0 B13R0.54 BrCCCCCCCCCCC(=O)N Amb16207966 [0,0,0,0,0,0|2,0,0]=2 1 B13R0.54 C=CCCCCCCCCOC(=O)C Amb10563791 [0,0,0,0,0,0|2,0,2]=4 2 B13R0.54 CC(C)CCCCCCCCCCO Amb22055767 [0,0,0,0,0,0|3,0,1]=4 3 B13R0.54 CC(C)CCCCCCCCCCO Amb22730980 [0,0,0,0,0,0|3,0,1]=4 4 B13R0.54 CCCCCCCCCC=CC(=O)O Amb13952752 [0,0,0,0,0,0|0,0,2]=2 5 B13R0.54 CCCCCCCCCCCC(=C)Br Amb19886460 [0,0,0,0,0,0|2,0,0]=2 6 B13R0.54 CCCCCCCCCCCC(=N)N Amb10568321 [0,0,0,0,0,0|2,0,0]=2 7 B13R0.54 CCCCCCCCCCCC(=S)N Amb13953232 [0,0,0,0,0,0|1,1,0]=2 8 B13R0.54 CCCCCCCCCCCC(C)=C Amb19886457 [0,0,0,0,0,0|2,0,0]=2 9 B13R0.54 CCCCCCCCCCCC(C)Br Amb22734063 [0,0,0,0,0,0|2,0,1]=3 10 B13R0.54 CCCCCCCCCCCC(C)N Amb21953727 [0,0,0,0,0,0|2,0,1]=3 11 B13R0.54 CCCCCCCCCCCC(O)=O Amb22348404 [0,0,0,0,0,0|0,0,0]=0 12 B13R0.54 CCCCCCCCCCCC(O)=O Amb22730643 [0,0,0,0,0,0|0,0,0]=0 13 B13R0.54 CCCCCCCCCCCC([O-])=O Amb17942849 [0,0,0,0,0,0|0,0,1]=1 14 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22729066 [0,0,0,0,0,0|0,0,1]=1 15 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730602 [0,0,0,0,0,0|0,0,1]=1 16 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730786 [0,0,0,0,0,0|0,0,1]=1 17 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731774 [0,0,0,0,0,0|0,0,1]=1 18 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731775 [0,0,0,0,0,0|0,0,1]=1 19 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22733752 [0,0,0,0,0,0|0,0,1]=1 20 B13R0.54 CCCCCCCCCCC[13C](O)=O Amb21928681 [0,0,0,0,0,0|0,0,0]=0 21 B13R0.54 CCCCCCCCCCC[14C](O)=O Amb22349630 [0,0,0,0,0,0|0,0,0]=0 22 B13R0.54 CCCCCCCCCCNC(=O)N Amb2228230 [0,0,0,0,0,0|2,0,0]=2 23 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,0,0,0,0,0|2,0,0]=2 24 B13R0.54 CCCCCCCCCCOC([S-])=S Amb22334119 [0,0,0,0,0,0|1,2,0]=3 25 B13R0.54 CCCCCCCCCCOP(O)O Amb22049477 [0,0,0,0,0,0|2,0,1]=3 26 B13R0.54 CCCCCCCCCC[13CH2]C(O)=O Amb22353612 [0,0,0,0,0,0|0,0,0]=0 27 B13R0.54 CCCCCCCCCC[13CH2][13C](O)=O Amb22353611 [0,0,0,0,0,0|0,0,0]=0 28 B13R0.54 CCCCCCCCSCCC(=O)N Amb10669601 [0,0,0,0,0,0|2,0,0]=2 29 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,0,0,0,0,0|1,0,0]=1 30 B13R0.54 CCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22353609 [0,0,0,0,0,0|0,0,0]=0 31 B13R0.54 CCCCCCC\C=C\COC(C)=O Amb22730835 [0,0,0,0,0,0|2,0,2]=4 32 B13R0.54 CCCCCC\C=C/CCCC(O)=O Amb20672025 [0,0,0,0,0,0|0,0,2]=2 33 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,0,0,0,0,0|1,0,0]=1 34 B13R0.54 CCCC\C=C\CCCCOC(C)=O Amb22731600 [0,0,0,0,0,0|2,0,2]=4 35 B13R0.54 CC\C=C/CCCCCCOC(=O)C Amb10563792 [0,0,0,0,0,0|2,0,2]=4 36 B13R0.54 CC\C=C\CCCCCCOC(C)=O Amb22729861 [0,0,0,0,0,0|2,0,2]=4 37 B13R0.54 CN(C)CCCCCCCCCCN Amb24117501 [0,0,0,0,0,0|4,0,0]=4 38 B13R0.54 N#CCCCCCCCCCC(O)=O Amb22547629 [0,0,0,0,0,0|1,0,1]=2 39 B13R0.54 NC(=[NH2+])SCCCCCCCCCO Amb22054616 [0,0,0,0,0,0|4,0,0]=4 40 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,0,0,0,0,0|2,0,0]=2 41 B13R0.54 NCCCCCCCCCCC([O-])=O Amb22353821 [0,0,0,0,0,0|1,0,1]=2 42 B13R0.54 OCCCCCCCCCCC(=O)O Amb1814707 [0,0,0,0,0,0|1,0,0]=1 43 B13R0.54 [13CH3]CCCCCCCCCCC(O)=O Amb22353502 [0,0,0,0,0,0|0,0,0]=0 44 B13R0.54 [13CH3]CCCCCCCCCC[13C](O)=O Amb22353610 [0,0,0,0,0,0|0,0,0]=0 45 B12R0.5 C=CCCCCCCCCCCBr Amb22899287 [1,0,0,0,0,0|2,0,0]=3 46 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [1,0,0,0,0,0|2,0,0]=3 47 B12R0.5 C=CCCCCCCCCC[Mg]Br Amb22897367 [1,0,0,0,0,0|3,0,0]=4 48 B12R0.5 C=CCCCCCCCCC[Zn]Br Amb22897886 [1,0,0,0,0,0|3,0,0]=4 49 B12R0.5 CCCCCCCCCCCCCl Amb22733144 [1,0,0,0,0,0|1,0,1]=3 50 B12R0.5 CCCCCCCCCCCCN Amb22366429 [1,0,0,0,0,0|1,0,1]=3 51 B12R0.5 CCCCCCCCCCCC[14CH3] Amb22352523 [1,0,0,0,0,0|1,0,1]=3 52 B12R0.5 CCCCCCCCCCCC[15NH2] Amb22362752 [1,0,0,0,0,0|1,0,1]=3 53 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [1,0,0,0,0,0|1,0,1]=3 54 B12R0.5 CCCCCCCCCCC[13CH2]Br Amb22338410 [1,0,0,0,0,0|1,0,1]=3 55 B12R0.5 CCCCCCCCCCC[13CH2]O Amb22362751 [1,0,0,0,0,0|0,0,1]=2 56 B12R0.5 CCCCCCCCCCC[Mg]Br Amb22897368 [1,0,0,0,0,0|2,0,0]=3 57 B12R0.5 CCCCCCCCCCN=C=O Amb22348014 [1,0,0,0,0,0|1,0,1]=3 58 B12R0.5 CCCCCCCCCCOC=C Amb22735088 [1,0,0,0,0,0|2,0,0]=3 59 B12R0.5 CCCCCCCCCCOCC Amb24056425 [1,0,0,0,0,0|2,0,1]=4 60 B12R0.5 CCCCCCCCCC\C=C\Cl Amb22731233 [1,0,0,0,0,0|1,0,1]=3 61 B12R0.5 CCCCCCCCC\C=C\C=O Amb22351858 [1,0,0,0,0,0|0,0,2]=3 62 B12R0.5 CCCCCCCCC\C=C\CO Amb22350397 [1,0,0,0,0,0|0,0,3]=4 63 B12R0.5 CCCCCCCCNCCCN Amb19058864 [1,0,0,0,0,0|2,0,1]=4 64 B12R0.5 CCCCCCCCOCCCN Amb13951369 [1,0,0,0,0,0|2,0,1]=4 65 B12R0.5 CCCCCCCCSCCC#N Amb22358950 [1,0,0,0,0,0|2,0,1]=4 66 B12R0.5 CCCCCCCC\C=C\CC=O Amb22735030 [1,0,0,0,0,0|0,0,2]=3 67 B12R0.5 CCCCCCNCCCCCC Amb22350699 [1,0,0,0,0,0|2,0,1]=4 68 B12R0.5 CCCCCCNCCCCCC Amb22359816 [1,0,0,0,0,0|2,0,1]=4 69 B12R0.5 CCCCCC\C=C/CCCCO Amb22740006 [1,0,0,0,0,0|0,0,3]=4 70 B12R0.5 CCCCCC\C=C\CCCCO Amb22740007 [1,0,0,0,0,0|0,0,3]=4 71 B12R0.5 CCCC\C=C/CCCCCCO Amb10563789 [1,0,0,0,0,0|0,0,3]=4 72 B12R0.5 CCC\C=C/CCCCCCCO Amb20243410 [1,0,0,0,0,0|0,0,3]=4 73 B12R0.5 CCC\C=C\CCCCCCCO Amb22734806 [1,0,0,0,0,0|0,0,3]=4 74 B12R0.5 CCOCCCCCCCCCO Amb22233218 [1,0,0,0,0,0|1,0,1]=3 75 B12R0.5 CC\C=C\CCCCCCCCO Amb22731394 [1,0,0,0,0,0|0,0,3]=4 76 B12R0.5 CNCCCNCCCCCCC Amb20171957 [1,0,0,0,0,0|3,0,0]=4 77 B12R0.5 C\C=C\CCCCCCCCCO Amb22731398 [1,0,0,0,0,0|0,0,3]=4 78 B12R0.5 ICCCCCCCCCCCI Amb22346855 [1,0,0,0,0,0|2,0,1]=4 79 B12R0.5 NCCCCCCCCCCCN Amb16233911 [1,0,0,0,0,0|2,0,1]=4 80 B12R0.5 NCCCCCCCCCCCS Amb22336989 [1,0,0,0,0,0|1,1,1]=4 81 B12R0.5 OCCCCCCCCCCC#C Amb10602413 [1,0,0,0,0,0|0,0,3]=4 82 B12R0.5 OCCCCCCCCCCCO Amb15692712 [1,0,0,0,0,0|1,0,1]=3 83 B12R0.5 SCCCCCCCCCCCS Amb22352799 [1,0,0,0,0,0|1,1,1]=4 84 B12R0.234 C=CCCCCCCCCC(=O)[O-] Amb10843808 [1,0,0,0,0,0|0,0,3]=4 85 B12R0.234 C=CCCCCCCCCC(O)=O Amb22353389 [1,0,0,0,0,0|0,0,2]=3 86 B12R0.234 C=CCCCCCCCCC(O)=O Amb22731323 [1,0,0,0,0,0|0,0,2]=3 87 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [1,0,0,0,0,0|3,0,0]=4 88 B12R0.234 CCCCCCCC/C=C/C(O)=O Amb17942922 [1,0,0,0,0,0|0,0,2]=3 89 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [1,0,0,0,0,0|1,0,1]=3 90 B12R0.234 CCCCCCCCCCC(C)Br Amb22338800 [1,0,0,0,0,0|2,0,1]=4 91 B12R0.234 CCCCCCCCCCC(C)C Amb22228876 [1,0,0,0,0,0|2,0,1]=4 92 B12R0.234 CCCCCCCCCC[SiH](C)C Amb19893766 [1,0,0,0,0,0|2,1,0]=4 93 B12R0.234 CCCCCCCCCOC(=O)Cl Amb22732385 [1,0,0,0,0,0|2,0,0]=3 94 B12R0.234 CCCCCCCCCOC([S-])=S Amb19748280 [1,0,0,0,0,0|1,2,0]=4 95 B12R0.234 CCCCCCC\C=C\CC(C)=O Amb21963229 [1,0,0,0,0,0|1,0,2]=4 96 B12R0.234 CNCCOCCOCCC(O)=O Amb24057901 [1,0,0,0,0,0|3,0,0]=4 97 B12R0.234 COCCOCCOCCC(=O)O Amb16184341 [1,0,0,0,0,0|3,0,0]=4 98 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [1,0,0,0,0,0|1,0,0]=2 99 B12R0.234 NCCOCCOCCCC(=O)O Amb16184328 [1,0,0,0,0,0|3,0,0]=4 100 B12R0.234 NCCOCCSCCCC(=O)O Amb17502011 [1,0,0,0,0,0|3,0,0]=4 101 B14R0.2 CCCCCOCC(=O)NCCC(O)=O Amb25391963 [0,1,0,0,0,0|2,0,1]=4 102 B14R0.2 CCCCSCCC(=O)NCCC(O)=O Amb25391980 [0,1,0,0,0,0|2,0,1]=4 103 B14R0.68 C=C(F)CCCCCCCCCC(O)=O Amb22641506 [0,1,0,0,0,0|0,0,2]=3 104 B14R0.68 CC(C)CCCCCCCCCC(O)=O Amb21928797 [0,1,0,0,0,0|0,0,0]=1 105 B14R0.68 OC(=O)CCCCCCCCCC(=O)O Amb10807546 [0,1,0,0,0,0|1,0,1]=3 106 B14R0.88 CCCCCCCCCCCC(C)(C)S Amb22733810 [0,1,0,0,0,0|1,1,1]=4 107 B14R0.88 CCCCCCCCCCCP(O)(O)=O Amb22388785 [0,1,0,0,0,0|1,0,0]=2 108 B14R0.88 CCCCCCCCCCCS([O-])(=O)=O Amb22052665 [0,1,0,0,0,0|1,0,1]=3 109 B14R0.88 CCCCCCCCCCC[Si](Cl)(Cl)Cl Amb19894165 [0,1,0,0,0,0|2,1,0]=4 110 B14R0.88 CCCCCCCCCCOS(=O)(=O)[O-] Amb10789214 [0,1,0,0,0,0|2,0,1]=4 111 B14R0.88 CCCCCCCCCCSS(=O)(=O)C Amb17611641 [0,1,0,0,0,0|2,0,1]=4 112 B14R0.88 NCCCCCCCCCCP(O)(O)=O Amb22388717 [0,1,0,0,0,0|2,0,0]=3 113 B14R0.88 NCCCCCCCCCCP(O)(O)=O Amb22388718 [0,1,0,0,0,0|2,0,0]=3 114 B14R0.88 OP(O)(=O)CCCCCCCCCCBr Amb24057492 [0,1,0,0,0,0|2,0,0]=3 115 B14R0.231 CCCOCC(=O)NCCCCC(O)=O Amb25391846 [0,1,0,0,0,0|2,0,1]=4 116 B14R0.231 CCCSCC(=O)NCCCCC(O)=O Amb25391845 [0,1,0,0,0,0|2,0,1]=4 117 B14R0.305 CCC(=O)NCCCCCCCC(O)=O Amb25392233 [0,1,0,0,0,0|1,0,1]=3 118 B14R0.305 CCC(C)CCCCCCCCC(O)=O Amb21928795 [0,1,0,0,0,0|0,0,0]=1 119 B14R0.305 NNC(=O)CCCCCCCCC(=O)O Amb1792999 [0,1,0,0,0,0|2,0,1]=4 120 B14R0.337 BrCCCCCCCCCCC(=O)NN Amb16207967 [0,1,0,0,0,0|2,0,0]=3 121 B14R0.337 CCCCCCCCCCCC(=O)NC