0,1,0,1,0,0|2,0,0]=4 1674 B14R2.55 O=C(O)C1CCNC12CCOCC2 Amb35750378 [0,1,0,1,0,0|2,0,0]=4 1675 B14R2.55 O=C(O)C1CCNC12CCOCC2 Amb35752361 [0,1,0,1,0,0|2,0,0]=4 1676 B14R2.55 O=C(O)C1CCOC12CCCCC2 Amb32990696 [0,1,0,1,0,0|1,0,0]=3 1677 B14R2.55 O=C(O)C1CCOC12CCCSC2 Amb32990720 [0,1,0,1,0,0|2,0,0]=4 1678 B14R2.55 O=C(O)C1CCOC12CCNCC2 Amb32990705 [0,1,0,1,0,0|2,0,0]=4 1679 B14R2.55 O=C(O)C1CCOC12CCOCC2 Amb32990715 [0,1,0,1,0,0|2,0,0]=4 1680 B14R2.55 O=C(O)C1CCOC12CCSCC2 Amb32990706 [0,1,0,1,0,0|2,0,0]=4 1681 B14R2.55 O=C(O)C1CNCC12CCCCC2 Amb23597880 [0,1,0,1,0,0|0,0,0]=2 1682 B14R2.55 O=C(O)C1CNCC12CCCCC2 Amb32835529 [0,1,0,1,0,0|0,0,0]=2 1683 B14R2.55 O=C(O)C1CNCC12CCCOC2 Amb25769848 [0,1,0,1,0,0|1,0,0]=3 1684 B14R2.55 O=C(O)C1CNCC12CCCSC2 Amb33468781 [0,1,0,1,0,0|1,0,0]=3 1685 B14R2.55 O=C(O)C1CNCC12CCNCC2 Amb33468767 [0,1,0,1,0,0|1,0,0]=3 1686 B14R2.55 O=C(O)C1CNCC12CCOCC2 Amb23597885 [0,1,0,1,0,0|1,0,0]=3 1687 B14R2.55 O=C(O)C1CNCC12CCSCC2 Amb33468768 [0,1,0,1,0,0|1,0,0]=3 1688 B14R2.55 O=C(O)N1CCOC12CCCCC2 Amb24089194 [0,1,0,1,0,0|2,0,0]=4 1689 B14R2.55 O=C(O)[C@@H]1CNCC12CCCCC2 Amb27179153 [0,1,0,1,0,0|0,0,0]=2 1690 B14R2.787 NC(=O)C1(N)CCC12CCCCC2 Amb35619217 [0,1,0,1,0,0|2,0,0]=4 1691 B14R2.787 NC(=O)C1(O)CCC12CCCCC2 Amb35619439 [0,1,0,1,0,0|2,0,0]=4 1692 B14R2.787 NC1(C(=O)O)CCC12CCCCC2 Amb35619212 [0,1,0,1,0,0|1,0,0]=3 1693 B14R2.787 O=C(O)C1(O)CCC12CCCCC2 Amb35619440 [0,1,0,1,0,0|1,0,0]=3 1694 B14R2.6119 CC1NC(=O)C(C)C12CCCCC2 Amb28346052 [0,1,0,1,0,0|2,0,0]=4 1695 B14R2.183 COC1C(C(=O)O)C12CCOCC2 Amb23538768 [0,1,0,1,0,0|2,0,0]=4 1696 B14R2.1018 NCC1OC(=O)CC12CCCCC2 Amb33097760 [0,1,0,1,0,0|0,0,0]=2 1697 B14R2.1018 NCC1OC(=O)CC12CCCNC2 Amb32993157 [0,1,0,1,0,0|1,0,0]=3 1698 B14R2.1018 NCC1OC(=O)CC12CCCOC2 Amb33276943 [0,1,0,1,0,0|1,0,0]=3 1699 B14R2.1018 NCC1OC(=O)CC12CCCSC2 Amb33276941 [0,1,0,1,0,0|1,0,0]=3 1700 B14R2.1018 NCC1OC(=O)CC12CCNCC2 Amb33097765 [0,1,0,1,0,0|1,0,0]=3 1701 B14R2.1018 NCC1OC(=O)CC12CCOCC2 Amb33097778 [0,1,0,1,0,0|1,0,0]=3 1702 B14R2.1018 NCC1OC(=O)CC12CCSCC2 Amb33276935 [0,1,0,1,0,0|1,0,0]=3 1703 B14R2.1018 O=C1CC2(CCCCC2)C(CI)O1 Amb33097702 [0,1,0,1,0,0|1,0,0]=3 1704 B14R2.1018 O=C1CC2(CCCOC2)C(CI)O1 Amb32648766 [0,1,0,1,0,0|2,0,0]=4 1705 B14R2.1018 O=C1CC2(CCCSC2)C(CI)O1 Amb33276710 [0,1,0,1,0,0|2,0,0]=4 1706 B14R2.1018 O=C1CC2(CCNCC2)C(CI)O1 Amb33097707 [0,1,0,1,0,0|2,0,0]=4 1707 B14R2.1018 O=C1CC2(CCOCC2)C(CI)O1 Amb33097717 [0,1,0,1,0,0|2,0,0]=4 1708 B14R2.1018 O=C1CC2(CCSCC2)C(CI)O1 Amb32648761 [0,1,0,1,0,0|2,0,0]=4 1709 B14R2.30027 CC1CC(=O)CC2(CCCCC2)N1 Amb27229971 [0,1,0,1,0,0|2,0,0]=4 1710 B14R2.30027 NC1=CC(=O)CC2(CCCCC2)C1 Amb24665833 [0,1,0,1,0,0|1,0,0]=3 1711 B14R2.30027 O=C1CC(=O)CC2(CCCCC2)C1 Amb428013 [0,1,0,1,0,0|2,0,0]=4 1712 B14R2.30027 O=C1CC2(CCCCC2)CC(=O)N1 Amb33534642 [0,1,0,1,0,0|2,0,0]=4 1713 B14R2.30027 O=C1CC2(CCCCC2)CC(=O)O1 Amb1153827 [0,1,0,1,0,0|1,0,0]=3 1714 B14R2.30027 O=C1CC2(CCOCC2)CC(=O)O1 Amb35752242 [0,1,0,1,0,0|2,0,0]=4 1715 B14R2.32487 O=CNC1(CC(=O)O)CCC2CC21 Amb33255152 [0,1,0,1,0,0|1,0,1]=4 1716 B14R2.32487 O=CNC1(CC(=O)O)CC[C@@H]2C[C@@H]21 