Amb22043375 [0,1,0,0,0,0|1,0,0]=2 122 B14R0.337 CCCCCCCCCCCC(O)C#C Amb22345519 [0,1,0,0,0,0|1,0,1]=3 123 B14R0.337 CCCCCCCCCCNC(=O)C=C Amb22735131 [0,1,0,0,0,0|2,0,0]=3 124 B14R0.337 CCCCCCCCCCNC(=O)CBr Amb17333188 [0,1,0,0,0,0|2,0,0]=3 125 B14R0.337 CCCCCCCCCCOC(=O)CBr Amb1103529 [0,1,0,0,0,0|2,0,0]=3 126 B14R0.337 CCCCCCCCCOCC(CO)O Amb10071477 [0,1,0,0,0,0|1,0,2]=4 127 B14R0.337 COC(=O)CCCCCCCCCC=C Amb21928798 [0,1,0,0,0,0|0,0,2]=3 128 B14R0.337 COC(=O)CCCCCCCCCCCl Amb22522963 [0,1,0,0,0,0|1,0,0]=2 129 B14R0.337 COC(=O)CCCCCCCCCCN Amb23575681 [0,1,0,0,0,0|1,0,0]=2 130 B14R0.340 CCCCCCCCCCC(N)C(O)=O Amb21858489 [0,1,0,0,0,0|0,0,0]=1 131 B14R0.340 CCCCCCCCCC[C@@H](N)C(O)=O Amb22745407 [0,1,0,0,0,0|0,0,0]=1 132 B14R0.344 CCCCCCCCC(C)CCC(O)=O Amb22347578 [0,1,0,0,0,0|0,0,0]=1 133 B14R0.344 CCCCCCCCC(O)C#CC(O)=O Amb17779806 [0,1,0,0,0,0|0,0,2]=3 134 B14R0.344 CCCCCCCCS(=O)CCC(=O)N Amb10669588 [0,1,0,0,0,0|2,0,0]=3 135 B14R0.344 CCCCCCCCS(=O)CCC(=O)O Amb1038995 [0,1,0,0,0,0|1,0,0]=2 136 B14R0.344 CCCCCCCNC(=O)CCC(=O)O Amb1771111 [0,1,0,0,0,0|1,0,1]=3 137 B14R0.391 CC(=O)CC(=O)NCCCCCCCC Amb22359801 [0,1,0,0,0,0|2,0,1]=4 138 B14R0.391 CCCCCCCCCC(O)CC(O)=O Amb21928747 [0,1,0,0,0,0|0,0,0]=1 139 B14R0.391 CCCCCCC\C=C\C(O)CC(O)=O Amb22831937 [0,1,0,0,0,0|0,0,2]=3 140 B14R0.391 CCCCC\C=C\CCC(O)CC(O)=O Amb22831938 [0,1,0,0,0,0|0,0,2]=3 141 B14R0.391 CC\C=C/CCCCCC(O)CC(O)=O Amb22831939 [0,1,0,0,0,0|0,0,2]=3 142 B14R0.394 C#CCCCCCCCCCCC(=O)O Amb1396957 [0,1,0,0,0,0|0,0,1]=2 143 B14R0.394 CC(=O)NCCCCCCCCCCN Amb22358951 [0,1,0,0,0,0|2,0,0]=3 144 B14R0.394 CC(=O)OCCCCCCCCCC=C Amb19930234 [0,1,0,0,0,0|1,0,2]=4 145 B14R0.394 CC(C)CCCCCCCCCCCO Amb22055854 [0,1,0,0,0,0|2,0,1]=4 146 B14R0.394 CCCCCCCCCCCCB(O)O Amb13890365 [0,1,0,0,0,0|1,0,1]=3 147 B14R0.394 CCCCCCCCCCCCC(=C)Br Amb19886461 [0,1,0,0,0,0|2,0,0]=3 148 B14R0.394 CCCCCCCCCCCCC(=O)Cl Amb22353030 [0,1,0,0,0,0|1,0,0]=2 149 B14R0.394 CCCCCCCCCCCCC(C)=C Amb19886458 [0,1,0,0,0,0|2,0,0]=3 150 B14R0.394 CCCCCCCCCCCCC(C)=O Amb22730728 [0,1,0,0,0,0|1,0,0]=2 151 B14R0.394 CCCCCCCCCCCCC(C)Br Amb22045226 [0,1,0,0,0,0|2,0,1]=4 152 B14R0.394 CCCCCCCCCCCCC(C)C Amb22730068 [0,1,0,0,0,0|2,0,1]=4 153 B14R0.394 CCCCCCCCCCCCC(N)=O Amb22359815 [0,1,0,0,0,0|1,0,0]=2 154 B14R0.394 CCCCCCCCCCCCS(C)=O Amb22337517 [0,1,0,0,0,0|2,0,0]=3 155 B14R0.394 CCCCCCCCCC\C=C\C(O)=O Amb22734282 [0,1,0,0,0,0|0,0,1]=2 156 B14R0.394 CCCCCCCCSCCSC(=N)N Amb1085938 [0,1,0,0,0,0|3,0,0]=4 157 B14R0.394 CCCCCCCCSCCSC(N)=N Amb22283870 [0,1,0,0,0,0|3,0,0]=4 158 B14R0.394 C\C=C\CCCCCCCCOC(C)=O Amb22641577 [0,1,0,0,0,0|1,0,2]=4 159 B14R0.394 NCCOCCOCCOCCC(O)=O Amb22371716 [0,1,0,0,0,0|3,0,0]=4 160 B14R0.394 OC(=O)CCCCCCCCCCCS Amb22350627 [0,1,0,0,0,0|0,0,0]=1 161 B14R0.394 OC(=O)CCCCCCCC\C=C\C=O Amb21928974 [0,1,0,0,0,0|0,0,3]=4 162 B14R0.394 OC(=O)CCCCCCC\C=C/CC=O Amb21928973 [0,1,0,0,0,0|0,0,3]=4 163 B14R0.394 OC(=O)CCOCCOCCOCCBr Amb24057426 [0,1,0,0,0,0|3,0,0]=4 164 B14R0.394 OC(=O)CCOCCOCCOCCS Amb24058080 [0,1,0,0,0,0|3,0,0]=4 165 B14R0.394 OCCOCCOCCOCCC(O)=O Amb24057824 [0,1,0,0,0,0|3,0,0]=4 166 B14R0.432 CCOC(=O)CCCCCCCC(=O)O Amb17608619 [0,1,0,0,0,0|1,0,1]=3 167 B14R0.2224 CCCCCNC(=O)NCCCC(=O)O Amb17043004 [0,1,0,0,0,0|2,0,1]=4 168 B14R0.2224 COCCCCC(=O)NCCCC(O)=O Amb25392005 [0,1,0,0,0,0|2,0,1]=4 169 B14R1.96 CCC1CCCCC1N\C=C\C(O)=O Amb24730088 [0,0,0,1,0,0|1,0,2]=4 170 B14R1.96 CCC1CCCCN1CCCC(=O)Cl Amb17143700 [0,0,0,1,0,0|2,0,0]=3 171 B14R1.96 CCC1CCCCN1CCCC(=O)N Amb17143194 [0,0,0,1,0,0|2,0,0]=3 172 B14R1.122 CCCCCCCCC1CCC(=O)O1 Amb10071536 [0,0,0,1,0,0|0,0,0]=1 173 B14R1.159 CC1CSCCN1CCCCC(O)=O Amb25386602 [0,0,0,1,0,0|2,0,0]=3 174 B14R1.221 CCCCCCCCCCCC1CO1 Amb24057487 [0,0,0,1,0,0|1,0,1]=3 175 B14R1.221 CCCCCCCCCCC[C@@H]1CO1 Amb22337892 [0,0,0,1,0,0|1,0,1]=3 176 B14R1.269 CCCC1CCCCCC1NC(=O)C Amb2227902 [0,0,0,1,0,0|2,0,0]=3 177 B14R1.269 CCC[C@@H]1CCCCC[C@@H]1NC(C)=O Amb24629779 [0,0,0,1,0,0|2,0,0]=3 178 B14R1.333 NC1CCCCCCC1SCC(N)=O Amb24507705 [0,0,0,1,0,0|3,0,0]=4 179 B14R1.333 OC1CCCCCCC1CCC(O)=O Amb24378159 [0,0,0,1,0,0|1,0,0]=2 180 B14R1.422 NC(=O)CCCCCC1CCCCC1 Amb22340011 [0,0,0,1,0,0|1,0,0]=2 181 B14R1.422 OC(=O)CCCC#CC1CCCCC1 Amb25774995 [0,0,0,1,0,0|0,0,2]=3 182 B14R1.422 OC(=O)CCCCCC1CCCCC1 Amb22230076 [0,0,0,1,0,0|0,0,0]=1 183 B14R1.422 OC(=O)CCCSCC1CCCNC1 Amb17503127 [0,0,0,1,0,0|2,0,0]=3 184 B14R1.422 OC(=O)CCCSCC1CCNCC1 Amb17503028 [0,0,0,1,0,0|2,0,0]=3 185 B14R1.422 OC(=O)CCNCCC1=CCCCC1 Amb17309052 [0,0,0,1,0,0|1,0,2]=4 186 B14R1.422 OC(=O)CNCCCN1CCCCC1 Amb20152206 [0,0,0,1,0,0|2,0,0]=3 187 B14R1.427 OC(=O)CCNCCCN1CCCC1 Amb19090342 [0,0,0,1,0,0|2,0,0]=3 188 B14R1.498 CSCC1CCCN1CCCC(O)=O Amb25387490 [0,0,0,1,0,0|2,0,0]=3 189 B14R1.651 C#CCCC1CCCCCC1C(O)=O Amb25165528 [0,0,0,1,0,0|0,0,2]=3 190 B14R1.651 C#CCCN1CCCCCC1C(O)=O Amb25774429 [0,0,0,1,0,0|1,0,2]=4 191 B14R1.651 CC#CCC1CCCCCC1C(O)=O Amb25165527 [0,0,0,1,0,0|0,0,2]=3 192 B14R1.651 CC#CCN1CCCCCC1C(O)=O Amb25257396 [0,0,0,1,0,0|1,0,2]=4 193 B14R1.653 CCCCC1CCC=CCCC(=O)N1 Amb24443708 [0,0,0,1,0,0|1,0,2]=4 194 B14R1.653 OCCCC1CC=CCCCC(=O)O1 Amb25136300 [0,0,0,1,0,0|1,0,2]=4 195 B14R1.786 CC#CCN1CCCCC1CC(O)=O Amb19063514 [0,0,0,1,0,0|1,0,2]=4 196 B14R1.786 CCCCN1CCCCC1CC(O)=O Amb19056735 [0,0,0,1,0,0|1,0,0]=2 197 B14R1.854 CSC1CCCCCCC1NC(C)=O Amb25165897 [0,0,0,1,0,0|3,0,0]=4 198 B14R1.903 CCOCCN1CCCCC1C(O)=O Amb24770122 [0,0,0,1,0,0|2,0,0]=3 199 B14R1.903 CSCCNC1CCCCC1C(N)=O Amb24271669 [0,0,0,1,0,0|3,0,0]=4 200 B14R1.1454 OC(=O)\C=C\CN1CCCCCCC1 Amb18296450 [0,0,0,1,0,0|1,0,2]=4 201 B14R1.1454 OC(=O)\C=C\NC1CCCCCCC1 Amb24658938 [0,0,0,1,0,0|1,0,2]=4 202 B14R1.1820 C=CC1CCCCCCCC1C(O)=O Amb25672397 [0,0,0,1,0,0|0,0,2]=3 203 B14R1.4408 CC1CCCCCCCCCCCN1 Amb25691000 [0,0,0,1,0,0|2,0,1]=4 204 B14R1.4408 NC1CCCCCCCCCCCC1 Amb24631880 [0,0,0,1,0,0|2,0,1]=4 205 B14R1.4408 NN1CCCCCCCCCCCC1 Amb25848483 [0,0,0,1,0,0|3,0,0]=4 206 B14R1.4408 O=C1C=CCCCCCCCCCN1 Amb24404897 [0,0,0,1,0,0|1,0,2]=4 207 B14R1.4408 O=C1CCCCCCCCCCC=C1 Amb25793577 [0,0,0,1,0,0|1,0,1]=3 208 B14R1.4408 O=C1CCCCCCCNCCCN1 Amb25037669 [0,0,0,1,0,0|2,0,0]=3 209 B14R1.4408 O=C1CCNCCCCNCCCN1 Amb25664304 [0,0,0,1,0,0|3,0,0]=4 210 B14R1.4408 O=C1OCCCCCCCCCCO1 Amb24459843 [0,0,0,1,0,0|1,0,0]=2 211 B14R1.4408 OC1CCCCCCCCCCC=C1 Amb25855851 [0,0,0,1,0,0|1,0,2]=4 212 B14R1.4408 OC1CCCCCCCCCCCN1 Amb25139380 [0,0,0,1,0,0|1,0,1]=3 213 B14R1.4408 O[C@H]1CCCCCCCCCCC=C1 Amb25098681 [0,0,0,1,0,0|1,0,2]=4 214 B14R1.4408 S=C1CCCCCCCCCCCN1 Amb25835726 [0,0,0,1,0,0|1,1,0]=3 215 B14R1.4728 CCCCCCCCC1CC1C(=O)O Amb1033024 [0,0,0,1,0,0|0,0,0]=1 216 B14R1.4972 FC1(F)CCCCCCCCCCC1 Amb24687280 [0,0,0,1,0,0|2,0,1]=4 217 B14R1.5254 C#CCN1CCCCCCC1C(O)=O Amb24731020 [0,0,0,1,0,0|1,0,2]=4 218 B14R1.5254 CCCN1CCCCCCC1C(O)=O Amb25354108 [0,0,0,1,0,0|1,0,0]=2 219 B14R1.5254 OC(=O)C1CCCCCCN1CCF Amb25715628 [0,0,0,1,0,0|2,0,0]=3 220 B14R1.5254 OCCN1CCCCCCC1C(O)=O Amb24418260 [0,0,0,1,0,0|2,0,0]=3 221 B14R1.5883 CC1CCCCCCCCCC1(C)C Amb24594982 [0,0,0,1,0,0|2,0,1]=4 222 B14R1.6335 CC(=O)CCN1CCCCCCCC1 Amb24351727 [0,0,0,1,0,0|2,0,0]=3 223 B14R1.6335 CC(O)CCN1CCCCCCCC1 Amb25793669 [0,0,0,1,0,0|2,0,1]=4 224 B14R1.6335 NC(=N)CCN1CCCCCCCC1 Amb25060830 [0,0,0,1,0,0|3,0,0]=4 225 B14R1.6335 NC(=O)CCN1CCCCCCCC1 Amb25169053 [0,0,0,1,0,0|2,0,0]=3 226 B14R1.6335 OC(=O)CCN1CCCCCCCC1 Amb25298722 [0,0,0,1,0,0|1,0,0]=2 227 B14R1.6343 NC(=O)CSCCN1CCCCCC1 Amb21983543 [0,0,0,1,0,0|3,0,0]=4 228 B14R1.6343 OC(=O)CCCCN1CCNCCC1 Amb17479032 [0,0,0,1,0,0|2,0,0]=3 229 B14R1.6343 OC(=O)CNCCN1CCCCCC1 Amb20573254 [0,0,0,1,0,0|2,0,0]=3 230 B14R1.6343 OC(=O)CSCCN1CCCCCC1 Amb21988835 [0,0,0,1,0,0|2,0,0]=3 231 B14R1.6414 CC(O)C1CCCCCCCCCC1 Amb25107604 [0,0,0,1,0,0|1,0,1]=3 232 B14R1.6414 OC(=O)C1CC=CCCCCCCC1 Amb24498139 [0,0,0,1,0,0|0,0,2]=3 233 B14R1.6444 OC(=O)CC1CCCCCCCCC1 Amb25125214 [0,0,0,1,0,0|0,0,0]=1 234 B14R1.6444 OC(=O)CC=1CCCCCCCCC1 Amb24498388 [0,0,0,1,0,0|0,0,2]=3 235 B11R0.3 CCCCCCCCCCCF Amb17939015 [2,0,0,0,0,0|1,0,0]=3 236 B11R0.3 CCCCCCCCCCCS Amb22366963 [2,0,0,0,0,0|0,1,0]=3 237 B11R0.3 CCCCCCCCCCOC Amb21520322 [2,0,0,0,0,0|1,0,1]=4 238 B11R0.3 CCCCCCCCCC[13CH]=[13CH2] Amb22351201 [2,0,0,0,0,0|0,0,1]=3 239 B11R0.3 CCCCCCCCCC[Hg]Cl Amb22359876 [2,0,0,0,0,0|2,0,0]=4 240 B11R0.3 CCCCCCCCCC[Mg]Br Amb22363113 [2,0,0,0,0,0|2,0,0]=4 241 B11R0.3 CCCCCCCCCC[Mg]Cl Amb22737569 [2,0,0,0,0,0|2,0,0]=4 242 B11R0.3 CCCCCCCCCN=C=O Amb22336763 [2,0,0,0,0,0|1,0,1]=4 243 B11R0.3 CCCCCCCCCSCC Amb22359735 [2,0,0,0,0,0|1,0,1]=4 244 B11R0.3 CCCCCCCCNCCN Amb18794624 [2,0,0,0,0,0|2,0,0]=4 245 B11R0.3 CCCCCCCCNCCN Amb22358941 [2,0,0,0,0,0|2,0,0]=4 246 B11R0.3 CCCCCCCCOCC=O Amb18807440 [2,0,0,0,0,0|1,0,0]=3 247 B11R0.3 CCCCCCCCSCCO Amb1032988 [2,0,0,0,0,0|1,0,0]=3 248 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [2,0,0,0,0,0|0,0,2]=4 249 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [2,0,0,0,0,0|0,0,2]=4 250 B11R0.3 CCCCCCCNCCCN Amb18794637 [2,0,0,0,0,0|2,0,0]=4 251 B11R0.3 CCCCCOCCOCCO Amb22366805 [2,0,0,0,0,0|2,0,0]=4 252 B11R0.3 CC\C=C/CCCCCCC=O Amb10807471 [2,0,0,0,0,0|0,0,2]=4 253 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [2,0,0,0,0,0|0,0,2]=4 254 B11R0.3 ICCCCCCCCCCI Amb10071532 [2,0,0,0,0,0|2,0,0]=4 255 B11R0.3 NCCCCCCCCCCBr Amb17609917 [2,0,0,0,0,0|2,0,0]=4 256 B11R0.3 NCCCCCCCCCCN Amb22732919 [2,0,0,0,0,0|2,0,0]=4 257 B11R0.3 NCCCCCCCCCCO Amb17607975 [2,0,0,0,0,0|1,0,0]=3 258 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [2,0,0,0,0,0|1,0,0]=3 259 B11R0.3 OCCCCCCCCC#CC Amb10605931 [2,0,0,0,0,0|0,0,2]=4 260 B11R0.3 OCCCCCCCCCCCl Amb10844747 [2,0,0,0,0,0|1,0,0]=3 261 B11R0.148 C#CCCCCCCCC(O)=O Amb22388895 [2,0,0,0,0,0|0,0,2]=4 262 B11R0.148 CCCC=CCCCCC(O)=O Amb24063196 [2,0,0,0,0,0|0,0,2]=4 263 B11R0.148 CCCCC=CCCCC(O)=O Amb24062906 [2,0,0,0,0,0|0,0,2]=4 264 B11R0.148 CCCCCC=CCCC(O)=O Amb24079160 [2,0,0,0,0,0|0,0,2]=4 265 B11R0.148 CCCCCCCCCC([O-])=O Amb22733551 [2,0,0,0,0,0|0,0,1]=3 266 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [2,0,0,0,0,0|0,0,0]=2 267 B11R0.148 CCCCCCCCC[C@H](C)O Amb20240616 [2,0,0,0,0,0|1,0,1]=4 268 B11R0.148 CCCCCCCCNC(=O)C Amb10562300 [2,0,0,0,0,0|2,0,0]=4 269 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [2,0,0,0,0,0|0,0,0]=2 270 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [2,0,0,0,0,0|1,0,0]=3 271 B11R0.148 CCCCCC\C=C\CC(=O)O Amb10807476 [2,0,0,0,0,0|0,0,2]=4 272 B11R0.148 CCCCC\C=C\CCC(=O)O Amb17594266 [2,0,0,0,0,0|0,0,2]=4 273 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [2,0,0,0,0,0|1,0,0]=3 274 B11R0.148 CCC\C=C\CCCCC(O)=O Amb22411539 [2,0,0,0,0,0|0,0,2]=4 275 B11R0.148 CCNCCOCCCC(O)=O Amb18110845 [2,0,0,0,0,0|2,0,0]=4 276 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [2,0,0,0,0,0|2,0,0]=4 277 B11R0.148 OC(=O)CCCCCCCC=O Amb17939414 [2,0,0,0,0,0|1,0,1]=4 278 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [2,0,0,0,0,0|0,0,0]=2 279 B13R0.2 CCCCCCCCCC(O)CCC Amb22229885 [1,1,0,0,0,0|1,0,1]=4 280 B13R0.2 CCCCCCCCCC(O)CCO Amb24081769 [1,1,0,0,0,0|0,0,1]=3 281 B13R0.66 CCCCC(O)CCCCCCCC Amb22230023 [1,1,0,0,0,0|1,0,1]=4 282 B13R0.66 CCCCCCCCS(=O)CCCO Amb1085915 [1,1,0,0,0,0|1,0,1]=4 283 B13R0.147 CCCCCCCCCCC(=O)C=O Amb24084923 [1,1,0,0,0,0|0,0,1]=3 284 B13R0.147 CCCCCCCCCCC(C)[Mg]Br Amb22897298 [1,1,0,0,0,0|2,0,0]=4 285 B13R0.147 CCCCCCCCCCC(O)CC Amb22229414 [1,1,0,0,0,0|1,0,1]=4 286 B13R0.147 CCCCCCCCCCC(O)CO Amb22002456 [1,1,0,0,0,0|0,0,1]=3 287 B13R0.165 CCCCCCC(CCCCCC)O Amb10553307 [1,1,0,0,0,0|1,0,1]=4 288 B13R0.336 C=CCCCCCCCCCCC=C Amb22227679 [1,1,0,0,0,0|1,0,1]=4 289 B13R0.336 CCCCCCCCCCCCCBr Amb16234183 [1,1,0,0,0,0|1,0,1]=4 290 B13R0.336 CCCCCCCCCCCCC[NH3+] Amb10555901 [1,1,0,0,0,0|1,0,1]=4 291 B13R0.336 CCCCCCCCCCCCON Amb24117984 [1,1,0,0,0,0|0,0,1]=3 292 B13R0.336 CCCCCCCCCCCCS[Au] Amb22354035 [1,1,0,0,0,0|0,1,1]=4 293 B13R0.336 CCCCCCCCCCCC[Hg]Cl Amb22359879 [1,1,0,0,0,0|1,0,1]=4 294 B13R0.336 CCCCCCCCCCCC[Mg]Br Amb22353523 [1,1,0,0,0,0|1,0,1]=4 295 B13R0.336 CCCCCCCCCCCN=C=O Amb16233603 [1,1,0,0,0,0|0,0,1]=3 296 B13R0.336 CCCCCCCCCCCN=C=S Amb19883893 [1,1,0,0,0,0|0,1,1]=4 297 B13R0.336 CCCCCCCCCCNCCN Amb18333779 [1,1,0,0,0,0|1,0,1]=4 298 B13R0.336 CCCCCCCCCCOCC#N Amb22358974 [1,1,0,0,0,0|1,0,1]=4 299 B13R0.336 CCCCCCCCCCSCCN Amb24060873 [1,1,0,0,0,0|1,0,1]=4 300 B13R0.336 CCCCCCCCCCSCCO Amb1032989 [1,1,0,0,0,0|0,0,1]=3 301 B13R0.336 CCCCCCCCCC\C=C\C=O Amb22351314 [1,1,0,0,0,0|0,0,1]=3 302 B13R0.336 CCCCCCCCCC\C=C\CO Amb22336246 [1,1,0,0,0,0|0,0,1]=3 303 B13R0.336 NCCCCCCCCCCCCBr Amb17609918 [1,1,0,0,0,0|1,0,1]=4 304 B13R0.336 NCCCCCCCCCCCCO Amb17608041 [1,1,0,0,0,0|0,0,1]=3 305 B13R0.336 OC\C=C\CCCCCCCCCBr Amb22347650 [1,1,0,0,0,0|1,0,1]=4 306 B13R0.338 CCCCCCCC(O)CCCCC Amb22230107 [1,1,0,0,0,0|1,0,1]=4 307 B13R0.1 CCCCCCC(O)C\C=C\C(O)=O Amb22545321 [1,1,0,0,0,0|0,0,2]=4 308 B13R0.150 CC(CCCCCCCCO)C(O)=O Amb20246737 [1,1,0,0,0,0|1,0,0]=3 309 B13R0.150 CCCCCCCCCC(C)C(O)=O Amb18320092 [1,1,0,0,0,0|0,0,0]=2 310 B13R0.150 CCCCCCCCCC(O)C(O)=O Amb22224801 [1,1,0,0,0,0|0,0,0]=2 311 B13R0.154 CCCCCCCC(O)CCC(O)=O Amb22058992 [1,1,0,0,0,0|0,0,0]=2 312 B13R0.154 CCCCCCCC(O)CCC([O-])=O Amb19148937 [1,1,0,0,0,0|0,0,1]=3 313 B13R0.179 CC(C)CCCCCCCCC(O)=O Amb21928890 [1,1,0,0,0,0|0,0,0]=2 314 B13R0.179 CC(CCCCCCCCC(=O)O)N Amb2229643 [1,1,0,0,0,0|0,0,0]=2 315 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22264826 [1,1,0,0,0,0|1,0,1]=4 316 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22351881 [1,1,0,0,0,0|1,0,1]=4 317 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22369048 [1,1,0,0,0,0|1,0,1]=4 318 B13R0.202 CCC(C)CCCCCCCC(O)=O Amb21928874 [1,1,0,0,0,0|0,0,0]=2 319 B13R0.202 CCC(CCCCCCCC(=O)O)N Amb2229644 [1,1,0,0,0,0|0,0,0]=2 320 B13R0.202 COC(=O)CCCCCCCC(=O)O Amb2099653 [1,1,0,0,0,0|1,0,1]=4 321 B13R0.202 OC(=O)CCCCCCCC(F)CBr Amb22547613 [1,1,0,0,0,0|1,0,0]=3 322 B13R0.280 CCCCCCCCCCP(=O)(C)C Amb1239581 [1,1,0,0,0,0|2,0,0]=4 323 B13R0.280 CCCCCCCCCCS(O)(=O)=O Amb22348234 [1,1,0,0,0,0|1,0,0]=3 324 B13R0.335 CCCCCCCCC(O)CC(O)=O Amb21928763 [1,1,0,0,0,0|0,0,0]=2 325 B13R0.335 CCCCCCCNC(C)CC(N)=O Amb20090477 [1,1,0,0,0,0|2,0,0]=4 326 B13R0.335 CCCCCC\C=C\C(O)CC(O)=O Amb22831935 [1,1,0,0,0,0|0,0,2]=4 327 B13R0.335 CC\C=C/CCCCC(O)CC(O)=O Amb22831936 [1,1,0,0,0,0|0,0,2]=4 328 B15R0.367 CCCCCCCCC(=O)CCSC(C)=O Amb17779684 [0,2,0,0,0,0|1,0,1]=4 329 B15R0.371 CCCCCC(NC(=O)CCCC(=O)O)C Amb1887698 [0,2,0,0,0,0|1,0,1]=4 330 B15R0.247 CCC(C)CCCCCCCCCC(O)=O Amb21928889 [0,2,0,0,0,0|0,0,0]=2 331 B15R0.247 COC(=O)CCCCCCCCCC(C)C Amb21928849 [0,2,0,0,0,0|0,0,0]=2 332 B15R0.2702 CC(C)C(=O)NCCCCCCCC(O)=O Amb24781559 [0,2,0,0,0,0|1,0,1]=4 333 B15R0.5184 NC(CCCCC(O)=O)CCCCC(O)=O Amb21913247 [0,2,0,0,0,0|1,0,1]=4 334 B15R0.252 CCCCCCCCCCCCS(=O)(=O)[O-] Amb10807313 [0,2,0,0,0,0|1,0,1]=4 335 B15R0.252 CCCCCCCCCCCOS(O)(=O)=O Amb22731675 [0,2,0,0,0,0|1,0,0]=3 336 B15R0.252 CCCCCCCCCCCOS([O-])(=O)=O Amb22043316 [0,2,0,0,0,0|1,0,1]=4 337 B15R0.252 OP(O)(=O)CCCCCCCCCCCS Amb23437860 [0,2,0,0,0,0|1,0,0]=3 338 B15R0.99 CCC(C)CC(=O)NCCCCCC(O)=O Amb25396531 [0,2,0,0,0,0|1,0,1]=4 339 B15R0.234 CCCOCC(=O)NCCCCCC(O)=O Amb24781081 [0,2,0,0,0,0|1,0,1]=4 340 B15R0.234 CCCSCC(=O)NCCCCCC(O)=O Amb24781080 [0,2,0,0,0,0|1,0,1]=4 341 B15R0.234 CSCCCC(=O)NCCCCCC(O)=O Amb17954261 [0,2,0,0,0,0|1,0,1]=4 342 B15R0.193 CCCCOCC(=O)NCCCCC(O)=O Amb24780687 [0,2,0,0,0,0|1,0,1]=4 343 B15R0.193 NCCCCCC(=O)CCCCCC(O)=O Amb22347546 [0,2,0,0,0,0|0,0,1]=3 344 B15R0.399 CCCC(C)CC(=O)NCCCCC(O)=O Amb24780688 [0,2,0,0,0,0|1,0,1]=4 345 B15R0.3196 CCSCCC(C)N(C)CCCCC(O)=O Amb24868139 [0,2,0,0,0,0|2,0,0]=4 346 B15R0.111 CCCC(=O)NCCCCCCCC(O)=O Amb24781558 [0,2,0,0,0,0|0,0,1]=3 347 B15R0.111 COCC(=O)NCCCCCCCC(O)=O Amb24781561 [0,2,0,0,0,0|1,0,1]=4 348 B15R0.172 CCC(C)CCCCCCCCC(=O)OC Amb21928848 [0,2,0,0,0,0|0,0,0]=2 349 B15R0.172 COC(=O)CCCCCCCCC(F)CBr Amb22547620 [0,2,0,0,0,0|1,0,0]=3 350 B15R0.172 COC(=O)CCCCCCCCC(F)CO Amb22547616 [0,2,0,0,0,0|1,0,0]=3 351 B15R0.172 COC(=O)CCCCCCCCC(O)CF Amb22547611 [0,2,0,0,0,0|1,0,0]=3 352 B15R0.81 CCCCCCCCCCCCC(=O)C=C Amb10562278 [0,2,0,0,0,0|1,0,0]=3 353 B15R0.81 CCCCCCCCCCCCC(=O)OC Amb21928887 [0,2,0,0,0,0|0,0,0]=2 354 B15R0.81 CCCCCCCCCCCCC(O)CO Amb17674268 [0,2,0,0,0,0|0,0,2]=4 355 B15R0.81 CCCCCCCCCCCCN(N=O)C Amb17618596 [0,2,0,0,0,0|2,0,0]=4 356 B15R0.81 CCCCCCCCCCCNC(=O)CCl Amb17869099 [0,2,0,0,0,0|1,0,0]=3 357 B15R0.81 CCCCCCCCCCCOC(=O)C=C Amb17934180 [0,2,0,0,0,0|1,0,0]=3 358 B15R0.81 CCCCCCCCCCCOC(=O)CCl Amb24097185 [0,2,0,0,0,0|1,0,0]=3 359 B15R0.81 CCCCCCCCCCOCC(O)CN Amb22348071 [0,2,0,0,0,0|1,0,1]=4 360 B15R0.81 