Amb33255283 [0,1,0,1,0,0|1,0,1]=4 1717 B14R2.36635 O=C(O)CC1(C2CC2)CCCCC1 Amb33097680 [0,1,0,1,0,0|1,0,0]=3 1718 B14R2.36635 O=C(O)CC1(C2CC2)CCNCC1 Amb33097687 [0,1,0,1,0,0|2,0,0]=4 1719 B14R2.36635 O=C(O)CC1(C2CC2)CCOCC1 Amb33097690 [0,1,0,1,0,0|2,0,0]=4 1720 B14R2.9526 CC1(C)C(C(=O)O)C12CCNCC2 Amb28316730 [0,1,0,1,0,0|2,0,0]=4 1721 B14R2.31680 O=C(O)CC12CCCCC1C2(F)F Amb32666587 [0,1,0,1,0,0|1,0,0]=3 1722 B14R2.62762 CC1(C)C2CCC1(CC(=O)O)CC2 Amb27179341 [0,1,0,1,0,0|1,0,0]=3 1723 B14R3.695 O=C1CC2CCCCC23CCC13 Amb27176179 [0,0,0,2,0,0|2,0,0]=4 1724 B14R3.3853 O=C1CC[C@H]2[C@@H]1C23CCCCC3 Amb28351485 [0,0,0,2,0,0|2,0,0]=4 1725 B14R3.6748 CC1NC(=O)CC12CCC3CC32 Amb27787610 [0,0,0,2,0,0|2,0,0]=4 1726 B14R3.5009 O=C1COCC23CCCCC2C13 Amb27256609 [0,0,0,2,0,0|2,0,0]=4 1727 B10R0.86 CCCCCC(CC)C(=O)O Amb18791930 [0,0,1,0,1,0|1,0,0]=3 1728 B10R0.86 CCCCCC(OC)C(=O)O Amb32953478 [0,0,1,0,1,0|2,0,0]=4 1729 B10R0.86 CCCCSC(CC)C(=O)O Amb9675509 [0,0,1,0,1,0|2,0,0]=4 1730 B10R0.86 CCC\C=C\C(CN)C(=O)O Amb33224469 [0,0,1,0,1,0|0,0,2]=4 1731 B10R0.126 CCC(CC)(CCN)C(=O)O Amb32938544 [0,0,1,0,1,0|2,0,0]=4 1732 B10R0.126 CCSC(CC)(CC)C(=O)O Amb17504400 [0,0,1,0,1,0|2,0,0]=4 1733 B10R1.363 C=C(C)C1(C)CCCCC1 Amb27814605 [1,0,0,0,1,0|2,0,0]=4 1734 B10R1.363 C=C(C)C1(N)CCCCC1 Amb33201889 [1,0,0,0,1,0|2,0,0]=4 1735 B10R1.363 CC(=O)C1(C)CCCCC1 Amb25825155 [1,0,0,0,1,0|1,0,0]=3 1736 B10R1.363 CC(=O)C1(C)CCCCN1 Amb27173872 [1,0,0,0,1,0|2,0,0]=4 1737 B10R1.363 CC(=O)C1(C)CCCNC1 Amb24411216 [1,0,0,0,1,0|2,0,0]=4 1738 B10R1.363 CC(=O)C1(C)CCNCC1 Amb28073260 [1,0,0,0,1,0|2,0,0]=4 1739 B10R1.363 CC(=O)C1(C)CCOCC1 Amb23439817 [1,0,0,0,1,0|2,0,0]=4 1740 B10R1.363 CC(=O)C1(N)CCCCC1 Amb1091885 [1,0,0,0,1,0|1,0,0]=3 1741 B10R1.363 CC(=O)C1(N)CCCCC1 Amb22283957 [1,0,0,0,1,0|1,0,0]=3 1742 B10R1.363 CC(=O)C1(N)CCOCC1 Amb26381759 [1,0,0,0,1,0|2,0,0]=4 1743 B10R1.363 CC(=O)C1(O)CCCCC1 Amb4017468 [1,0,0,0,1,0|2,0,0]=4 1744 B10R1.363 CC(=O)C1(S)CCCCC1 Amb25130567 [1,0,0,0,1,0|2,0,0]=4 1745 B10R1.363 CC(O)C1(N)CCCCC1 Amb18202452 [1,0,0,0,1,0|1,0,1]=4 1746 B10R1.363 CC1(C(=N)N)CCCCC1 Amb26954796 [1,0,0,0,1,0|2,0,0]=4 1747 B10R1.363 CC1(C(=N)N)CCCCC1 Amb30584754 [1,0,0,0,1,0|2,0,0]=4 1748 B10R1.363 CC1(C(=O)Cl)CCCCC1 Amb3939513 [1,0,0,0,1,0|1,0,0]=3 1749 B10R1.363 CC1(C(=O)Cl)CCCCO1 Amb25047171 [1,0,0,0,1,0|2,0,0]=4 1750 B10R1.363 CC1(C(=O)O)C=CCCC1 Amb4021852 [1,0,0,0,1,0|0,0,2]=4 1751 B10R1.363 CC1(C(=O)O)CC=CCC1 Amb18643550 [1,0,0,0,1,0|0,0,2]=4 1752 B10R1.363 CC1(C(=O)O)CCCCC1 Amb2388313 [1,0,0,0,1,0|0,0,0]=2 1753 B10R1.363 CC1(C(=O)O)CCCCN1 Amb21959568 [1,0,0,0,1,0|1,0,0]=3 1754 B10R1.363 CC1(C(=O)O)CCCCN1 Amb2694988 [1,0,0,0,1,0|1,0,0]=3 1755 B10R1.363 CC1(C(=O)O)CCCCO1 Amb33542722 [1,0,0,0,1,0|1,0,0]=3 1756 B10R1.363 CC1(C(=O)O)CCCCS1 Amb28323348 [1,0,0,0,1,0|1,0,0]=3 1757 B10R1.363 CC1(C(=O)O)CCCNC1 Amb17622036 [1,0,0,0,1,0|1,0,0]=3 1758 B10R1.363 CC1(C(=O)O)CCCNC1 Amb19148847 [1,0,0,0,1,0|1,0,0]=3 1759 B10R1.363 CC1(C(=O)O)CCCOC1 Amb33532255 [1,0,0,0,1,0|1,0,0]=3 1760 B10R1.363 CC1(C(=O)O)CCNCC1 Amb15701613 [1,0,0,0,1,0|1,0,0]=3 1761 B10R1.363 