CCCCCCCCCC\C=C\C(=O)OC Amb21928888 [0,2,0,0,0,0|0,0,1]=3 361 B15R0.81 COC(=O)CCCCCCCCCCC#N Amb22730693 [0,2,0,0,0,0|0,0,1]=3 362 B15R0.81 COC(=O)CCCCCCCCCCCN Amb21856053 [0,2,0,0,0,0|0,0,0]=2 363 B15R0.81 NCCCCCCCCCCCC(=O)OC Amb17608040 [0,2,0,0,0,0|0,0,0]=2 364 B15R0.84 CC(=C)C(=O)NCCCCCCCCCC Amb17933993 [0,2,0,0,0,0|2,0,0]=4 365 B15R0.84 CC(=C)C(=O)OCCCCCCCCCC Amb17933994 [0,2,0,0,0,0|2,0,0]=4 366 B15R0.84 CC(CCCCCCCCCCC)=C(F)F Amb22641691 [0,2,0,0,0,0|2,0,0]=4 367 B15R0.84 CCCCCCCCCCCC(O)C(O)=O Amb22730439 [0,2,0,0,0,0|0,0,0]=2 368 B15R0.84 CCCCCCCCCCNC(=O)C(Br)C Amb17332064 [0,2,0,0,0,0|2,0,0]=4 369 B15R0.84 CCCCCCCCCCOC(=O)C(C)C Amb22732202 [0,2,0,0,0,0|2,0,0]=4 370 B15R0.253 CCCCCCCCCCCC(OC)OC Amb22730042 [0,2,0,0,0,0|0,0,2]=4 371 B15R0.324 CCCCCCCCCCC(Br)C(=O)OC Amb17673704 [0,2,0,0,0,0|0,0,0]=2 372 B15R0.324 CCCCCCCCCCC(O)C(=O)OC Amb21928821 [0,2,0,0,0,0|0,0,0]=2 373 B15R0.324 CCCCCCCCNCC(C)C(=O)OC Amb20673404 [0,2,0,0,0,0|1,0,0]=3 374 B15R0.324 COC(=O)C(C)CNCCCOCCCC Amb20673369 [0,2,0,0,0,0|2,0,0]=4 375 B15R0.366 CCCCCCC=CCCCC(=O)OCC Amb24066550 [0,2,0,0,0,0|0,0,2]=4 376 B15R0.366 CCCCCCCCCCCC(=O)CCC Amb22733183 [0,2,0,0,0,0|1,0,0]=3 377 B15R0.366 CCCCCCCCCCCC(=O)CCN Amb22358955 [0,2,0,0,0,0|1,0,0]=3 378 B15R0.366 CCCCCCCCCCCC(=O)NCC Amb17671367 [0,2,0,0,0,0|1,0,0]=3 379 B15R0.366 CCCCCCCCCCCC(=O)OC=C Amb17938955 [0,2,0,0,0,0|0,0,0]=2 380 B15R0.366 CCCCCCCCCCCC(CC#C)O Amb16202818 [0,2,0,0,0,0|1,0,1]=4 381 B15R0.366 CCCCCCCCCCOC(=O)CCC Amb22367032 [0,2,0,0,0,0|2,0,0]=4 382 B15R0.366 CCCCCCCCC\C=C\C(=O)OCC Amb10067118 [0,2,0,0,0,0|0,0,2]=4 383 B15R0.366 CCCCCCCCNCCC(=O)OCC Amb20673293 [0,2,0,0,0,0|1,0,0]=3 384 B15R0.366 CCCCCCCCSCCC(=O)OCC Amb1032998 [0,2,0,0,0,0|1,0,0]=3 385 B15R0.366 CCOC(=O)CCCCCCCCCCBr Amb22232003 [0,2,0,0,0,0|1,0,0]=3 386 B15R0.3221 CCCCCCCCCC(C)NC(=O)CCl Amb22345963 [0,2,0,0,0,0|2,0,0]=4 387 B15R0.3221 CCCCCCCCCC(O)CC(=O)OC Amb21928822 [0,2,0,0,0,0|0,0,0]=2 388 B15R0.3221 CCCCCCCCNC(C)CC(=O)OC Amb20673405 [0,2,0,0,0,0|1,0,0]=3 389 B15R0.3221 COC(=O)CC(C)NCCCOCCCC Amb20673370 [0,2,0,0,0,0|2,0,0]=4 390 B15R0.1626 CCCCCCCCCCC(C(=O)O)(C)C Amb10565362 [0,2,0,0,0,0|0,0,0]=2 391 B15R0.1626 [2H]C([2H])(CCCCCCCCCC)C(O)=O Amb21928683 [0,2,0,0,0,0|0,0,0]=2 392 B15R0.1997 CCCCCCCCCCC(CC)C(O)=O Amb24084099 [0,2,0,0,0,0|0,0,0]=2 393 B15R0.88 CCCCOCCCNC(=O)CCC(=O)O Amb1811797 [0,2,0,0,0,0|1,0,1]=4 394 B15R0.1927 CCCCCCC(NC(=O)CCC(=O)O)C Amb1795372 [0,2,0,0,0,0|1,0,1]=4 395 B15R0.69 CCCCCCCCCCC(O)CC(O)=O Amb21928762 [0,2,0,0,0,0|0,0,0]=2 396 B15R0.129 CCCCCOCC(=O)NCCCC(O)=O Amb24781007 [0,2,0,0,0,0|1,0,1]=4 397 B15R0.129 CCCCSCCC(=O)NCCCC(O)=O Amb24780777 [0,2,0,0,0,0|1,0,1]=4 398 B15R0.129 COCCCCNC(=O)CCCCC(O)=O Amb25394331 [0,2,0,0,0,0|1,0,1]=4 399 B15R0.164 C#CCCCCCCCCCCCC(O)=O Amb22642011 [0,2,0,0,0,0|0,0,0]=2 400 B15R0.164 CCCCCCCCCCCCCC(=C)Br Amb19886462 [0,2,0,0,0,0|2,0,0]=4 401 B15R0.164 CCCCCCCCCCCCCC(C)=C Amb19886459 [0,2,0,0,0,0|2,0,0]=4 402 B15R0.164 CCCCCCCCCCCCCC(C)=O Amb21962426 [0,2,0,0,0,0|1,0,0]=3 403 B15R0.164 CCCCCCCCCCCCCC([O-])=O Amb22348346 [0,2,0,0,0,0|0,0,1]=3 404 B15R0.164 CCCCCCCCCCCCCC([O-])=O Amb22730152 [0,2,0,0,0,0|0,0,1]=3 405 B15R0.164 CCCCCCCCCCCCC[13C](=O)Cl Amb22367510 [0,2,0,0,0,0|1,0,0]=3 406 B15R0.164 CCCCCCCCCCCCC[13C](O)=O Amb22351789 [0,2,0,0,0,0|0,0,0]=2 407 B15R0.164 CCCCCCCCCCCCNC(=O)C Amb10560436 [0,2,0,0,0,0|1,0,0]=3 408 B15R0.164 CCCCCCCCCCCCNC(N)=N Amb22168111 [0,2,0,0,0,0|2,0,0]=4 409 B15R0.164 CCCCCCCCCCCCNC(N)=N Amb22523280 [0,2,0,0,0,0|2,0,0]=4 410 B15R0.164 CCCCCCCCCCCCNC(N)=N Amb22729789 [0,2,0,0,0,0|2,0,0]=4 411 B15R0.164 CCCCCCCCCCCCOB(O)O Amb22489689 [0,2,0,0,0,0|1,0,1]=4 412 B15R0.164 CCCCCCCCCCCCOC(=O)Cl Amb22002629 [0,2,0,0,0,0|1,0,0]=3 413 B15R0.164 CCCCCCCCCCCCOC([S-])=S Amb22334179 [0,2,0,0,0,0|0,2,0]=4 414 B15R0.164 CCCCCCCCCCCCSC(=N)N Amb10669535 [0,2,0,0,0,0|2,0,0]=4 415 B15R0.164 CCCCCCCCCCCCSC(N)=N Amb22284269 [0,2,0,0,0,0|2,0,0]=4 416 B15R0.164 CCCCCCCCCCCC[13CH2][13C](O)=O Amb22338404 [0,2,0,0,0,0|0,0,0]=2 417 B15R0.164 CCCCCCCCCCCNCC(C)O Amb22340410 [0,2,0,0,0,0|1,0,1]=4 418 B15R0.164 CCCCCCCCCCNCCC(O)=O Amb20630815 [0,2,0,0,0,0|0,0,0]=2 419 B15R0.164 CCCCCCCCCCNCCC(O)=O Amb22059078 [0,2,0,0,0,0|0,0,0]=2 420 B15R0.164 CCCCCCCCCCSCCC(=O)O Amb1036580 [0,2,0,0,0,0|0,0,0]=2 421 B15R0.164 CCCCCCCCSCCCCC(=O)O Amb1038997 [0,2,0,0,0,0|0,0,0]=2 422 B15R0.164 CCCCCC\C=C\CCCCOC(C)=O Amb22730203 [0,2,0,0,0,0|1,0,1]=4 423 B15R0.164 CCCC\C=C\CCCCCCCC(O)=O Amb22350221 [0,2,0,0,0,0|0,0,0]=2 424 B15R0.164 CCCC\C=C\CCCCCCOC(C)=O Amb22734616 [0,2,0,0,0,0|1,0,1]=4 425 B15R0.164 CCC\C=C\CCCCCCCOC(=O)C Amb2223366 [0,2,0,0,0,0|1,0,1]=4 426 B15R0.164 CNCCCCCCCCCCCC(O)=O Amb22350069 [0,2,0,0,0,0|0,0,0]=2 427 B15R0.164 COCCOCCOCCOCCC(=O)O Amb16184419 [0,2,0,0,0,0|2,0,0]=4 428 B15R0.164 C\C=C\CCCCCCCCCOC(=O)C Amb10563793 [0,2,0,0,0,0|1,0,1]=4 429 B15R0.164 OCCCCCCCCCCCCC(O)=O Amb21935785 [0,2,0,0,0,0|0,0,0]=2 430 B15R0.164 ONCCCCCCCCCCCC(O)=O Amb22364339 [0,2,0,0,0,0|0,0,0]=2 431 B15R0.164 [13CH3]CCCCCCCCCCCCC(O)=O Amb22367443 [0,2,0,0,0,0|0,0,0]=2 432 B15R0.222 C=C(F)CCCCCCCCCCC(O)=O Amb22547618 [0,2,0,0,0,0|0,0,1]=3 433 B15R0.222 CC(C)CCCCCCCCCCC(O)=O Amb19747078 [0,2,0,0,0,0|0,0,0]=2 434 B15R0.222 OC(=O)CCCCCCCCCCC(O)=O Amb22336590 [0,2,0,0,0,0|0,0,1]=3 435 B15R0.222 O[13C](=O)[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](=O)O Amb17613553 [0,2,0,0,0,0|0,0,1]=3 436 B15R0.222 [O-]C(=O)CCCCCCCCCCC([O-])=O Amb22168125 [0,2,0,0,0,0|0,0,2]=4 437 B13R1.28 CCCCCCCC1CCCCC1 Amb21618900 [1,0,0,1,0,0|1,0,1]=4 438 B13R1.28 O=CCCCC#CC1CCCCC1 Amb24722872 [1,0,0,1,0,0|0,0,2]=4 439 B13R1.119 CCCCCCCCC1OCCO1 Amb22364938 [1,0,0,1,0,0|1,0,1]=4 440 B13R1.119 O=CCCCCCCC1OCCO1 Amb24490278 [1,0,0,1,0,0|2,0,0]=4 441 B13R1.154 CCCOC1CCCCCCC1O Amb19075956 [1,0,0,1,0,0|1,0,1]=4 442 B13R1.154 CNCCN1CCCCCCC1=O Amb18977649 [1,0,0,1,0,0|2,0,0]=4 443 B13R1.154 O=C1CCCCCCN1CCCS Amb25792227 [1,0,0,1,0,0|2,0,0]=4 444 B13R1.154 O=CCCC1CCCCCCC1=O Amb25190625 [1,0,0,1,0,0|1,0,1]=4 445 B13R1.154 OCCCC1CCCCCCC1=O Amb24457861 [1,0,0,1,0,0|1,0,0]=3 446 B13R1.203 N[C@@H]1CCCCCCCCC[C@H]1O Amb24553817 [1,0,0,1,0,0|1,0,1]=4 447 B13R1.203 O=C1CCCCCCCCCC1Cl Amb24561040 [1,0,0,1,0,0|1,0,0]=3 448 B13R1.203 OC1CCCCCCCCCC1O Amb25680531 [1,0,0,1,0,0|1,0,1]=4 449 B13R1.229 OCCN1CCCCCCCCC1 Amb25317623 [1,0,0,1,0,0|1,0,1]=4 450 B13R1.279 NC1CCCCCCCCCCC1 Amb1116041 [1,0,0,1,0,0|1,0,1]=4 451 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [1,0,0,1,0,0|0,0,0]=2 452 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [1,0,0,1,0,0|1,0,0]=3 453 B13R1.279 O=C1NCCCCCCCCCN1 Amb24616274 [1,0,0,1,0,0|2,0,0]=4 454 B13R1.279 OC1CCCCCCCCCCO1 Amb24495296 [1,0,0,1,0,0|1,0,1]=4 455 B13R1.378 NCCN1CCCCCCCC1=O Amb24650951 [1,0,0,1,0,0|2,0,0]=4 456 B13R1.489 O=CCCN1CCCCCCCC1 Amb24411095 [1,0,0,1,0,0|1,0,0]=3 457 B13R1.555 CCCCC#CC1CCCCC1=O Amb24434562 [1,0,0,1,0,0|0,0,2]=4 458 B13R1.555 CCCCCCC1CCCCC1=O Amb19045128 [1,0,0,1,0,0|0,0,0]=2 459 B13R1.579 CCCCN1CCCC1CCCO Amb19075562 [1,0,0,1,0,0|1,0,1]=4 460 B13R1.603 C=CC1CCCCCCCCC1=O Amb25287600 [1,0,0,1,0,0|0,0,2]=4 461 B13R1.603 N#CC1CCCCCCCCC1=O Amb24494980 [1,0,0,1,0,0|1,0,1]=4 462 B13R1.603 O=CC1CCCCCCCCC1=O Amb25287227 [1,0,0,1,0,0|1,0,1]=4 463 B13R1.603 O=CC1CCCCCCCCC1Cl Amb24469324 [1,0,0,1,0,0|1,0,0]=3 464 B13R1.623 CNC1CCCCCCCCCC1 Amb24595964 [1,0,0,1,0,0|2,0,0]=4 465 B13R1.623 NCC1CCCCCCCCCC1 Amb25311610 [1,0,0,1,0,0|1,0,1]=4 466 B13R1.623 O=CC1CCCCCCCCC=C1 Amb24706997 [1,0,0,1,0,0|0,0,2]=4 467 B13R1.654 CCCCC#CCC1CCCC1=O Amb25729111 [1,0,0,1,0,0|0,0,2]=4 468 B13R1.654 CCCCCCCC1CCOC1=O Amb22230225 [1,0,0,1,0,0|1,0,0]=3 469 B13R1.654 CCCCCCCN1CCCC1=O Amb20621393 [1,0,0,1,0,0|1,0,0]=3 470 B13R1.659 CCCCCCCCCC[C@@H]1CO1 Amb22353251 [1,0,0,1,0,0|0,0,1]=3 471 B13R1.659 CCCCCCCCCC[C@H]1CS1 Amb22367103 [1,0,0,1,0,0|0,1,1]=4 472 B13R1.1150 O=CNCCC1CCCCCCC1 Amb25195820 [1,0,0,1,0,0|1,0,0]=3 473 B13R1.1887 CCCCCCC1CCCCCN1 Amb2235791 [1,0,0,1,0,0|1,0,1]=4 474 B13R1.2883 C1CCCCCCCCCCCC1 Amb22230504 [1,0,0,1,0,0|1,0,1]=4 475 B13R1.6 CC\C=C/CCC1CCCC(=O)O1 Amb22734229 [1,0,0,1,0,0|0,0,2]=4 476 B13R1.27 CCCCCCCC1CCC(=O)O1 Amb1154110 [1,0,0,1,0,0|0,0,0]=2 477 B13R1.90 CCC1CCCCN1CCC(=O)Cl Amb17143287 [1,0,0,1,0,0|2,0,0]=4 478 B13R1.90 