CC1(C(=O)O)CCNCC1 Amb33549108 [1,0,0,0,1,0|1,0,0]=3 1762 B10R1.363 CC1(C(=O)O)CCOCC1 Amb10843981 [1,0,0,0,1,0|1,0,0]=3 1763 B10R1.363 CC1(C(=O)O)CCOCO1 Amb24648903 [1,0,0,0,1,0|2,0,0]=4 1764 B10R1.363 CC1(C(=O)O)CCSCC1 Amb10843982 [1,0,0,0,1,0|1,0,0]=3 1765 B10R1.363 CC1(C(=O)O)CNCCN1 Amb27830098 [1,0,0,0,1,0|2,0,0]=4 1766 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32656211 [1,0,0,0,1,0|2,0,0]=4 1767 B10R1.363 CC1(C(=O)O)CNCCO1 Amb32988610 [1,0,0,0,1,0|2,0,0]=4 1768 B10R1.363 CC1(C(=O)O)COCCN1 Amb26021643 [1,0,0,0,1,0|2,0,0]=4 1769 B10R1.363 CC1(C(=O)O)COCCN1 Amb31291275 [1,0,0,0,1,0|2,0,0]=4 1770 B10R1.363 CC1(C(=O)O)COCCO1 Amb26485107 [1,0,0,0,1,0|2,0,0]=4 1771 B10R1.363 CC1(C(=O)O)COCOC1 Amb6336131 [1,0,0,0,1,0|2,0,0]=4 1772 B10R1.363 CC1(C(N)=O)CCCCC1 Amb17674284 [1,0,0,0,1,0|1,0,0]=3 1773 B10R1.363 CC1(C(N)=O)CCCCN1 Amb26003815 [1,0,0,0,1,0|2,0,0]=4 1774 B10R1.363 CC1(C(N)=O)CCCCN1 Amb28896018 [1,0,0,0,1,0|2,0,0]=4 1775 B10R1.363 CC1(C(N)=O)CCCNC1 Amb19517052 [1,0,0,0,1,0|2,0,0]=4 1776 B10R1.363 CC1(C(N)=O)CCCNC1 Amb21960167 [1,0,0,0,1,0|2,0,0]=4 1777 B10R1.363 CC1(C(N)=O)CCNCC1 Amb19516982 [1,0,0,0,1,0|2,0,0]=4 1778 B10R1.363 CC1(C(N)=O)CCNCC1 Amb21960207 [1,0,0,0,1,0|2,0,0]=4 1779 B10R1.363 CC1(C(N)=O)CCOCC1 Amb26578642 [1,0,0,0,1,0|2,0,0]=4 1780 B10R1.363 CC1(C(N)=S)CCCCC1 Amb24400735 [1,0,0,0,1,0|1,1,0]=4 1781 B10R1.363 CC1([N+](=O)[O-])CCCCC1 Amb27230211 [1,0,0,0,1,0|1,0,1]=4 1782 B10R1.363 C[C@@H](O)C1(C)CCCCC1 Amb25042143 [1,0,0,0,1,0|1,0,1]=4 1783 B10R1.363 C[C@@]1(C(=O)O)C=CCCC1 Amb24505174 [1,0,0,0,1,0|0,0,2]=4 1784 B10R1.363 C[C@@]1(C(=O)O)CCCCN1 Amb22262937 [1,0,0,0,1,0|1,0,0]=3 1785 B10R1.363 C[C@@]1(C(=O)O)CCCNC1 Amb30594012 [1,0,0,0,1,0|1,0,0]=3 1786 B10R1.363 C[C@@]1(C(N)=O)CCCCN1 Amb27168600 [1,0,0,0,1,0|2,0,0]=4 1787 B10R1.363 C[C@H](O)C1(C)CCCCC1 Amb24415006 [1,0,0,0,1,0|1,0,1]=4 1788 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb22262934 [1,0,0,0,1,0|1,0,0]=3 1789 B10R1.363 C[C@]1(C(=O)O)CCCCN1 Amb33715562 [1,0,0,0,1,0|1,0,0]=3 1790 B10R1.363 C[C@]1(C(=O)O)CCCCO1 Amb24659158 [1,0,0,0,1,0|1,0,0]=3 1791 B10R1.363 C[C@]1(C(=O)O)COCCN1 Amb27857000 [1,0,0,0,1,0|2,0,0]=4 1792 B10R1.363 C[C@]1(C(N)=O)CCCCN1 Amb25147419 [1,0,0,0,1,0|2,0,0]=4 1793 B10R1.363 N=C(N)C1(N)CCCCC1 Amb27196371 [1,0,0,0,1,0|2,0,0]=4 1794 B10R1.363 NC(=O)C1(Br)CCCCC1 Amb27849949 [1,0,0,0,1,0|2,0,0]=4 1795 B10R1.363 NC(=O)C1(N)CCCCC1 Amb6259495 [1,0,0,0,1,0|1,0,0]=3 1796 B10R1.363 NC(=O)C1(N)CCCCC1 Amb9178008 [1,0,0,0,1,0|1,0,0]=3 1797 B10R1.363 NC(=O)C1(N)CCCNC1 Amb26038224 [1,0,0,0,1,0|2,0,0]=4 1798 B10R1.363 NC(=O)C1(N)CCCNC1 Amb33328788 [1,0,0,0,1,0|2,0,0]=4 1799 B10R1.363 NC(=O)C1(N)CCCOC1 Amb22059476 [1,0,0,0,1,0|2,0,0]=4 1800 B10R1.363 NC(=O)C1(N)CCCOC1 Amb32693416 [1,0,0,0,1,0|2,0,0]=4 1801 B10R1.363 NC(=O)C1(N)CCNCC1 Amb18278418 [1,0,0,0,1,0|2,0,0]=4 1802 B10R1.363 NC(=O)C1(N)CCNCC1 Amb33483967 [1,0,0,0,1,0|2,0,0]=4 1803 B10R1.363 NC(=O)C1(N)CCOCC1 Amb18278286 [1,0,0,0,1,0|2,0,0]=4 1804 B10R1.363 NC(=O)C1(N)CCOCC1 Amb32667049 [1,0,0,0,1,0|2,0,0]=4 1805 B10R1.363 NC(=O)C1(N)CCSCC1 Amb18278809 [1,0,0,0,1,0|2,0,0]=4 1806 B10R1.363 NC(=O)C1(O)CCCCC1 Amb24116820 [1,0,0,0,1,0|2,0,0]=4 1807 B10R1.363 NC(=S)C1(N)CCCCC1 Amb27389992 [1,0,0,0,1,0|1,1,0]=4 1808 B10R1.363 NC1(C(=O)O)CC=CCC1 Amb27816089 [1,0,0,0,1,0|0,0,2]=4 1809 B10R1.363 NC1(C(=O)O)CCCCC1 Amb1153058 [1,0,0,0,1,0|0,0,0]=2 1810 B10R1.363 NC1(C(=O)O)CCCCC1 Amb2720183 [1,0,0,0,1,0|0,0,0]=2 1811 B10R1.363 NC1(C(=O)O)CCCNC1 Amb20242317 [1,0,0,0,1,0|1,0,0]=3 1812 B10R1.363 NC1(C(=O)O)CCCNC1 Amb22756826 [1,0,0,0,1,0|1,0,0]=3 1813 B10R1.363 NC1(C(=O)O)CCCNC1 Amb28555533 [1,0,0,0,1,0|1,0,0]=3 1814 B10R1.363 NC1(C(=O)O)CCCOC1 Amb19958927 [1,0,0,0,1,0|1,0,0]=3 1815 B10R1.363 NC1(C(=O)O)CCCOC1 Amb22270206 [1,0,0,0,1,0|1,0,0]=3 1816 B10R1.363 NC1(C(=O)O)CCCSC1 Amb18948549 [1,0,0,0,1,0|1,0,0]=3 1817 B10R1.363 NC1(C(=O)O)CCNCC1 Amb16230706 [1,0,0,0,1,0|1,0,0]=3 1818 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2695575 [1,0,0,0,1,0|1,0,0]=3 1819 B10R1.363 NC1(C(=O)O)CCNCC1 Amb2698793 [1,0,0,0,1,0|1,0,0]=3 1820 B10R1.363 NC1(C(=O)O)CCNCC1 Amb33549791 [1,0,0,0,1,0|1,0,0]=3 1821 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699136 [1,0,0,0,1,0|1,0,0]=3 1822 B10R1.363 NC1(C(=O)O)CCOCC1 Amb2699208 [1,0,0,0,1,0|1,0,0]=3 1823 B10R1.363 NC1(C(=O)O)CCSCC1 Amb17943831 [1,0,0,0,1,0|1,0,0]=3 1824 B10R1.363 NC1(P(O)O)CCCCC1 Amb27394628 [1,0,0,0,1,0|1,0,1]=4 1825 B10R1.363 O=C(Cl)C1(Cl)CCCCC1 Amb8427958 [1,0,0,0,1,0|2,0,0]=4 1826 B10R1.363 O=C(O)C1(Br)CCCCC1 Amb18130989 [1,0,0,0,1,0|1,0,0]=3 1827 B10R1.363 O=C(O)C1(Br)CCOCC1 Amb25828678 [1,0,0,0,1,0|2,0,0]=4 1828 B10R1.363 O=C(O)C1(Cl)CCCCC1 Amb8427953 [1,0,0,0,1,0|1,0,0]=3 1829 B10R1.363 O=C(O)C1(Cl)CCCOC1 Amb33127968 [1,0,0,0,1,0|2,0,0]=4 1830 B10R1.363 O=C(O)C1(Cl)CCOCC1 Amb18646184 [1,0,0,0,1,0|2,0,0]=4 1831 B10R1.363 O=C(O)C1(Cl)CCSCC1 Amb33127953 [1,0,0,0,1,0|2,0,0]=4 1832 B10R1.363 O=C(O)C1(F)CCCCC1 Amb10603425 [1,0,0,0,1,0|1,0,0]=3 1833 B10R1.363 O=C(O)C1(F)CCCNC1 Amb24062229 [1,0,0,0,1,0|2,0,0]=4 1834 B10R1.363 O=C(O)C1(F)CCCOC1 Amb25178890 [1,0,0,0,1,0|2,0,0]=4 1835 B10R1.363 O=C(O)C1(F)CCCSC1 Amb27441996 [1,0,0,0,1,0|2,0,0]=4 1836 B10R1.363 O=C(O)C1(F)CCNCC1 Amb17739849 [1,0,0,0,1,0|2,0,0]=4 1837 B10R1.363 O=C(O)C1(F)CCNCC1 Amb19374711 [1,0,0,0,1,0|2,0,0]=4 1838 B10R1.363 O=C(O)C1(F)CCOCC1 Amb16233480 [1,0,0,0,1,0|2,0,0]=4 1839 B10R1.363 O=C(O)C1(O)CCCCC1 Amb1159102 [1,0,0,0,1,0|1,0,0]=3 1840 B10R1.363 O=C(O)C1(O)CCCNC1 Amb18202374 [1,0,0,0,1,0|2,0,0]=4 1841 B10R1.363 O=C(O)C1(O)CCCNC1 Amb32671229 [1,0,0,0,1,0|2,0,0]=4 1842 B10R1.363 O=C(O)C1(O)CCNCC1 Amb10552861 [1,0,0,0,1,0|2,0,0]=4 1843 B10R1.363 O=C(O)C1(O)CCNCC1 Amb21961528 [1,0,0,0,1,0|2,0,0]=4 1844 B10R1.363 O=C(O)C1(O)CCOCC1 Amb18944710 [1,0,0,0,1,0|2,0,0]=4 1845 B10R1.363 O=C(O)C1(O)CCSCC1 Amb18945166 [1,0,0,0,1,0|2,0,0]=4 1846 B10R1.363 O=C(O)[C@@]1(F)CCCNC1 Amb24502317 [1,0,0,0,1,0|2,0,0]=4 1847 B10R1.363 [NH3+]C1(C(=O)O)CCCCC1 Amb4239236 [1,0,0,0,1,0|0,0,1]=3 1848 B10R1.370 C=C(C)CC1(N)CCCC1 Amb35634488 [1,0,0,0,1,0|2,0,0]=4 1849 B10R1.370 CC(=O)CC1(N)CCCC1 Amb27788263 [1,0,0,0,1,0|1,0,0]=3 1850 B10R1.370 CC(=O)CC1(O)CCCC1 