CCC1CCCCN1CCC(O)=O Amb21955365 [1,0,0,1,0,0|1,0,0]=3 479 B13R1.90 OCC1CCCCN1CCC(O)=O Amb19076440 [1,0,0,1,0,0|2,0,0]=4 480 B13R1.158 CC1CCCCC1CCNC(N)=O Amb25246447 [1,0,0,1,0,0|2,0,0]=4 481 B13R1.158 CC1CSCCN1CCCC(O)=O Amb24768864 [1,0,0,1,0,0|2,0,0]=4 482 B13R1.158 CN1CCCCC1CNCC(O)=O Amb18313080 [1,0,0,1,0,0|2,0,0]=4 483 B13R1.158 OC(=O)CCCC1CCCCC1=O Amb17594755 [1,0,0,1,0,0|1,0,1]=4 484 B13R1.224 C#CCC1CCCCCC1C(O)=O Amb25369715 [1,0,0,1,0,0|0,0,2]=4 485 B13R1.224 CCCC1CCCCCC1C(O)=O Amb24377494 [1,0,0,1,0,0|0,0,0]=2 486 B13R1.224 CCSC1CCCCCC1C(O)=O Amb18303070 [1,0,0,1,0,0|1,0,0]=3 487 B13R1.226 OCCC1CCCCCCC(=O)O1 Amb25284567 [1,0,0,1,0,0|1,0,0]=3 488 B13R1.280 CC1CCCCCC1NCC(N)=O Amb24667329 [1,0,0,1,0,0|2,0,0]=4 489 B13R1.280 CC1CCCCCC1NCC(O)=O Amb24466628 [1,0,0,1,0,0|1,0,0]=3 490 B13R1.280 CC1CCCCCN1CCC(C)=O Amb24385394 [1,0,0,1,0,0|2,0,0]=4 491 B13R1.280 CC1CCCCCN1CCC(N)=O Amb25098032 [1,0,0,1,0,0|2,0,0]=4 492 B13R1.280 CC1CCOCCN1CCC(O)=O Amb25356852 [1,0,0,1,0,0|2,0,0]=4 493 B13R1.280 CC1CCSCCN1CCC(O)=O Amb25204492 [1,0,0,1,0,0|2,0,0]=4 494 B13R1.280 CC=1CCCCCC1CCC(O)=O Amb24391509 [1,0,0,1,0,0|0,0,2]=4 495 B13R1.280 CN1CCCCCC1CCC(O)=O Amb18191306 [1,0,0,1,0,0|1,0,0]=3 496 B13R1.280 OC(=O)CCC1CCCCCC1=O Amb18822898 [1,0,0,1,0,0|1,0,1]=4 497 B13R1.283 OC(=O)CC1CCCCCCC1=O Amb25187867 [1,0,0,1,0,0|1,0,1]=4 498 B13R1.337 NC(=O)CNCCC1CCCCC1 Amb13952496 [1,0,0,1,0,0|2,0,0]=4 499 B13R1.337 OC(=O)CCCCC1CCCCC1 Amb22336378 [1,0,0,1,0,0|0,0,0]=2 500 B13R1.337 OC(=O)CCCCN1CCCCC1 Amb19373622 [1,0,0,1,0,0|1,0,0]=3 501 B13R1.337 OC(=O)CCCCN1CCNCC1 Amb17479004 [1,0,0,1,0,0|2,0,0]=4 502 B13R1.337 OC(=O)CCCSC1CCNCC1 Amb17502196 [1,0,0,1,0,0|2,0,0]=4 503 B13R1.337 OC(=O)COCCC1CCCCN1 Amb18628209 [1,0,0,1,0,0|2,0,0]=4 504 B13R1.343 OC(=O)CCCCCC1CCSS1 Amb17614989 [1,0,0,1,0,0|2,0,0]=4 505 B13R1.343 OC(=O)CCCCCC1OCCO1 Amb25124123 [1,0,0,1,0,0|2,0,0]=4 506 B13R1.343 OC(=O)CNCCCN1CCCC1 Amb19058449 [1,0,0,1,0,0|2,0,0]=4 507 B13R1.380 CCCC1CCCCC1CC(O)=O Amb22339365 [1,0,0,1,0,0|0,0,0]=2 508 B13R1.380 CCCN1CCCCC1CC(O)=O Amb18304879 [1,0,0,1,0,0|1,0,0]=3 509 B13R1.380 CCOC1CCCCC1CC(O)=O Amb18191219 [1,0,0,1,0,0|1,0,0]=3 510 B13R1.380 COCC1CCCCN1CC(O)=O Amb21865524 [1,0,0,1,0,0|2,0,0]=4 511 B13R1.392 CSCC1CCCN1CCC(O)=O Amb24769710 [1,0,0,1,0,0|2,0,0]=4 512 B13R1.486 OCCCC1CCCCCC(=O)N1 Amb18191307 [1,0,0,1,0,0|2,0,0]=4 513 B13R1.486 OCCCC1CCCCCC(=O)O1 Amb24569922 [1,0,0,1,0,0|1,0,0]=3 514 B13R1.572 CC#CCC1CCCCC1C(O)=O Amb25838065 [1,0,0,1,0,0|0,0,2]=4 515 B13R1.572 CCCCN1CCCCC1C(=O)O Amb13886354 [1,0,0,1,0,0|1,0,0]=3 516 B13R1.572 CCCCN1CCCCC1C(=O)O Amb2382770 [1,0,0,1,0,0|1,0,0]=3 517 B13R1.572 CCCCN1CCOCC1C(O)=O Amb24271291 [1,0,0,1,0,0|2,0,0]=4 518 B13R1.610 CCC1CCCCCC1NC(=O)C Amb2227899 [1,0,0,1,0,0|2,0,0]=4 519 B13R1.610 CCC1CCCCCN1CC(N)=O Amb25090150 [1,0,0,1,0,0|2,0,0]=4 520 B13R1.610 CCC1CCCCCN1CC(O)=O Amb24349311 [1,0,0,1,0,0|1,0,0]=3 521 B13R1.610 CCN1CCCCCC1CC(C)=O Amb24472004 [1,0,0,1,0,0|2,0,0]=4 522 B13R1.610 CC[C@@H]1CCCCC[C@@H]1NC(C)=O Amb24560969 [1,0,0,1,0,0|2,0,0]=4 523 B13R1.610 CC[C@@H]1NCCCC[C@H]1CC(O)=O Amb18191310 [1,0,0,1,0,0|1,0,0]=3 524 B13R1.610 COC1CCCCCC1CC(O)=O Amb18822015 [1,0,0,1,0,0|1,0,0]=3 525 B13R1.610 OCC1CCCCCC1CC(O)=O Amb25101626 [1,0,0,1,0,0|1,0,0]=3 526 B13R1.610 OCC1CCCCCN1CC(O)=O Amb25696335 [1,0,0,1,0,0|2,0,0]=4 527 B13R1.614 CCC1CCCCCCC1C(O)=O Amb24710104 [1,0,0,1,0,0|0,0,0]=2 528 B13R1.670 CC#CCCC1CCCC1C(O)=O Amb24471231 [1,0,0,1,0,0|0,0,2]=4 529 B13R1.670 CCSCCN1CCCC1C(O)=O Amb24769161 [1,0,0,1,0,0|2,0,0]=4 530 B13R1.670 CCSCCN1CCC[C@H]1C(O)=O Amb24769158 [1,0,0,1,0,0|2,0,0]=4 531 B13R1.1009 NC(=O)C1CCCCNCCCC1 Amb24461661 [1,0,0,1,0,0|2,0,0]=4 532 B13R1.1009 OC(=O)C1CCC=CCCCCC1 Amb25039409 [1,0,0,1,0,0|0,0,2]=4 533 B13R1.1009 OC(=O)C1CCCCCCCCC1 Amb25061287 [1,0,0,1,0,0|0,0,0]=2 534 B13R1.1009 OC(=O)C1CCCCNCCCC1 Amb24365928 [1,0,0,1,0,0|1,0,0]=3 535 B13R1.1009 OC(=O)C=1CCCCCCCCC1 Amb24711230 [1,0,0,1,0,0|0,0,2]=4 536 B13R1.1022 CC(=O)CCC1CCCCCCC1 Amb25120339 [1,0,0,1,0,0|1,0,0]=3 537 B13R1.1022 CC(=O)NCC1CCCCCCC1 Amb24072669 [1,0,0,1,0,0|2,0,0]=4 538 B13R1.1022 CC(O)CCC1CCCCCCC1 Amb25260363 [1,0,0,1,0,0|1,0,1]=4 539 B13R1.1022 NC(=O)CCN1CCCCCCC1 Amb18328558 [1,0,0,1,0,0|2,0,0]=4 540 B13R1.1022 NC(=O)CNC1CCCCCCC1 Amb1113527 [1,0,0,1,0,0|2,0,0]=4 541 B13R1.1022 NC(=O)NCC1CCCCCCC1 Amb25163666 [1,0,0,1,0,0|2,0,0]=4 542 B13R1.1022 OC(=O)C#CC1CCCCCCC1 Amb25332789 [1,0,0,1,0,0|0,0,2]=4 543 B13R1.1022 OC(=O)CCN1CCCCCCC1 Amb21955684 [1,0,0,1,0,0|1,0,0]=3 544 B13R1.1022 OC(=O)CCN1CCSCCCC1 Amb23596973 [1,0,0,1,0,0|2,0,0]=4 545 B13R1.1022 OC(=O)CSC1CCCCCCC1 Amb25725888 [1,0,0,1,0,0|1,0,0]=3 546 B13R1.1022 OC(=O)\C=C\C1CCCCCCC1 Amb24397482 [1,0,0,1,0,0|0,0,2]=4 547 B13R1.1107 OC(=O)CC1CCCCCCCC1 Amb25279551 [1,0,0,1,0,0|0,0,0]=2 548 B13R1.1107 OC(=O)CN1CCCCCCCC1 Amb25169064 [1,0,0,1,0,0|1,0,0]=3 549 B13R1.1988 OC(=O)CCCN1CCCCCC1 Amb10072744 [1,0,0,1,0,0|1,0,0]=3 550 B13R1.2433 CCCCCCCC1CC1B(O)O Amb24329636 [1,0,0,1,0,0|1,0,1]=4 551 B13R1.3816 CN1CCCCCCCC1C(O)=O Amb25365310 [1,0,0,1,0,0|1,0,0]=3 552 B13R1.3816 NC1CCCCCCCC1C(O)=O Amb24436959 [1,0,0,1,0,0|1,0,0]=3 553 B15R1.503 O=C(CCC1CCCC1)NCCC(=O)O Amb1137305 [0,1,0,1,0,0|1,0,1]=4 554 B15R1.1081 CN(CC1CCCCC1)CCCC(O)=O Amb24771174 [0,1,0,1,0,0|1,0,0]=3 555 B15R1.1081 CN(CC1CCCCO1)CCCC(O)=O Amb24771087 [0,1,0,1,0,0|2,0,0]=4 556 B15R1.1081 O=C(NC1CCCCC1)CCCC(=O)O Amb1863935 [0,1,0,1,0,0|1,0,1]=4 557 B15R1.1159 CC1CC(CCC#CC)C(CC1)C(O)=O Amb25717049 [0,1,0,1,0,0|0,0,2]=4 558 B15R1.8019 CC1CCCCC1C(C)NCCC(O)=O Amb25634468 [0,1,0,1,0,0|1,0,0]=3 559 B15R1.8019 CC1CCCCC1N(C)CCCC(O)=O Amb24771479 [0,1,0,1,0,0|1,0,0]=3 560 B15R1.31246 O=C(N1CCCCCC1)CCCC(=O)O Amb1119287 [0,1,0,1,0,0|1,0,1]=4 561 B15R1.31246 OC(=O)CCNC(=O)C1CCCCCC1 Amb19025823 [0,1,0,1,0,0|1,0,1]=4 562 B15R1.5914 CN(C)CC1CCCCN1CCC(O)=O Amb19361590 [0,1,0,1,0,0|2,0,0]=4 563 B15R1.8882 CC(C)CCCN1CCCCC1C(O)=O Amb25390500 [0,1,0,1,0,0|1,0,0]=3 564 B15R1.8882 CC(C)OCCN1CCCCC1C(O)=O Amb24771024 [0,1,0,1,0,0|2,0,0]=4 565 B15R1.8882 CN(CCCN1CCCCC1C(=O)O)C Amb17561235 [0,1,0,1,0,0|2,0,0]=4 566 B15R1.8894 CC(C)CC1CCCCCN1CC(O)=O Amb24186789 [0,1,0,1,0,0|1,0,0]=3 567 B15R1.8894 CC(C)C[C@@H]1NCCCC[C@H]1CC(O)=O Amb18771359 [0,1,0,1,0,0|1,0,0]=3 568 B15R1.12256 CC(C)CN1CCCCCCC1C(O)=O Amb25313839 [0,1,0,1,0,0|1,0,0]=3 569 B15R1.3890 OS(=O)(=O)CCCCNC1CCCCC1 Amb22264863 [0,1,0,1,0,0|2,0,0]=4 570 B15R1.504 CC(=O)NCCCCCN1CCCCC1 Amb16898208 [0,1,0,1,0,0|2,0,0]=4 571 B15R1.504 OC(=O)CCNCCCC1CCCCC1 Amb25617474 [0,1,0,1,0,0|0,0,0]=2 572 B15R1.504 OC(=O)CCNCCCN1CCCCC1 Amb20573470 [0,1,0,1,0,0|1,0,0]=3 573 B15R1.1239 CCCNC(=O)C1CCCCC1C(=O)O Amb1901784 [0,1,0,1,0,0|1,0,1]=4 574 B15R1.1246 CCCCC(=O)N1CCCC1CC(O)=O Amb24770893 [0,1,0,1,0,0|1,0,1]=4 575 B15R1.9080 OC(=O)CCCCCNC(=O)C1CCC1 Amb1130271 [0,1,0,1,0,0|1,0,1]=4 576 B15R1.1405 CCCCCC(=O)N1CCC[C@@H]1C(O)=O Amb25388349 [0,1,0,1,0,0|1,0,1]=4 577 B15R1.8290 CC1CCCC(C)N1CCCCC(O)=O Amb25388897 [0,1,0,1,0,0|1,0,0]=3 578 B15R1.8958 OC(=O)CCNCCC1CCCCCC1 Amb25617443 [0,1,0,1,0,0|0,0,0]=2 579 B15R1.8958 OC(=O)CCNCCN1CCCCCC1 Amb20573203 [0,1,0,1,0,0|1,0,0]=3 580 B15R1.8958 OC(=O)CCSCCN1CCCCCC1 Amb21988845 [0,1,0,1,0,0|1,0,0]=3 581 B15R1.8958 OC(=O)CNCCCN1CCCCCC1 Amb20573289 [0,1,0,1,0,0|1,0,0]=3 582 B15R1.9022 OC(=O)CCCCNC(=O)CC1CCC1 Amb24773519 [0,1,0,1,0,0|1,0,1]=4 583 B15R1.9023 OC(=O)CCCCNC(=O)CCC1CC1 Amb25391847 [0,1,0,1,0,0|1,0,1]=4 584 B15R1.10724 CCCCN1C(CCC1=O)CCC(O)=O Amb23541270 [0,1,0,1,0,0|1,0,1]=4 585 B15R1.12845 CC1CN(CCCC(O)=O)C(CO1)CC Amb24771064 [0,1,0,1,0,0|2,0,0]=4 586 B15R1.123 CC1CCCN(CCCCC(O)=O)C1C Amb24772535 [0,1,0,1,0,0|1,0,0]=3 587 B15R1.871 CN1CCN(CCCCCC(O)=O)CC1 Amb22490301 [0,1,0,1,0,0|2,0,0]=4 588 B15R1.985 CCC(=O)N1CCCCC1CCC(O)=O Amb18309598 [0,1,0,1,0,0|1,0,1]=4 589 B15R1.11398 CCC(=O)NC1CCCCCC1C(O)=O Amb24638555 [0,1,0,1,0,0|1,0,1]=4 590 B15R1.11715 CC(CC)N1CCCCCCC1C(O)=O Amb25213038 [0,1,0,1,0,0|1,0,0]=3 591 B15R1.11715 CC(CO)N1CCCCCCC1C(O)=O Amb25030925 [0,1,0,1,0,0|2,0,0]=4 592 B15R1.11715 CCC(=O)N1CCCCCCC1C(O)=O Amb24527165 [0,1,0,1,0,0|1,0,1]=4 593 B15R1.11715 CCS(=O)N1CCCCCCC1C(O)=O Amb25241926 [0,1,0,1,0,0|2,0,0]=4 594 B15R1.273 CCSC1CCCCC1NCC(=O)OC Amb24186831 [0,1,0,1,0,0|2,0,0]=4 595 B15R1.962 COC(=O)CCCSCC1CCCNC1 Amb17503128 [0,1,0,1,0,0|2,0,0]=4 596 B15R1.962 COC(=O)CCCSCC1CCNCC1 Amb17503029 [0,1,0,1,0,0|2,0,0]=4 597 B15R1.962 COC(=O)CCOCCC1CCCCN1 Amb21957247 [0,1,0,1,0,0|2,0,0]=4 598 B15R1.962 COC(=O)CCOCCC1CCCNC1 Amb21957236 [0,1,0,1,0,0|2,0,0]=4 599 B15R1.962 COC(=O)CCOCCC1CCNCC1 Amb21957246 [0,1,0,1,0,0|2,0,0]=4 600 B15R1.962 COC(=O)CCSCCC1CCCCN1 Amb22395656 [0,1,0,1,0,0|2,0,0]=4 601 B15R1.6326 CCCCCCCCC1CC1C(=O)NO Amb1077218 [0,1,0,1,0,0|0,0,0]=2 602 B15R1.15405 C#CC1(O)CCCCCCCCCCC1 Amb1779893 [0,1,0,1,0,0|1,0,1]=4 603 B15R1.15405 COC1(C)CCCCCCCCCCC1 Amb22731553 [0,1,0,1,0,0|1,0,1]=4 604 B15R1.3664 CC(CNCCN1CCCCC1)C(O)=O Amb20573380 [0,1,0,1,0,0|2,0,0]=4 605 B15R1.3664 CC(NCCCC1CCCCC1)C(O)=O Amb25617537 [0,1,0,1,0,0|1,0,0]=3 606 B15R1.3664 C[C@@H](NCCCC1CCCCC1)C(O)=O Amb25617534 [0,1,0,1,0,0|1,0,0]=3 607 B15R1.3664 C[C@H](NCCCC1CCCCC1)C(O)=O Amb25617535 [0,1,0,1,0,0|1,0,0]=3 608 B15R1.3670 CC(CNCCCN1CCCC1)C(O)=O Amb20573222 [0,1,0,1,0,0|2,0,0]=4 609 B15R1.9036 CC(=O)C1CCCCCCCCCCC1 Amb1033011 [0,1,0,1,0,0|1,0,0]=3 610 B15R1.9036 OC(=O)C1CCCCCCCCCCC1 Amb22347939 [0,1,0,1,0,0|0,0,0]=2 611 B15R1.15940 CC(NCCC1CCCCCC1)C(O)=O Amb25617468 [0,1,0,1,0,0|1,0,0]=3 612 B15R1.15940 CC(SCCN1CCCCCC1)C(O)=O Amb21988839 [0,1,0,1,0,0|2,0,0]=4 613 B15R1.15940 C[C@@H](NCCC1CCCCCC1)C(O)=O Amb25617467 [0,1,0,1,0,0|1,0,0]=3 614 B15R1.15940 C[C@H](NCCC1CCCCCC1)C(O)=O Amb25617426 [0,1,0,1,0,0|1,0,0]=3 615 B15R1.16044 C=C(CN1CCCCCCCC1)C(O)=O Amb25067045 [0,1,0,1,0,0|1,0,1]=4 616 B15R1.16044 CC(CN1CCCCCCCC1)C(O)=O Amb25793670 [0,1,0,1,0,0|1,0,0]=3 617 B15R1.16044 NC(CN1CCCCCCCC1)C(N)=O Amb25087297 [0,1,0,1,0,0|2,0,0]=4 618 B15R1.16044 NC(CN1CCCCCCCC1)C(O)=O Amb25169069 [0,1,0,1,0,0|1,0,0]=3 619 B15R1.256 CC1CCCCC1CN(C)CCC(O)=O Amb25617334 [0,1,0,1,0,0|1,0,0]=3 620 B15R1.559 CSCCCN1CC[C@@H](O)C[C@H]1C(O)=O Amb22775130 [0,1,0,1,0,0|2,0,0]=4 621 B15R1.5919 CN(CCC(=O)O)CCN1CCCCC1 Amb17561234 [0,1,0,1,0,0|2,0,0]=4 622 B15R1.12292 OC(=O)CNC(=O)CCCC1CCCC1 Amb25391927 [0,1,0,1,0,0|1,0,1]=4 623 B15R1.16735 CN(CCC(O)=O)C1CCCCCCC1 Amb18615907 [0,1,0,1,0,0|1,0,0]=3 624 B15R1.16735 OC(=O)CNC(=O)C1CCCCCCC1 Amb25114577 [0,1,0,1,0,0|1,0,1]=4 625 B15R1.5503 CC(CC(O)=O)NCCCN1CCCC1 Amb20573440 [0,1,0,1,0,0|2,0,0]=4 626 B15R1.5741 CC1CCCCCC1NC(=O)CC(O)=O Amb25029815 [0,1,0,1,0,0|1,0,1]=4 627 B15R1.9084 CC(CC(O)=O)NCCN1CCCCC1 Amb20414301 [0,1,0,1,0,0|2,0,0]=4 628 B15R1.9084 CN(CC(O)=O)CCCC1CCCCC1 Amb25617513 [0,1,0,1,0,0|1,0,0]=3 629 B15R1.22526 OC(=O)CC(=O)N1CCCCCCCC1 Amb25684866 [0,1,0,1,0,0|1,0,1]=4 630 B15R1.22532 CN(CC(O)=O)CCC1CCCCCC1 Amb25617442 [0,1,0,1,0,0|1,0,0]=3 631 B15R1.22585 OC(=O)CC(=O)NC1CCCCCCC1 Amb18987411 [0,1,0,1,0,0|1,0,1]=4 632 B15R1.106 CCCCCCCCC1CCCC(=O)O1 Amb22732769 [0,1,0,1,0,0|0,0,0]=2 633 B15R1.241 COCCCCN1CCCCC1C(O)=O Amb25391481 [0,1,0,1,0,0|1,0,0]=3 634 B15R1.3525 OCCCCCCN1CCCC1C(O)=O Amb25389707 [0,1,0,1,0,0|1,0,0]=3 635 B15R1.3525 OCCCCCCN1CCC[C@H]1C(O)=O Amb25389692 [0,1,0,1,0,0|1,0,0]=3 636 B15R1.8920 OC(=O)CCCCN1CCCCCCC1 Amb25388898 [0,1,0,1,0,0|0,0,0]=2 637 B15R1.9199 CCCCCCCCCCCC[C@@H]1CO1 Amb22369735 [0,1,0,1,0,0|1,0,1]=4 638 B15R1.9199 CCCCCCCCCCOCC1CO1 Amb22337870 [0,1,0,1,0,0|1,0,1]=4 639 B15R1.10901 N#CCCN1CCCCCCC1C(O)=O Amb25030828 [0,1,0,1,0,0|1,0,1]=4 640 B15R1.820 CC(CCC)C1CCCN1CCC(O)=O Amb24186790 [0,1,0,1,0,0|1,0,0]=3 641 B15R1.1274 CC(CCC)CN1CCCCC1C(O)=O Amb24772662 [0,1,0,1,0,0|1,0,0]=3 642 B15R1.497 CN(CCCCC(O)=O)C1CCCCC1 Amb25388896 [0,1,0,1,0,0|1,0,0]=3 643 B15R1.497 O=C(C1CCCCC1)NCCCC(=O)O Amb1112140 [0,1,0,1,0,0|1,0,1]=4 644 B15R1.507 O=C(CC1CCCC1)NCCCC(=O)O Amb1114159 [0,1,0,1,0,0|1,0,1]=4 645 B15R1.3995 CCCCCC1C(CCC1=O)CC(=O)O Amb10843401 [0,1,0,1,0,0|0,0,1]=3 646 B15R1.3995 CC\C=C/C[C@@H]1[C@H](CC(O)=O)CC[C@H]1O Amb22801093 [0,1,0,1,0,0|0,0,2]=4 647 B15R1.3995 CC\C=C\CC1C(CC(O)=O)CCC1O Amb22489634 [0,1,0,1,0,0|0,0,2]=4 648 B15R1.8158 CC1CC1CNC(=O)CCCCC(O)=O Amb25391683 [0,1,0,1,0,0|1,0,1]=4 649 B15R2.20 CCC1CCCCC12CC(=O)CCO2 Amb25314086 [0,0,0,2,0,0|2,0,0]=4 650 B15R2.31 N=C1CCCC(CC2CCCCC2)N1 Amb25797762 [0,0,0,2,0,0|2,0,0]=4 651 B15R2.31 O=C1CC(CC2CCCCC2)CCC1 Amb25087460 [0,0,0,2,0,0|1,0,0]=3 652 B15R2.31 O=C1CC(CC2CCOCC2)CCC1 Amb25736506 [0,0,0,2,0,0|2,0,0]=4 653 B15R2.31 O=C1COCC(CC2CCCCC2)N1 Amb25166025 [0,0,0,2,0,0|2,0,0]=4 654 B15R2.31 O=C1COC[C@@H](CC2CCCCC2)N1 Amb25311307 [0,0,0,2,0,0|2,0,0]=4 655 B15R2.31 O=C1COC[C@H](CC2CCCCC2)N1 Amb24347352 [0,0,0,2,0,0|2,0,0]=4 656 B15R2.332 CC1CCCCN1C2CC(=O)CCC2 Amb24438150 [0,0,0,2,0,0|2,0,0]=4 657 B15R2.1117 O=C1CC(CCC1)CCC2COCC2 Amb24597919 [0,0,0,2,0,0|2,0,0]=4 658 B15R2.1117 O=C1CC(CCC2CCCO2)CCC1 Amb25830629 [0,0,0,2,0,0|2,0,0]=4 659 B15R2.1117 O=C1CCCC(CCC2CCCC2)=C1 Amb25190693 [0,0,0,2,0,0|1,0,1]=4 660 B15R2.1117 O=C1CCCC(CNC2CCCC2)N1 Amb24393862 [0,0,0,2,0,0|2,0,0]=4 661 B15R2.2188 COC1CCCC1C2CC(=O)CCC2 Amb24685518 [0,0,0,2,0,0|2,0,0]=4 662 B15R2.7124 O=C1CC(CCC1)C2CCCCCC2 Amb25827991 [0,0,0,2,0,0|1,0,0]=3 663 B15R2.7124 O=C1CC(OCC1)C2CCCCCC2 Amb24613272 [0,0,0,2,0,0|2,0,0]=4 664 B15R2.7124 O=C1CCCC(=C1)C2CCCCCC2 Amb25096985 [0,0,0,2,0,0|1,0,1]=4 665 B15R2.7124 O=C1CCCN(C1)C2CCCCCC2 Amb10603082 [0,0,0,2,0,0|2,0,0]=4 666 B15R2.7124 OC1CC(CCC1)C2CCCCCC2 Amb25812239 [0,0,0,2,0,0|1,0,1]=4 667 B15R2.11929 CCCC1CCCC2CCNC(=O)C21 Amb25114013 [0,0,0,2,0,0|2,0,0]=4 668 B15R2.13221 C=C1C[C@@H]2C[C@H](C1)CCCCCCC2 Amb24417098 [0,0,0,2,0,0|2,0,0]=4 669 B15R2.13221 OC1CC2CC(C1)CCCCCCC2 Amb24500735 [0,0,0,2,0,0|1,0,1]=4 670 B15R2.13221 O[C@@H]1C[C@@H]2C[C@H](C1)CCCCCCC2 Amb24430131 [0,0,0,2,0,0|1,0,1]=4 671 B15R2.6 NC(=O)CCN1CC[C@@H]2CCCC[C@H]12 Amb25213301 [0,0,0,2,0,0|2,0,0]=4 672 B15R2.6 OC(=O)CCC1CCC2CCCCC12 Amb25312671 [0,0,0,2,0,0|0,0,0]=2 673 B15R2.6 OC(=O)CNC1CCN2CCCCC21 Amb18978710 [0,0,0,2,0,0|2,0,0]=4 674 B15R2.627 CC1C(CCC2CCCCN21)C(O)=O Amb25102537 [0,0,0,2,0,0|1,0,0]=3 675 B15R2.627 OC1C2CCCCC2CCC1C(O)=O Amb25684745 [0,0,0,2,0,0|1,0,0]=3 676 B15R2.1668 CC(=O)N[C@@H]1C[C@H]2CCCC[C@H]2CC1 Amb25269543 [0,0,0,2,0,0|2,0,0]=4 677 B15R2.1668 CC(=O)N[C@H]1C[C@H]2CCCC[C@@H]2CC1 Amb25224409 [0,0,0,2,0,0|2,0,0]=4 678 B15R2.1668 CC(=O)OC1C[C@H]2CCCC[C@@H]2CC1 Amb24594803 [0,0,0,2,0,0|2,0,0]=4 679 B15R2.1668 NC(=O)CN1CCC2C(C1)CCCC2 Amb10683307 [0,0,0,2,0,0|2,0,0]=4 680 B15R2.1668 OC(=O)CC1CC2CCCCC2CC1 Amb24373950 [0,0,0,2,0,0|0,0,0]=2 681 B15R2.1668 OC(=O)CC1CC2CCCCC2CN1 Amb25036731 [0,0,0,2,0,0|1,0,0]=3 682 B15R2.1668 OC(=O)CC1CC2COCCN2CC1 Amb18811233 [0,0,0,2,0,0|2,0,0]=4 683 B15R2.1668 OC(=O)CC1CC2CSCCN2CC1 Amb18170833 [0,0,0,2,0,0|2,0,0]=4 684 B15R2.1668 OC(=O)CC1CCC2CCCCC2O1 Amb25363486 [0,0,0,2,0,0|1,0,0]=3 685 B15R2.1668 OC(=O)CC1CN2CCCCC2CN1 Amb18811724 [0,0,0,2,0,0|2,0,0]=4 686 B15R2.1668 OC(=O)CC=1C[C@H]2CCCC[C@@H]2CC1 Amb25212592 [0,0,0,2,0,0|0,0,2]=4 687 B15R2.1668 OC(=O)C[C@@H]1C[C@H]2CCCC[C@@H]2CC1 Amb24711360 [0,0,0,2,0,0|0,0,0]=2 688 B15R2.1668 OC(=O)C[C@H]1C[C@H]2CCCC[C@@H]2CN1 Amb25362072 [0,0,0,2,0,0|1,0,0]=3 689 B15R2.1668 OC(=O)\C=C\1/CC2CCCCC2CC1 Amb25207818 [0,0,0,2,0,0|0,0,2]=4 690 B15R2.2189 CCC1CCCCC1C2CC(=O)NC2 Amb25352838 [0,0,0,2,0,0|2,0,0]=4 691 B15R2.2189 CCC1CCCCC1C=2CCC(=O)C2 Amb24697451 [0,0,0,2,0,0|1,0,1]=4 692 B15R2.2189 CCC1CCCCC1N2CC(=O)CC2 Amb19052764 [0,0,0,2,0,0|2,0,0]=4 693 B15R2.2189 CCC1CCCCN1C2CC(=O)CC2 Amb25734813 [0,0,0,2,0,0|2,0,0]=4 694 B15R2.1664 OC(=O)CN1CCC2CNCC2CC1 Amb24448850 [0,0,0,2,0,0|2,0,0]=4 695 B15R2.4041 CC1C2CNCC2CN1CCC(O)=O Amb24467890 [0,0,0,2,0,0|2,0,0]=4 696 B15R2.5274 OCC1CCCC12CC(=O)CCCC2 Amb25846167 [0,0,0,2,0,0|2,0,0]=4 697 B15R2.5274 OC[C@H]1CCC[C@]12CC(=O)CCCC2 Amb25284231 [0,0,0,2,0,0|2,0,0]=4 698 B15R2.5367 CCC1CCCN1C2CCC2C(O)=O Amb24383682 [0,0,0,2,0,0|1,0,0]=3 699 B15R2.5367 COC1CCCC1C2CCC2C(O)=O Amb24349083 [0,0,0,2,0,0|1,0,0]=3 700 B15R2.5367 OCC1CCCN1C2CCC2C(O)=O Amb25125514 [0,0,0,2,0,0|2,0,0]=4 701 B15R2.7688 OC(=O)CCC1CN2CCCC2CN1 Amb18811725 [0,0,0,2,0,0|2,0,0]=4 702 B15R2.7688 OC(=O)CCN1CC2CCNC2CC1 Amb25306856 [0,0,0,2,0,0|2,0,0]=4 703 B15R2.7688 OC(=O)CNC1CC2CCCN2CC1 Amb25735298 [0,0,0,2,0,0|2,0,0]=4 704 B15R2.7688 OC(=O)CNC1CC2CNCC2CC1 Amb25368840 [0,0,0,2,0,0|2,0,0]=4 705 B15R2.43323 CC1C(CC(O)=O)NCC2CCCN21 Amb18811726 [0,0,0,2,0,0|2,0,0]=4 706 B15R2.70 CCCC1CNCCC12CNC(=O)O2 Amb25323978 [0,0,0,2,0,0|2,0,0]=4 707 B15R2.283 O=C1CC(CC1)CCC2CCOCC2 