Amb26479628 [1,0,0,0,1,0|2,0,0]=4 1851 B10R1.370 CC(O)CC1(N)CCCC1 Amb29883644 [1,0,0,0,1,0|1,0,1]=4 1852 B10R1.370 CC1(CC(=O)O)CCCC1 Amb33544780 [1,0,0,0,1,0|0,0,0]=2 1853 B10R1.370 CC1(CC(=O)O)CCCO1 Amb33620695 [1,0,0,0,1,0|1,0,0]=3 1854 B10R1.370 CC1(CC(=O)O)CCCS1 Amb28239513 [1,0,0,0,1,0|1,0,0]=3 1855 B10R1.370 CC1(CC(=O)O)CCOC1 Amb28193907 [1,0,0,0,1,0|1,0,0]=3 1856 B10R1.370 CC1(CC(=O)O)OCCO1 Amb3620870 [1,0,0,0,1,0|2,0,0]=4 1857 B10R1.370 CC1(CC(=O)O)OCCS1 Amb27965057 [1,0,0,0,1,0|2,0,0]=4 1858 B10R1.370 CC1(NC(=O)Cl)CCCC1 Amb35625784 [1,0,0,0,1,0|2,0,0]=4 1859 B10R1.370 CC1(OC(N)=O)CCCC1 Amb28367830 [1,0,0,0,1,0|2,0,0]=4 1860 B10R1.370 NC(=O)CC1(N)CCCC1 Amb27488719 [1,0,0,0,1,0|1,0,0]=3 1861 B10R1.370 NC(=O)CC1(N)CCNC1 Amb33254814 [1,0,0,0,1,0|2,0,0]=4 1862 B10R1.370 NC(=O)CC1(N)CCOC1 Amb33254358 [1,0,0,0,1,0|2,0,0]=4 1863 B10R1.370 NC(=O)CC1(N)CCSC1 Amb33254333 [1,0,0,0,1,0|2,0,0]=4 1864 B10R1.370 NC(=O)CC1(O)CCCC1 Amb28316033 [1,0,0,0,1,0|2,0,0]=4 1865 B10R1.370 NC1(CC(=O)O)C=CCC1 Amb33036359 [1,0,0,0,1,0|0,0,2]=4 1866 B10R1.370 NC1(CC(=O)O)CCCC1 Amb22295785 [1,0,0,0,1,0|0,0,0]=2 1867 B10R1.370 NC1(CC(=O)O)CCCC1 Amb22337063 [1,0,0,0,1,0|0,0,0]=2 1868 B10R1.370 NC1(CC(=O)O)CCNC1 Amb26460077 [1,0,0,0,1,0|1,0,0]=3 1869 B10R1.370 NC1(CC(=O)O)CCOC1 Amb22059549 [1,0,0,0,1,0|1,0,0]=3 1870 B10R1.370 NC1(CC(=O)O)CCOC1 Amb32693448 [1,0,0,0,1,0|1,0,0]=3 1871 B10R1.370 NC1(CC(=O)O)CCSC1 Amb23515102 [1,0,0,0,1,0|1,0,0]=3 1872 B10R1.370 NC1(CC(=O)O)CCSC1 Amb28555637 [1,0,0,0,1,0|1,0,0]=3 1873 B10R1.370 O=C(O)CC1(F)CCNC1 Amb28070974 [1,0,0,0,1,0|2,0,0]=4 1874 B10R1.370 O=C(O)CC1(O)CCCC1 Amb18285919 [1,0,0,0,1,0|1,0,0]=3 1875 B10R1.370 O=C(O)CC1(O)CCNC1 Amb25135404 [1,0,0,0,1,0|2,0,0]=4 1876 B10R1.370 O=C(O)CC1(O)CCOC1 Amb32672194 [1,0,0,0,1,0|2,0,0]=4 1877 B10R1.370 O=C(O)CC1(O)CCSC1 Amb18961446 [1,0,0,0,1,0|2,0,0]=4 1878 B10R1.529 C#CCC1(CN)CCCC1 Amb27799485 [1,0,0,0,1,0|1,0,1]=4 1879 B10R1.529 C=CCC1(CBr)CCCC1 Amb27488625 [1,0,0,0,1,0|2,0,0]=4 1880 B10R1.529 C=CCC1(CCl)CCCC1 Amb27944944 [1,0,0,0,1,0|2,0,0]=4 1881 B10R1.529 C=CCC1(CN)CCCC1 Amb26364076 [1,0,0,0,1,0|1,0,0]=3 1882 B10R1.529 C=CCC1(CN)CCCS1 Amb27650605 [1,0,0,0,1,0|2,0,0]=4 1883 B10R1.529 C=CCC1(CO)CCCC1 Amb27753052 [1,0,0,0,1,0|2,0,0]=4 1884 B10R1.529 CCCC1(CN)CCCC1 Amb18299780 [1,0,0,0,1,0|1,0,1]=4 1885 B10R1.529 CNCC1(CN)CCCC1 Amb28461657 [1,0,0,0,1,0|2,0,0]=4 1886 B10R1.529 COC1(CC=O)CCCC1 Amb28049849 [1,0,0,0,1,0|2,0,0]=4 1887 B10R1.529 COCC1(CN)CCCC1 Amb10608036 [1,0,0,0,1,0|2,0,0]=4 1888 B10R1.529 COCC1(CN)CCCC1 Amb21959644 [1,0,0,0,1,0|2,0,0]=4 1889 B10R1.529 CSCC1(CN)CCCC1 Amb33272943 [1,0,0,0,1,0|2,0,0]=4 1890 B10R1.529 N#CC1(CC=O)CCCC1 Amb32938531 [1,0,0,0,1,0|0,0,2]=4 1891 B10R1.529 NCC1(CCF)CCCC1 Amb27257813 [1,0,0,0,1,0|1,0,1]=4 1892 B10R1.529 NCC1(CCO)CCCC1 Amb19149333 [1,0,0,0,1,0|0,0,1]=3 1893 B10R1.529 NCC1(CCO)CCCS1 Amb27823238 [1,0,0,0,1,0|1,0,1]=4 1894 B10R1.529 NCC1(CCO)CCOC1 Amb20668771 [1,0,0,0,1,0|1,0,1]=4 1895 B10R1.529 NCCC1(CN)CCCC1 Amb23452573 [1,0,0,0,1,0|1,0,1]=4 1896 B10R1.227 C=CC1(CC(=O)O)CCC1 Amb27425012 [0,0,0,0,2,0|1,0,1]=4 