Amb25666799 [0,0,0,2,0,0|2,0,0]=4 708 B15R2.283 O=C1CC(CCC2CCCCC2)CC1 Amb25796578 [0,0,0,2,0,0|1,0,0]=3 709 B15R2.283 O=C1CCC(CNC2CCCCC2)N1 Amb25738969 [0,0,0,2,0,0|2,0,0]=4 710 B15R2.283 O=C1CC[C@@H](COC2CCCCO2)O1 Amb22887008 [0,0,0,2,0,0|2,0,0]=4 711 B15R2.283 O=C1CN(CCC2CCCCC2)CC1 Amb19052752 [0,0,0,2,0,0|2,0,0]=4 712 B15R2.283 O=C1NC(CO1)CCC2CCCCC2 Amb25240962 [0,0,0,2,0,0|2,0,0]=4 713 B15R2.283 OC1CC(CC1)CCC2CCCCC2 Amb24758783 [0,0,0,2,0,0|1,0,1]=4 714 B15R2.305 CC1CCCCC1CN2CC(=O)CC2 Amb19052780 [0,0,0,2,0,0|2,0,0]=4 715 B15R2.6962 O=C1CC[C@@H](CN2CCCCCC2)N1 Amb25315227 [0,0,0,2,0,0|2,0,0]=4 716 B15R2.6962 O=C1NCC(CC2CCCCCC2)O1 Amb25257761 [0,0,0,2,0,0|1,0,0]=3 717 B15R2.362 CC1CCCCC12CNCC2C(O)=O Amb25093924 [0,0,0,2,0,0|1,0,0]=3 718 B15R2.1660 NC(=O)CCN1CC2CCCCC2C1 Amb24622528 [0,0,0,2,0,0|2,0,0]=4 719 B15R2.1660 NC(=O)CCN1C[C@@H]2CCCC[C@@H]2C1 Amb25221861 [0,0,0,2,0,0|2,0,0]=4 720 B15R2.1660 OC(=O)CCC1CC2CCCCC2N1 Amb17673616 [0,0,0,2,0,0|1,0,0]=3 721 B15R2.1660 OC(=O)CCC1CC2CCCCC2O1 Amb24449491 [0,0,0,2,0,0|1,0,0]=3 722 B15R2.1660 OC(=O)CCN1C[C@@H]2CCCC[C@@H]2C1 Amb25276979 [0,0,0,2,0,0|1,0,0]=3 723 B15R2.8792 CC1CCCCN1C2CCC2C(O)=O Amb24395541 [0,0,0,2,0,0|1,0,0]=3 724 B15R2.8792 CC1COCCN1C2CCC2C(O)=O Amb24395542 [0,0,0,2,0,0|2,0,0]=4 725 B15R2.69021 CC12CCCCC1CCCC2C(O)=O Amb24710285 [0,0,0,2,0,0|0,0,0]=2 726 B15R2.516 CC1CCCN1C2CCCC2C(O)=O Amb19044567 [0,0,0,2,0,0|1,0,0]=3 727 B15R2.516 CC1CCCN1C2COCC2C(O)=O Amb25664821 [0,0,0,2,0,0|2,0,0]=4 728 B15R2.516 CC1CSCC1N2CCCC2C(O)=O Amb24440735 [0,0,0,2,0,0|2,0,0]=4 729 B15R2.516 CC1OCCC1N2CCCC2C(O)=O Amb24394587 [0,0,0,2,0,0|2,0,0]=4 730 B15R2.516 CC1SCCC1N2CCCC2C(O)=O Amb24345662 [0,0,0,2,0,0|2,0,0]=4 731 B15R2.516 OC1CCCC1N2CCCC2C(O)=O Amb19056359 [0,0,0,2,0,0|2,0,0]=4 732 B15R2.13887 OC1CCCC1NC2CCC2C(O)=O Amb25829098 [0,0,0,2,0,0|2,0,0]=4 733 B15R2.16416 OC(=O)CN1CC2CCCN2CCC1 Amb25676793 [0,0,0,2,0,0|2,0,0]=4 734 B15R2.42043 O[C@H]1CCCCCCCCC[C@H]2C[C@@H]21 Amb25271542 [0,0,0,2,0,0|1,0,1]=4 735 B15R2.63 CC(=O)N1CCCC1C2CCCCC2 Amb24721888 [0,0,0,2,0,0|2,0,0]=4 736 B15R2.63 OC(=O)C1CCCC1C2CCCCC2 Amb24593453 [0,0,0,2,0,0|0,0,0]=2 737 B15R2.63 OC(=O)C1CCCC1C2CCOCC2 Amb24703369 [0,0,0,2,0,0|1,0,0]=3 738 B15R2.63 OC(=O)C1CCCC1N2CCCCC2 Amb18288572 [0,0,0,2,0,0|1,0,0]=3 739 B15R2.63 OC(=O)C1CCCC1N2CCOCC2 Amb18967367 [0,0,0,2,0,0|2,0,0]=4 740 B15R2.63 OC(=O)C1CCCN1C2CCNCC2 Amb10609436 [0,0,0,2,0,0|2,0,0]=4 741 B15R2.63 OC(=O)C1CCCN1C2CCOCC2 Amb16230750 [0,0,0,2,0,0|2,0,0]=4 742 B15R2.63 OC(=O)C1CCCN1C2CCOCC2 Amb20669503 [0,0,0,2,0,0|2,0,0]=4 743 B15R2.63 OC(=O)C1CCCN1C2CCSCC2 Amb18769730 [0,0,0,2,0,0|2,0,0]=4 744 B15R2.63 OC(=O)C1CCCN1C2COCCC2 Amb25835822 [0,0,0,2,0,0|2,0,0]=4 745 B15R2.63 OC(=O)C1CCNC1C2CCCCC2 Amb18636230 [0,0,0,2,0,0|1,0,0]=3 746 B15R2.63 OC(=O)C1CCOC1C2CCCCC2 Amb24743032 [0,0,0,2,0,0|1,0,0]=3 747 B15R2.63 OC(=O)C1CCOC1C2CCNCC2 Amb25038574 [0,0,0,2,0,0|2,0,0]=4 748 B15R2.63 OC(=O)C1CNCC1C2CCCCC2 Amb18812244 [0,0,0,2,0,0|1,0,0]=3 749 B15R2.63 OC(=O)C1CNCC1C2COCCC2 Amb24526070 [0,0,0,2,0,0|2,0,0]=4 750 B15R2.63 OC(=O)C1COCC1N2CCCCC2 Amb24521696 [0,0,0,2,0,0|2,0,0]=4 751 B15R2.63 OC(=O)C1CSCC1N2CCCCC2 Amb18170877 [0,0,0,2,0,0|2,0,0]=4 752 B15R2.63 OC(=O)C1NCCC1C2CCCCC2 Amb25114495 [0,0,0,2,0,0|1,0,0]=3 753 B15R2.63 OC(=O)[C@@H]1CCCN1C2CCCCC2 Amb24182112 [0,0,0,2,0,0|1,0,0]=3 754 B15R2.63 OC(=O)[C@@H]1CCCN1C2CCNCC2 Amb19517079 [0,0,0,2,0,0|2,0,0]=4 755 B15R2.63 OC(=O)[C@@H]1CCCN1C2CCNCC2 Amb22587503 [0,0,0,2,0,0|2,0,0]=4 756 B15R2.63 OC(=O)[C@@H]1CCCN1C2CCOCC2 Amb24182114 [0,0,0,2,0,0|2,0,0]=4 757 B15R2.63 OC(=O)[C@@H]1CCN[C@H]1C2CCCCC2 Amb18812230 [0,0,0,2,0,0|1,0,0]=3 758 B15R2.63 OC(=O)[C@@H]1CCO[C@H]1C2CCNCC2 Amb24586110 [0,0,0,2,0,0|2,0,0]=4 759 B15R2.63 OC(=O)[C@H]1CCCN1C2CCCCC2 Amb25858160 [0,0,0,2,0,0|1,0,0]=3 760 B15R2.63 OC(=O)[C@H]1CCCN1C2CCNCC2 Amb25135467 [0,0,0,2,0,0|2,0,0]=4 761 B15R2.63 OC(=O)[C@H]1CCCN1C2CCOCC2 Amb25278478 [0,0,0,2,0,0|2,0,0]=4 762 B15R2.63 OC(=O)[C@H]1CCO[C@H]1C2CCOCC2 Amb24520152 [0,0,0,2,0,0|2,0,0]=4 763 B15R2.63 OC(=O)[C@H]1NCC[C@@H]1C2CCCCC2 Amb25179310 [0,0,0,2,0,0|1,0,0]=3 764 B15R2.571 CC1CCC1NC2CCCC2C(N)=O Amb25717353 [0,0,0,2,0,0|2,0,0]=4 765 B15R2.1243 NC(=O)C1CNCC1CC2CCCC2 Amb24636339 [0,0,0,2,0,0|2,0,0]=4 766 B15R2.1243 NC(=O)[C@@H]1CCC[C@@H]1NC2CCCC2 Amb24647487 [0,0,0,2,0,0|2,0,0]=4 767 B15R2.1243 OC(=O)C1CCCC1CC2CCCC2 Amb24521628 [0,0,0,2,0,0|0,0,0]=2 768 B15R2.1243 OC(=O)C1CCCC1NC2CCCC2 Amb21961737 [0,0,0,2,0,0|1,0,0]=3 769 B15R2.1243 OC(=O)C1CCCC1SC2CCCC2 Amb25113607 [0,0,0,2,0,0|1,0,0]=3 770 B15R2.1243 OC(=O)C1CCCN1CC2CCCC2 Amb18292075 [0,0,0,2,0,0|1,0,0]=3 771 B15R2.1243 OC(=O)C1CCCN1CC2COCC2 Amb18303236 [0,0,0,2,0,0|2,0,0]=4 772 B15R2.1243 OC(=O)C1CCCN1CC2CSCC2 Amb25065093 [0,0,0,2,0,0|2,0,0]=4 773 B15R2.1243 OC(=O)C1CNCC1CC2CCCC2 Amb25211501 [0,0,0,2,0,0|1,0,0]=3 774 B15R2.1243 OC(=O)C1COCC1NC2CCCC2 Amb24445006 [0,0,0,2,0,0|2,0,0]=4 775 B15R2.1243 OC(=O)C1NCCC1CN2CCCC2 Amb24711575 [0,0,0,2,0,0|2,0,0]=4 776 B15R2.1243 OC(=O)[C@@H]1CCCN1CC2COCC2 Amb25326291 [0,0,0,2,0,0|2,0,0]=4 777 B15R2.1243 OC(=O)[C@@H]1NCC[C@H]1CN2CCCC2 Amb18811711 [0,0,0,2,0,0|2,0,0]=4 778 B15R2.1243 OC(=O)[C@H]1CCCN1CC2CCCC2 Amb24421374 [0,0,0,2,0,0|1,0,0]=3 779 B15R2.1243 OC(=O)[C@H]1CCCN1CC2COCC2 Amb24676125 [0,0,0,2,0,0|2,0,0]=4 780 B15R2.1243 OC(=O)[C@H]1NCC[C@@H]1CN2CCCC2 Amb24575976 [0,0,0,2,0,0|2,0,0]=4 781 B15R2.16385 OC(=O)C1CNCC12CCCOCC2 Amb25238042 [0,0,0,2,0,0|2,0,0]=4 782 B15R2.16385 OC(=O)[C@@H]1CNCC12CCCCCC2 Amb25758998 [0,0,0,2,0,0|1,0,0]=3 783 B15R2.16147 OC(=O)C[C@@H]1CCCCN[C@H]1C2CC2 Amb18812222 [0,0,0,2,0,0|1,0,0]=3 784 B15R2.16147 OC(=O)C[C@H]1CCCCN[C@@H]1C2CC2 Amb24690521 [0,0,0,2,0,0|1,0,0]=3 785 B15R2.19812 CC(=O)NC1CCCCC2CCCC21 Amb25735148 [0,0,0,2,0,0|2,0,0]=4 786 B15R2.19812 CC(=O)NC1CCCC[C@@H]2CCC[C@@H]21 Amb25287253 [0,0,0,2,0,0|2,0,0]=4 787 B15R2.69020 OC(=O)C1CCCC2CCCCCC21 Amb25804077 [0,0,0,2,0,0|0,0,0]=2 788 B15R2.69020 OC(=O)C1CCCN2CCCCC[C@@H]21 Amb18812238 [0,0,0,2,0,0|1,0,0]=3 789 B15R2.69020 OC(=O)C1CCC[C@H]2CCCCC[C@@H]21 Amb24540297 [0,0,0,2,0,0|0,0,0]=2 790 B15R2.69020 OC(=O)C1CCNC2CCOCCC12 Amb25122074 [0,0,0,2,0,0|2,0,0]=4 791 B15R2.938 CC1CCC1N2CCCC2CC(O)=O Amb24659972 [0,0,0,2,0,0|1,0,0]=3 792 B15R2.1149 CC1CCC1N2CCCCC2C(O)=O Amb24594862 [0,0,0,2,0,0|1,0,0]=3 793 B15R2.1149 CC1CCC1N2CCOCC2C(O)=O Amb25070829 [0,0,0,2,0,0|2,0,0]=4 794 B15R2.68442 OC(=O)CCN1CC2CCCCCC12 Amb24720380 [0,0,0,2,0,0|1,0,0]=3 795 B15R2.68442 OC(=O)CCN1CC2CCCCCC12 Amb25796908 [0,0,0,2,0,0|1,0,0]=3 796 B15R2.68695 CC(=O)[C@@H]1C[C@@H]2CCCCN[C@@H]2CC1 Amb25247272 [0,0,0,2,0,0|2,0,0]=4 797 B15R2.68695 NC(=O)C1CC2CCCCCC2CC1 Amb25695345 [0,0,0,2,0,0|1,0,0]=3 798 B15R2.68695 OC(=O)C1CSC2CCCCCC2N1 Amb25814976 [0,0,0,2,0,0|2,0,0]=4 799 B15R2.68695 OC(=O)C1C[C@H]2CCCCCC2CC1 Amb25102539 [0,0,0,2,0,0|0,0,0]=2 800 B15R2.68695 OC(=O)C1C[C@H]2CCCCC[C@@H]2CC1 Amb24692945 [0,0,0,2,0,0|0,0,0]=2 801 B15R2.68695 OC(=O)C=1CCC2CCCCCC2C1 Amb25102660 [0,0,0,2,0,0|0,0,2]=4 802 B15R2.68695 OC(=O)[C@@H]1C[C@H]2CCCCC[C@@H]2CC1 Amb25241235 [0,0,0,2,0,0|0,0,0]=2 803 B15R2.68695 OC(=O)[C@H]1CN2CCCCC[C@H]2CC1 Amb25230104 [0,0,0,2,0,0|1,0,0]=3 804 B15R2.68695 OC(=O)[C@H]1C[C@H]2CCCCC[C@@H]2CC1 Amb24651019 [0,0,0,2,0,0|0,0,0]=2 805 B15R2.68695 OC(=O)[C@H]1C[C@H]2CCCCC[C@H]2CC1 Amb25176116 [0,0,0,2,0,0|0,0,0]=2 806 B15R2.62 OC(=O)C1NCCCC12CCCCC2 Amb24498079 [0,0,0,2,0,0|1,0,0]=3 807 B15R2.111 CC(=O)NC1CCCC12CCCCC2 Amb25310508 [0,0,0,2,0,0|2,0,0]=4 808 B15R2.111 OC(=O)CC1CCCC12CCCCC2 Amb25101729 [0,0,0,2,0,0|0,0,0]=2 809 B15R2.111 OC(=O)CC1CCCC12CCOCC2 Amb24730130 [0,0,0,2,0,0|1,0,0]=3 810 B15R2.111 OC(=O)CC1CCCC12OCCCO2 Amb25036835 [0,0,0,2,0,0|2,0,0]=4 811 B15R2.111 OC(=O)CN1CCCC12CCCCC2 Amb25217371 [0,0,0,2,0,0|1,0,0]=3 812 B15R2.111 OC(=O)\C=C/1\CCCC12CCCCC2 Amb25101727 [0,0,0,2,0,0|0,0,2]=4 813 B15R2.543 O=C1CCCCC(N1)C2CCCCN2 Amb23580688 [0,0,0,2,0,0|2,0,0]=4 814 B15R2.543 OC1CC(CCCC1)C2CCCCC2 Amb24521058 [0,0,0,2,0,0|1,0,1]=4 815 B15R2.1241 OC(=O)C1CCC1CC2CCCCC2 Amb24349493 [0,0,0,2,0,0|0,0,0]=2 816 B15R2.1241 OC(=O)C1CCC1CC2CCOCC2 Amb25044726 [0,0,0,2,0,0|1,0,0]=3 817 B15R2.1241 OC(=O)C1CCC1NC2CCCCC2 Amb24658888 [0,0,0,2,0,0|1,0,0]=3 818 B15R2.1241 OC(=O)C1CCC1NC2CCSCC2 Amb25282041 [0,0,0,2,0,0|2,0,0]=4 819 B15R2.1241 OC(=O)C1CCC1SC2CCCCC2 Amb25355153 [0,0,0,2,0,0|1,0,0]=3 820 B15R2.1241 OC(=O)C1CCC1SC2CCOCC2 Amb25849617 [0,0,0,2,0,0|2,0,0]=4 821 B15R2.1658 OC(=O)COC1CCC12CCCCC2 Amb24464084 [0,0,0,2,0,0|1,0,0]=3 822 B15R2.49524 O=C1CCCCCC2(CCCCC2)N1 Amb24724674 [0,0,0,2,0,0|1,0,0]=3 823 B15R2.68122 CC(=O)CN1CCC[C@@H]2CCCC[C@H]12 Amb25229936 [0,0,0,2,0,0|2,0,0]=4 824 B15R2.68122 CC(=O)NC1CCCC2CCCCC21 Amb25124897 [0,0,0,2,0,0|2,0,0]=4 825 B15R2.68122 CC(=O)NC1CCC[C@H]2CCCC[C@@H]21 Amb24513143 [0,0,0,2,0,0|2,0,0]=4 826 B15R2.68122 NC(=O)CN1CCCC2CCCCC12 Amb19081870 [0,0,0,2,0,0|2,0,0]=4 827 B15R2.68122 OC(=O)CC1CCCN2CCCCC21 Amb18812220 [0,0,0,2,0,0|1,0,0]=3 828 B15R2.68122 OC(=O)CC1CCCN2CCSCC21 Amb18170845 [0,0,0,2,0,0|2,0,0]=4 829 B15R2.68122 OC(=O)CC1CCOC2CCCCC12 Amb18188030 [0,0,0,2,0,0|1,0,0]=3 830 B15R2.68122 OC(=O)CC1CCOC2CCOCC12 Amb18810794 [0,0,0,2,0,0|2,0,0]=4 831 B15R2.68122 OC(=O)CC1CCOC2CCSCC12 Amb18170337 [0,0,0,2,0,0|2,0,0]=4 832 B15R2.68122 OC(=O)CC1COCC2CCCCN21 Amb18811228 [0,0,0,2,0,0|2,0,0]=4 833 B15R2.68122 OC(=O)CC=1CCCC2CCCCC12 Amb24426247 [0,0,0,2,0,0|0,0,2]=4 834 B15R2.68122 OC(=O)CN1CCCC2COCCC12 Amb24720351 [0,0,0,2,0,0|2,0,0]=4 835 B15R2.68122 OC(=O)CN1CCCC2COCCC12 Amb25285515 [0,0,0,2,0,0|2,0,0]=4 836 B15R2.68122 OC(=O)CN1CCOC2CCCCC12 Amb18956042 [0,0,0,2,0,0|2,0,0]=4 837 B15R2.68122 OC(=O)C[C@@H]1CCCN2CCCC[C@@H]21 Amb25361489 [0,0,0,2,0,0|1,0,0]=3 838 B15R2.68122 OC(=O)\C=C\1/CCCC2CCCCC12 Amb25336590 [0,0,0,2,0,0|0,0,2]=4 839 B15R2.110 CC(=O)NC1CCCCC12CCCC2 Amb25350595 [0,0,0,2,0,0|2,0,0]=4 840 B15R2.110 OC(=O)CC1CCCCC12CCCC2 Amb24406382 [0,0,0,2,0,0|0,0,0]=2 841 B15R2.110 OC(=O)CC1CCOCC12COCC2 Amb18810796 [0,0,0,2,0,0|2,0,0]=4 842 B15R2.110 OC(=O)CC1CCOCC12CSCC2 Amb18170373 [0,0,0,2,0,0|2,0,0]=4 843 B15R2.110 OC(=O)CC1CCSCC12COCC2 Amb18170363 [0,0,0,2,0,0|2,0,0]=4 844 B15R2.110 OC(=O)\C=C/1\CCCCC12CCCC2 Amb24554718 [0,0,0,2,0,0|0,0,2]=4 845 B15R2.417 OC(=O)CCC1CCCC12OCCO2 Amb25041171 [0,0,0,2,0,0|2,0,0]=4 846 B15R2.417 OC(=O)CCN1CCCC12CCCC2 Amb25204811 [0,0,0,2,0,0|1,0,0]=3 847 B15R2.1221 CC(=O)C1CCCCN1C2CCCC2 Amb25782157 [0,0,0,2,0,0|2,0,0]=4 848 B15R2.1221 NC(=O)C1CCCNC1C2CCCC2 Amb25849528 [0,0,0,2,0,0|2,0,0]=4 849 B15R2.1221 OC(=O)C1CCCCC1C2CCCC2 Amb25791841 [0,0,0,2,0,0|0,0,0]=2 850 B15R2.1221 OC(=O)C1CCCCC1N2CCCC2 Amb18967365 [0,0,0,2,0,0|1,0,0]=3 851 B15R2.1221 OC(=O)C1CCCCN1C2CSCC2 Amb18170906 [0,0,0,2,0,0|2,0,0]=4 852 B15R2.1221 OC(=O)C1CCCOC1C2CCCO2 Amb25720590 [0,0,0,2,0,0|2,0,0]=4 853 B15R2.1221 OC(=O)C1CNCCC1C2CCCC2 Amb18812215 [0,0,0,2,0,0|1,0,0]=3 854 B15R2.1221 OC(=O)C1CNCCC1C2COCC2 Amb18811224 [0,0,0,2,0,0|2,0,0]=4 855 B15R2.1221 OC(=O)C1CNCCC1C2CSCC2 Amb18170815 [0,0,0,2,0,0|2,0,0]=4 856 B15R2.1221 OC(=O)C1CNCCC1N2CCCC2 Amb18811765 [0,0,0,2,0,0|2,0,0]=4 857 B15R2.1221 OC(=O)C1COCCN1C2CCCC2 Amb18811220 [0,0,0,2,0,0|2,0,0]=4 858 B15R2.1221 OC(=O)C1CSCCN1C2CCCC2 Amb25761851 [0,0,0,2,0,0|2,0,0]=4 859 B15R2.1221 OC(=O)[C@@H]1CCCCN1C2CCCC2 Amb25705214 [0,0,0,2,0,0|1,0,0]=3 860 B15R2.1253 CC(=O)CC1CCCN1C2CCCC2 Amb25800599 [0,0,0,2,0,0|2,0,0]=4 861 B15R2.1253 CC(=O)CN1CCCC1C2CCCC2 Amb19081053 [0,0,0,2,0,0|2,0,0]=4 862 B15R2.1253 CC(=O)NC1CCCC1C2CCCC2 Amb24559207 [0,0,0,2,0,0|2,0,0]=4 863 B15R2.1253 CC(=O)N[C@@H]1CCC[C@@H]1C2CCCC2 Amb25218255 [0,0,0,2,0,0|2,0,0]=4 864 B15R2.1253 NC(=O)CN1CCCC1C2CCCC2 Amb19053515 [0,0,0,2,0,0|2,0,0]=4 865 B15R2.1253 OC(=O)CC1CCCC1N2CCCC2 Amb18812251 [0,0,0,2,0,0|1,0,0]=3 866 B15R2.1253 OC(=O)CC1CCCN1C2CCCC2 Amb18977158 [0,0,0,2,0,0|1,0,0]=3 867 B15R2.1253 OC(=O)CC1CCCN1C2COCC2 Amb24731042 [0,0,0,2,0,0|2,0,0]=4 868 B15R2.1253 OC(=O)CC1COCC1N2CCCC2 Amb18187712 [0,0,0,2,0,0|2,0,0]=4 869 B15R2.1253 OC(=O)CC1CSCC1N2CCCC2 Amb18170837 [0,0,0,2,0,0|2,0,0]=4 870 B15R2.1253 OC(=O)CN1CCCC1C2CCCC2 Amb18983896 [0,0,0,2,0,0|1,0,0]=3 871 B15R2.1253 OC(=O)CN1CCCC1C2CCCN2 Amb18296197 [0,0,0,2,0,0|2,0,0]=4 872 B15R2.7273 O=C1CCCCC(CC2CCCC2)=C1 Amb25186597 [0,0,0,2,0,0|1,0,1]=4 873 B15R2.19753 CC(=O)CCN1CCCC2CCCC12 Amb25841297 [0,0,0,2,0,0|2,0,0]=4 874 B15R2.19753 OC(=O)CCN1CCC[C@@H]2CNC[C@H]12 Amb25265367 [0,0,0,2,0,0|2,0,0]=4 875 B15R2.19753 OC(=O)CCN1CCC[C@H]2COC[C@@H]12 Amb25187180 [0,0,0,2,0,0|2,0,0]=4 876 B15R2.19753 OC(=O)CCN1CCOC2CCCC12 Amb18980766 [0,0,0,2,0,0|2,0,0]=4 877 B15R2.19753 OC(=O)CCN1CCO[C@H]2CCC[C@@H]12 Amb25734937 [0,0,0,2,0,0|2,0,0]=4 878 B15R2.19753 OC(=O)CCN1CCSC2CCCC12 Amb25065961 [0,0,0,2,0,0|2,0,0]=4 879 B15R2.984 CC1NC2CCCCC2CC1C(O)=O Amb25087486 [0,0,0,2,0,0|1,0,0]=3 880 B15R2.984 O[C@H]1C[C@@H]2CCCC[C@H]2C[C@@H]1C(O)=O Amb25361095 [0,0,0,2,0,0|1,0,0]=3 881 B15R2.984 O[C@H]1C[C@H]2CCCC[C@@H]2C[C@H]1C(O)=O Amb24627126 [0,0,0,2,0,0|1,0,0]=3 882 B15R2.993 CC1CC2CCCCC2N1CC(O)=O Amb25730893 [0,0,0,2,0,0|1,0,0]=3 883 B15R2.82782 OC(=O)CCN1C2CCCC1CCC2 Amb25107485 [0,0,0,2,0,0|1,0,0]=3 884 B15R2.964 CC1CN2CCCC2CN1CC(O)=O Amb24445728 [0,0,0,2,0,0|2,0,0]=4 885 B15R2.67715 NC(=O)C12CCCCC1CCCCC2 Amb25772913 [0,0,0,2,0,0|1,0,0]=3 886 B15R2.67715 NC(=O)[C@@]12CCCC[C@@H]1CCCCC2 Amb25336478 [0,0,0,2,0,0|1,0,0]=3 887 B15R2.67715 OC(=O)C12CC=CCC1CCCCC2 Amb24724706 [0,0,0,2,0,0|0,0,2]=4 888 B15R2.69067 OC(=O)C1CCCCCC1C2CCC2 Amb25683022 [0,0,0,2,0,0|0,0,0]=2 889 B15R2.69067 OC(=O)C1CCCCCN1C2CCC2 Amb24627624 [0,0,0,2,0,0|1,0,0]=3 890 B15R2.69067 OC(=O)C1CCCCCN1C2CSC2 Amb24656328 [0,0,0,2,0,0|2,0,0]=4 891 B15R2.1428 CCCCC1OC(=O)C2=CCCCC12 Amb16192670 [0,0,0,2,0,0|0,0,2]=4 892 B15R2.1428 CCCCC1OC(=O)C2CCCCC21 Amb24608757 [0,0,0,2,0,0|0,0,0]=2 893 B15R2.4490 O=C1CC2CCCCC2(CCCCl)O1 Amb24741061 [0,0,0,2,0,0|1,0,0]=3 894 B15R2.4490 O=C1C[C@@H]2CCCC[C@]2(CCCCl)O1 Amb24654959 [0,0,0,2,0,0|1,0,0]=3 895 B15R2.1162 CC1NCC2CCCCN2C1C(O)=O Amb18811723 [0,0,0,2,0,0|2,0,0]=4 896 B15R2.1162 C[C@@H]1C=C[C@@H]2CCCC[C@H]2[C@@H]1C(O)=O Amb24558574 [0,0,0,2,0,0|0,0,2]=4 897 B15R2.1162 C[C@H]1C=C[C@H]2CCCC[C@@H]2[C@H]1C(O)=O Amb24519985 [0,0,0,2,0,0|0,0,2]=4 898 B15R2.1162 NC1CCN2CCCCC2C1C(O)=O Amb18811713 [0,0,0,2,0,0|2,0,0]=4 899 B15R2.1425 CCCCN1C2CC(=O)CC1CCC2 Amb19064046 [0,0,0,2,0,0|2,0,0]=4 900 B15R2.19826 OC(=O)CC1CCCCN1C2CSC2 Amb24699317 [0,0,0,2,0,0|2,0,0]=4 901 B15R2.50423 OC(=O)C[C@]12CCCC[C@H]1CCC2=O Amb25209949 [0,0,0,2,0,0|1,0,1]=4 902 B15R2.50423 OC1CCC2CCCCC12CC(O)=O Amb25818586 [0,0,0,2,0,0|1,0,0]=3 903 B15R2.69618 CC(=O)NC12CCCCC1CCCC2 Amb25292342 [0,0,0,2,0,0|2,0,0]=4 904 B15R2.69618 NC(=O)CC12CCCCC1CCCC2 Amb25101934 [0,0,0,2,0,0|1,0,0]=3 905 B15R2.69618 OC(=O)CC12CCCCC1CCC=C2 Amb25758773 [0,0,0,2,0,0|0,0,2]=4 906 B15R2.69618 OC(=O)CC12CCCCC1CCCC2 Amb25287267 [0,0,0,2,0,0|0,0,0]=2 907 B15R2.69618 OC(=O)CC12CCCCN1CCCC2 Amb25327397 [0,0,0,2,0,0|1,0,0]=3 908 B15R2.69618 OC(=O)C[C@@]12CCCC[C@@H]1CCCC2 Amb25825664 [0,0,0,2,0,0|0,0,0]=2 909 B15R2.7192 CC1NCC2CCCN2C1CC(O)=O Amb18811728 [0,0,0,2,0,0|2,0,0]=4 910 B15R2.19747 OC(=O)CCN1[C@H]2CCNC[C@@H]1CC2 Amb24574107 [0,0,0,2,0,0|2,0,0]=4 911 B15R2.83023 OC(=O)CC1CCN2CCCCCC21 Amb18812221 [0,0,0,2,0,0|1,0,0]=3 912 B15R2.20284 O=C1CCCCC[C@@H](O1)[C@@H]2C[C@H]2C=O Amb24568329 [0,0,0,2,0,0|1,0,1]=4 913 B15R2.20284 O=C1CCCCC[C@@H](O1)[C@H]2C[C@@H]2C=O Amb24721648 [0,0,0,2,0,0|1,0,1]=4 914 B15R2.20284 O=C1CCCCC[C@H](O1)[C@@H]2C[C@H]2C=O Amb24585182 [0,0,0,2,0,0|1,0,1]=4 915 B15R2.20284 OC[C@@H]1C[C@H]1[C@@H]2CCCCCC(=O)O2 Amb25272299 [0,0,0,2,0,0|1,0,0]=3 916 B15R2.20284 OC[C@H]1C[C@@H]1[C@H]2CCCCCC(=O)O2 Amb25256756 [0,0,0,2,0,0|1,0,0]=3 917 B15R2.16320 OC(=O)C1CCCCC1SC2COC2 Amb25053827 [0,0,0,2,0,0|2,0,0]=4 918 B15R2.16320 OC(=O)C1CCCCN1CC2CCC2 Amb25095690 [0,0,0,2,0,0|1,0,0]=3 919 B15R2.16320 OC(=O)C1CNCCN1CC2CCC2 Amb24360905 [0,0,0,2,0,0|2,0,0]=4 920 B15R2.16320 OC(=O)C1CSCCN1CC2CCC2 Amb25042435 [0,0,0,2,0,0|2,0,0]=4 921 B15R2.4370 NCCN1CC2CCCC2C1C(O)=O Amb24749122 [0,0,0,2,0,0|2,0,0]=4 922 B15R2.4370 OCCN1CC2CCCC2C1C(O)=O Amb25704762 [0,0,0,2,0,0|2,0,0]=4 923 B15R2.67682 CC(=O)C1CC1C2CCCCCCC2 Amb24337031 [0,0,0,2,0,0|1,0,0]=3 924 B15R2.106506 N#CC1C2CCCCCCC21C(O)=O Amb24391655 [0,0,0,2,0,0|1,0,1]=4 925 B15R2.106506 N#C[C@H]1[C@H]2CCCCCC[C@]21C(O)=O Amb25179291 [0,0,0,2,0,0|1,0,1]=4 926 B15R2.69054 OC(=O)C1CCC1N2CCCNCC2 Amb25693488 [0,0,0,2,0,0|2,0,0]=4 927 B15R2.69054 OC(=O)C1CCC1N2CCCOCC2 Amb24347295 [0,0,0,2,0,0|2,0,0]=4 928 B15R2.16284 OC(=O)C1CCCCCCN1C2CC2 Amb24507712 [0,0,0,2,0,0|1,0,0]=3