1897 B10R1.227 CC(=O)CC1(CN)CCC1 Amb28050360 [0,0,0,0,2,0|1,0,0]=3 1898 B10R1.227 CC(=O)CC1(CN)CCC1 Amb33447089 [0,0,0,0,2,0|1,0,0]=3 1899 B10R1.227 CCC1(CC(=O)O)CCC1 Amb22735900 [0,0,0,0,2,0|1,0,0]=3 1900 B10R1.227 CCC1(CC(=O)O)COC1 Amb24743907 [0,0,0,0,2,0|2,0,0]=4 1901 B10R1.227 CCC1(CC(C)=O)CCC1 Amb25081870 [0,0,0,0,2,0|2,0,0]=4 1902 B10R1.227 CNC1(CC(=O)O)CCC1 Amb28315800 [0,0,0,0,2,0|2,0,0]=4 1903 B10R1.227 COC1(CC(=O)O)CCC1 Amb22886504 [0,0,0,0,2,0|2,0,0]=4 1904 B10R1.227 CSC1(CC(=O)O)CCC1 Amb27850081 [0,0,0,0,2,0|2,0,0]=4 1905 B10R1.227 N#CC1(CC(=O)O)CCC1 Amb28072907 [0,0,0,0,2,0|0,0,2]=4 1906 B10R1.227 NCC1(CC(=O)O)CCC1 Amb20669491 [0,0,0,0,2,0|0,0,0]=2 1907 B10R1.227 NCC1(CC(=O)O)CCC1 Amb22059709 [0,0,0,0,2,0|0,0,0]=2 1908 B10R1.227 NCC1(CC(=O)O)COC1 Amb20671383 [0,0,0,0,2,0|1,0,0]=3 1909 B10R1.227 NCC1(CC(=O)O)CSC1 Amb27640389 [0,0,0,0,2,0|1,0,0]=3 1910 B10R1.227 NOC1(CC(=O)O)CCC1 Amb27465095 [0,0,0,0,2,0|1,0,0]=3 1911 B10R1.227 NOC1(CC(=O)O)CNC1 Amb27443275 [0,0,0,0,2,0|2,0,0]=4 1912 B10R1.227 NOC1(CC(=O)O)CNC1 Amb32684921 [0,0,0,0,2,0|2,0,0]=4 1913 B10R1.227 NOC1(CC(=O)O)COC1 Amb33072037 [0,0,0,0,2,0|2,0,0]=4 1914 B10R1.227 O=C(O)CC1(CF)CCC1 Amb33376920 [0,0,0,0,2,0|1,0,0]=3 1915 B10R1.227 O=C(O)CC1(CO)CCC1 Amb26414950 [0,0,0,0,2,0|1,0,0]=3 1916 B10R1.227 O=C([O-])CC1(CO)CCC1 Amb31217645 [0,0,0,0,2,0|1,0,1]=4 1917 B10R1.477 C#CC1(C(=O)O)CCCC1 Amb26515640 [0,0,0,0,2,0|1,0,1]=4 1918 B10R1.477 C=C(C)C1(CN)CCCC1 Amb33199962 [0,0,0,0,2,0|2,0,0]=4 1919 B10R1.477 C=CC1(C(=O)O)CCCC1 Amb27955011 [0,0,0,0,2,0|1,0,1]=4 1920 B10R1.477 CC(=O)C1(CN)CCCC1 Amb33447092 [0,0,0,0,2,0|1,0,0]=3 1921 B10R1.477 CC(O)C1(CN)CCCC1 Amb25213912 [0,0,0,0,2,0|1,0,1]=4 1922 B10R1.477 CCC1(C(=O)O)CCCC1 Amb33531419 [0,0,0,0,2,0|1,0,0]=3 1923 B10R1.477 CCC1(C(=O)O)CCCN1 Amb15701408 [0,0,0,0,2,0|2,0,0]=4 1924 B10R1.477 CCC1(C(=O)O)CCCN1 Amb21959768 [0,0,0,0,2,0|2,0,0]=4 1925 B10R1.477 CCC1(C(=O)O)CCCO1 Amb24455991 [0,0,0,0,2,0|2,0,0]=4 1926 B10R1.477 CCC1(C(=O)O)CCNC1 Amb22059208 [0,0,0,0,2,0|2,0,0]=4 1927 B10R1.477 CCC1(C(=O)O)CCNC1 Amb32658029 [0,0,0,0,2,0|2,0,0]=4 1928 B10R1.477 CCC1(C(=O)O)CCOC1 Amb18964298 [0,0,0,0,2,0|2,0,0]=4 1929 B10R1.477 CCC1(C(C)=O)CCCC1 Amb27389662 [0,0,0,0,2,0|2,0,0]=4 1930 B10R1.477 CCC1(C(N)=O)CCCC1 Amb27948170 [0,0,0,0,2,0|2,0,0]=4 1931 B10R1.477 CC[C@@]1(C(=O)O)CCCN1 Amb27617134 [0,0,0,0,2,0|2,0,0]=4 1932 B10R1.477 CC[C@@]1(C(=O)O)CCNC1 Amb27633957 [0,0,0,0,2,0|2,0,0]=4 1933 B10R1.477 CC[C@]1(C(=O)O)CCCN1 Amb24625134 [0,0,0,0,2,0|2,0,0]=4 1934 B10R1.477 CC[C@]1(C(=O)O)CCCN1 Amb32405295 [0,0,0,0,2,0|2,0,0]=4 1935 B10R1.477 CNC1(C(=O)O)CCCC1 Amb22587341 [0,0,0,0,2,0|2,0,0]=4 1936 B10R1.477 CNC1(C(=O)O)CCCC1 Amb9619694 [0,0,0,0,2,0|2,0,0]=4 1937 B10R1.477 COC1(C(=O)O)CCCC1 Amb33538130 [0,0,0,0,2,0|2,0,0]=4 1938 B10R1.477 CSC1(C(=O)O)CCCC1 Amb18953834 [0,0,0,0,2,0|2,0,0]=4 1939 B10R1.477 N#CC1(C(=O)O)CCCC1 Amb445430 [0,0,0,0,2,0|0,0,2]=4 1940 B10R1.477 NCC1(C(=O)O)CC=CC1 Amb26996046 [0,0,0,0,2,0|0,0,2]=4 1941 B10R1.477 NCC1(C(=O)O)CCCC1 Amb21955748 [0,0,0,0,2,0|0,0,0]=2 1942 B10R1.477 NCC1(C(=O)O)CCCC1 Amb9902139 [0,0,0,0,2,0|0,0,0]=2 1943 B10R1.477 NCC1(C(=O)O)CCOC1 Amb25839450 [0,0,0,0,2,0|1,0,0]=3 1944 B10R1.477 NCC1(C(N)=O)CCCC1 Amb18957372 [0,0,0,0,2,0|1,0,0]=3 1945 B10R1.477 NCC1(C(N)=O)CCOC1 Amb27238499 [0,0,0,0,2,0|2,0,0]=4 1946 B10R1.477 NCC1(C(N)=O)CCSC1 Amb27612995 [0,0,0,0,2,0|2,0,0]=4 1947 B10R1.477 NOC1(C(=O)O)CCCC1 Amb32660231 [0,0,0,0,2,0|1,0,0]=3 1948 B10R1.477 O=C(O)C1(CBr)CCCC1 Amb27857310 [0,0,0,0,2,0|1,0,0]=3 1949 B10R1.477 O=C(O)C1(CF)CCCC1 Amb27623733 [0,0,0,0,2,0|1,0,0]=3 1950 B10R1.477 O=C(O)C1(CO)CCCC1 Amb17399884 [0,0,0,0,2,0|1,0,0]=3 1951 B10R1.477 O=C(O)C1(CO)CCCN1 Amb28367641 [0,0,0,0,2,0|2,0,0]=4 1952 B10R1.477 O=C(O)C1(CO)CCCO1 Amb24453901 [0,0,0,0,2,0|2,0,0]=4 1953 B10R1.477 O=C(O)C1(CO)CCNC1 Amb26328041 [0,0,0,0,2,0|2,0,0]=4 1954 B10R1.477 O=C(O)C1(CO)CCNC1 Amb33743454 [0,0,0,0,2,0|2,0,0]=4 1955 B10R1.477 O=C(O)C1(CO)CCOC1 Amb26961454 [0,0,0,0,2,0|2,0,0]=4 1956 B10R1.477 O=C(O)C1(CO)CCSC1 Amb32946220 [0,0,0,0,2,0|2,0,0]=4 1957 B10R1.477 O=C(O)C1(CS)CCCC1 Amb28042748 [0,0,0,0,2,0|1,0,0]=3 1958 B12R0.359 CC(CN)(CCC(=O)O)OCCO Amb33068827 [0,0,1,0,0,1|2,0,0]=4 1959 B12R1.3110 C=C(C)CCC1(N)CCCCC1 Amb35649476 [1,0,0,0,0,1|2,0,0]=4 1960 B12R1.3110 CC(=O)CCC1(C)CCCCC1 Amb28381165 [1,0,0,0,0,1|1,0,0]=3 1961 B12R1.3110 CC(=O)CCC1(C)CCOCC1 Amb33415596 [1,0,0,0,0,1|2,0,0]=4 1962 B12R1.3110 CC(=O)CCC1(O)CCCCC1 Amb27495367 [1,0,0,0,0,1|2,0,0]=4 1963 B12R1.3110 CC(=O)NCC1(C)CCCCC1 Amb28056742 [1,0,0,0,0,1|1,0,0]=3 1964 B12R1.3110 CC(=O)NCC1(C)CCCNC1 Amb28048723 [1,0,0,0,0,1|2,0,0]=4 1965 B12R1.3110 CC(=O)NCC1(C)CCNCC1 Amb28315123 [1,0,0,0,0,1|2,0,0]=4 1966 B12R1.3110 CC(=O)NCC1(C)CCOCC1 Amb27618222 [1,0,0,0,0,1|2,0,0]=4 1967 B12R1.3110 CC(=O)NCC1(F)CCCCC1 Amb27661965 [1,0,0,0,0,1|2,0,0]=4 1968 B12R1.3110 CC(=O)NCC1(N)CCCCC1 Amb28990857 [1,0,0,0,0,1|1,0,0]=3 1969 B12R1.3110 CC(=O)NCC1(N)CCOCC1 Amb29854523 [1,0,0,0,0,1|2,0,0]=4 1970 B12R1.3110 CC(=O)OCC1(C)CCCCC1 Amb27867457 [1,0,0,0,0,1|1,0,0]=3 1971 B12R1.3110 CC(=O)OCC1(C)CCOCC1 Amb27661967 [1,0,0,0,0,1|2,0,0]=4 1972 B12R1.3110 CC(=O)\C=C\C1(C)CCCCC1 Amb33417933 [1,0,0,0,0,1|1,0,1]=4 1973 B12R1.3110 CC(C)=CCC1(N)CCCCC1 Amb30029632 [1,0,0,0,0,1|2,0,0]=4 1974 B12R1.3110 CC(O)CCC1(C)CCCCC1 Amb27444395 [1,0,0,0,0,1|1,0,1]=4 1975 B12R1.3110 CC(O)CCC1(N)CCCCC1 Amb35643082 [1,0,0,0,0,1|1,0,1]=4 1976 B12R1.3110 CC1(CCC(=O)O)CCCCC1 Amb24365922 [1,0,0,0,0,1|0,0,0]=2 1977 B12R1.3110 CC1(CCC(=O)O)CCOCC1 Amb33416866 [1,0,0,0,0,1|1,0,0]=3 1978 B12R1.3110 CC1(CCC(=O)O)OCCCO1 Amb17334969 [1,0,0,0,0,1|2,0,0]=4 1979 B12R1.3110 CC1(CCC(=O)O)SCCCS1 Amb27592894 [1,0,0,0,0,1|2,0,0]=4 1980 B12R1.3110 CC1(CC[N+](=O)[O-])CCCCC1 Amb33226718 [1,0,0,0,0,1|1,0,1]=4 1981 B12R1.3110 CC1(CNC(=N)N)CCCCC1 Amb27647775 [1,0,0,0,0,1|2,0,0]=4 1982 B12R1.3110 CC1(CNC(=O)Cl)CCCCC1 Amb35633528 [1,0,0,0,0,1|1,0,0]=3 1983 B12R1.3110 CC1(CNC(=O)Cl)CCOCC1 Amb35625929 [1,0,0,0,0,1|2,0,0]=4 1984 B12R1.3110 CC1(CNC(N)=O)CCCNC1 Amb27242710 [1,0,0,0,0,1|2,0,0]=4 1985 B12R1.3110 CC1(NCC(=O)O)CCCOC1 Amb27477449 [1,0,0,0,0,1|1,0,0]=3 1986 B12R1.3110 CC1(NCC(=O)O)CCOCC1 Amb27207957 [1,0,0,0,0,1|1,0,0]=3 1987 B12R1.3110 CC1(NCC(N)=O)CCCOC1 Amb27477443 [1,0,0,0,0,1|2,0,0]=4 1988 B12R1.3110 CC1(OCC(=O)O)CCOCC1 Amb33042674 [1,0,0,0,0,1|1,0,0]=3 1989 B12R1.3110 CC1(OCC(N)=O)CCNCC1 Amb27442403 [1,0,0,0,0,1|2,0,0]=4 1990 B12R1.3110 CC1(\C=C\C(=O)O)CCCCC1 Amb33358910 [1,0,0,0,0,1|0,0,1]=3 1991 B12R1.3110 CC1(\C=C\C(=O)O)CCOCC1 Amb27983653 [1,0,0,0,0,1|1,0,1]=4 1992 B12R1.3110 CC1(\C=C\C(N)=O)CCCCC1 Amb24402966 [1,0,0,0,0,1|1,0,1]=4 1993 B12R1.3110 C[C@@H](O)CCC1(C)CCCCC1 Amb33417985 [1,0,0,0,0,1|1,0,1]=4 1994 B12R1.3110 C[C@H](O)CCC1(C)CCCCC1 Amb33417986 [1,0,0,0,0,1|1,0,1]=4 1995 B12R1.3110 NC(=O)NCC1(N)CCCCC1 Amb18952985 [1,0,0,0,0,1|1,0,0]=3 1996 B12R1.3110 NC(=O)NCC1(N)CCOCC1 Amb35712505 [1,0,0,0,0,1|2,0,0]=4 1997 B12R1.3110 NC1(CC=C(Cl)Cl)CCCCC1 Amb29886417 [1,0,0,0,0,1|2,0,0]=4 1998 B12R1.3110 NC1(CCC(=O)O)CCCCC1 Amb18198525 [1,0,0,0,0,1|0,0,0]=2 1999 B12R1.3110 NC1(CCC(=O)O)CCCCC1 Amb30584951 [1,0,0,0,0,1|0,0,0]=2 2000 B12R1.3110 NC1(CCC(=O)O)CCNCC1 Amb28201335 [1,0,0,0,0,1|1,0,0]=3 2001 B12R1.3110 NC1(CCC(=O)O)CCOCC1 Amb18825300 [1,0,0,0,0,1|1,0,0]=3 2002 B12R1.3110 NC1(CCC(=O)O)CCOCC1 Amb31157035 [1,0,0,0,0,1|1,0,0]=3 2003 B12R1.3110 O=C(O)C#CC1(O)CCCCC1 Amb1085906 [1,0,0,0,0,1|1,0,1]=4 2004 B12R1.3236 C=CCC1(CN)CCCCCC1 Amb28119149 [1,0,0,0,0,1|1,0,0]=3 2005 B12R1.3236 CNCC1(CN)CCCCCC1 Amb27754385 [1,0,0,0,0,1|2,0,0]=4 2006 B12R1.3236 COC1(CC=O)CCCCCC1 Amb24690805 [1,0,0,0,0,1|2,0,0]=4 2007 B12R1.3236 NCC1(CCO)CCCOCC1 Amb27808778 [1,0,0,0,0,1|0,0,1]=3 2008 B12R1.3236 NCC1(CCO)CCCSCC1 Amb35684845 [1,0,0,0,0,1|0,0,1]=3 2009 B12R1.3236 NCC1(CCO)COCCOC1 Amb27806753 [1,0,0,0,0,1|1,0,1]=4 2010 B12R1.3845 CCC1(CCC(=O)O)CCCC1 Amb33470242 [0,0,0,0,1,1|1,0,0]=3 2011 B12R1.3845 CCC1(CNC(=O)Cl)CCCC1 Amb35633502 [0,0,0,0,1,1|2,0,0]=4 2012 B12R1.3845 CCC1(\C=C\C(=O)O)CCCC1 Amb33470072 [0,0,0,0,1,1|1,0,1]=4 2013 B12R1.3845 NCC1(CC=C(Cl)Cl)CCCC1 Amb30019293 [0,0,0,0,1,1|2,0,0]=4 2014 B12R1.2346 CC(=O)C1(CN)CCCCCC1 Amb27416441 [0,0,0,0,1,1|1,0,0]=3 2015 B12R1.2346 CC(O)C1(CN)CCCCCC1 Amb27264529 [0,0,0,0,1,1|1,0,1]=4 2016 B12R1.2346 CCC1(C(=O)O)CCCCCC1 Amb27473406 [0,0,0,0,1,1|1,0,0]=3 2017 B12R1.2346 CNC1(C(=O)O)CCCOCC1 Amb27650898 [0,0,0,0,1,1|2,0,0]=4 2018 B12R1.2346 CNC1(C(=O)O)CCCSCC1 Amb35691499 [0,0,0,0,1,1|2,0,0]=4 2019 B12R1.2346 COC1(C(=O)O)CCCCCC1 Amb18953818 [0,0,0,0,1,1|2,0,0]=4 2020 B12R1.2346 COC1(C(=O)O)CCCSCC1 Amb35691460 [0,0,0,0,1,1|2,0,0]=4 2021 B12R1.2346 N#CC1(C(=O)O)CCCCCC1 Amb7774971 [0,0,0,0,1,1|0,0,2]=4 2022 B12R1.2346 N#CC1(C(=O)O)CCCOCC1 Amb32648355 [0,0,0,0,1,1|0,0,2]=4 2023 B12R1.2346 NCC1(C(=O)O)CCCCCC1 Amb18959884 [0,0,0,0,1,1|0,0,0]=2 2024 B12R1.2346 O=C(O)C1(CF)CCCCCC1 Amb27791270 [0,0,0,0,1,1|1,0,0]=3 2025 B12R1.2346 O=C(O)C1(CO)CCCCCC1 Amb24365964 [0,0,0,0,1,1|1,0,0]=3 2026 B14R1.11375 NCC1(CC=C(Cl)Cl)CCCCCC1 Amb30019320 [0,0,0,0,0,2|2,0,0]=4 2027 B14R1.11379 CCC1(N\C=C\C(=O)O)CCCCC1 Amb28193213 [0,0,0,0,0,2|1,0,1]=4 2028 B14R1.11575 C=C(C)CC1(CN)CCCCCCC1 Amb27418608 [0,0,0,0,0,2|2,0,0]=4 2029 B14R1.11575 CNC1(CC(=O)O)CCCCCCC1 Amb27386884 [0,0,0,0,0,2|2,0,0]=4