0 B24R0.34120 C=CCCCCCCCCCCCCCCCCCCCCC(O)=O Amb19930214 [0,0,0,0,0,0|0,0,2]=2 1 B24R0.34120 CCCCCCCCCCC\C=C\CCCCCCCCCC(O)=O Amb21928702 [0,0,0,0,0,0|0,0,2]=2 2 B24R0.34120 OCCCCCCCCCCCCCCCCCCCCCC(O)=O Amb21928735 [0,0,0,0,0,0|1,0,0]=1 3 B23R0.47 OCCCCCCCCCCCCCCCCCCCCCCO Amb21936052 [1,0,0,0,0,0|1,0,1]=3 4 B23R0.36959 BrCCCCCCCCCCCCCCCCCCCCC(=O)O Amb10071512 [1,0,0,0,0,0|1,0,0]=2 5 B23R0.36959 C=CCCCCCCCCCCCCCCCCCCCC(O)=O Amb22347533 [1,0,0,0,0,0|0,0,2]=3 6 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(=O)Cl Amb22350611 [1,0,0,0,0,0|1,0,0]=2 7 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(=O)O Amb10601786 [1,0,0,0,0,0|0,0,0]=1 8 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(N)=O Amb22232381 [1,0,0,0,0,0|1,0,0]=2 9 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC([O-])=O Amb22731684 [1,0,0,0,0,0|0,0,1]=2 10 B23R0.36959 CCCCCCCCCC\C=C\CCCCCCCCCC(O)=O Amb19515757 [1,0,0,0,0,0|0,0,2]=3 11 B23R0.36959 CCCCCCCC\C=C/CCCCCCCCCCCC(=O)Cl Amb22350015 [1,0,0,0,0,0|1,0,2]=4 12 B23R0.36959 CCCCCCCC\C=C\CCCCCCCCCCCC(O)=O Amb22359762 [1,0,0,0,0,0|0,0,2]=3 13 B25R0.7948 CCCCCCCCCCCCCCCCCCCCCCC[13C](O)=O Amb22366855 [0,1,0,0,0,0|0,0,0]=1 14 B25R0.7948 CCCCCCCC\C=C/CCCCCCCCCCCCOC(C)=O Amb22729139 [0,1,0,0,0,0|1,0,2]=4 15 B25R0.16317 CCCCCCCCCCCCCCCCCCCCCCC(=O)OC Amb21928886 [0,1,0,0,0,0|0,0,0]=1 16 B25R0.16317 COC(=O)CCCCCCCCCCCCCCCCCCCCCO Amb21928819 [0,1,0,0,0,0|1,0,0]=2 17 B25R0.16320 CCCCCCCCCCCCCCCCCCCCCC(O)C(O)=O Amb21928761 [0,1,0,0,0,0|0,0,0]=1 18 B25R0.16324 CCCCCCCCCCCCCCCCCCOC(=O)CCC(O)=O Amb22346572 [0,1,0,0,0,0|1,0,1]=3 19 B25R0.23759 CCCCCCCCCCCCCCCCCC(=O)CCCCC(O)=O Amb22366617 [0,1,0,0,0,0|0,0,1]=2 20 B25R0.29190 CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)C Amb22002579 [0,1,0,0,0,0|3,0,0]=4 21 B25R0.29190 CCCCCCCCCCCCCCCCCCCCCC[Si](C)(Cl)Cl Amb19893866 [0,1,0,0,0,0|2,1,0]=4 22 B25R0.29190 CCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl Amb19893867 [0,1,0,0,0,0|2,1,0]=4 23 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCC=C Amb21520342 [2,0,0,0,0,0|0,0,1]=3 24 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCC=O Amb20669633 [2,0,0,0,0,0|0,0,0]=2 25 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCO Amb22338495 [2,0,0,0,0,0|0,0,0]=2 26 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCS Amb24323614 [2,0,0,0,0,0|0,1,0]=3 27 B22R0.37843 CCCCCCCCCCCCCCCCNCCCCCC Amb20076225 [2,0,0,0,0,0|1,0,1]=4 28 B22R0.37843 CCCCCCCCCCCCCCCCOCCOCCO Amb22732047 [2,0,0,0,0,0|2,0,0]=4 29 B22R0.37843 CCCCCCCCCCCNCCCCCCCCCCC Amb22359576 [2,0,0,0,0,0|1,0,1]=4 30 B22R0.37843 CCCCCCCCCCCOCCCCCCCCCCC Amb22731681 [2,0,0,0,0,0|1,0,1]=4 31 B22R0.37843 CCCCCCCCCCCSCCCCCCCCCCC Amb22359734 [2,0,0,0,0,0|1,0,1]=4 32 B22R0.37843 CCCCCCCC\C=C/CCCCCCCCCCCCO Amb22732526 [2,0,0,0,0,0|0,0,2]=4 33 B22R0.2907 CCCCCCCCCCCCCCCCCCCCC(=O)Cl Amb22735152 [2,0,0,0,0,0|1,0,0]=3 34 B22R0.2907 CCCCCCCCCCCCCCCCCCOCC([O-])=O Amb22360583 [2,0,0,0,0,0|1,0,1]=4 35 B22R0.2907 OCCCCCCCCCCCCCCCCCCCC(O)=O Amb21928749 [2,0,0,0,0,0|1,0,0]=3 36 B24R0.2855 CCCCCCCCCCCCCCCCCCCCCCCCBr Amb22369178 [1,1,0,0,0,0|1,0,1]=4 37 B24R0.2855 CCCCCCCCCCCCCCCCNCCCCCCCC Amb20076232 [1,1,0,0,0,0|1,0,1]=4 38 B24R0.2855 CCCCCCCCCCCCNCCCCCCCCCCCC Amb22491109 [1,1,0,0,0,0|1,0,1]=4 39 B24R0.2855 CCCCCCCCCCCCOCCCCCCCCCCCC Amb19930032 [1,1,0,0,0,0|1,0,1]=4 40 B24R0.2855 CCCCCCCCCCCC[Hg]CCCCCCCCCCCC Amb22347116 [1,1,0,0,0,0|1,0,1]=4 41 B24R0.17633 CCCCCCCCCCCCCCCCCCCCOS(O)(=O)=O Amb22350103 [1,1,0,0,0,0|2,0,0]=4 42 B24R0.34581 CCCCCCCCCCCCCCCCCCCCC(O)C(O)=O Amb21928737 [1,1,0,0,0,0|0,0,0]=2 43 B26R0.8183 CCCCCCCCCCCCCCCCCCCCCCOS([O-])(=O)=O Amb22270255 [0,2,0,0,0,0|1,0,1]=4 44 B26R0.21513 CCCCCCCCCCCCCCCCCC(=O)CCCCCC(O)=O Amb22347547 [0,2,0,0,0,0|0,0,0]=2 45 B26R0.26422 CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=C Amb22001052 [0,2,0,0,0,0|1,0,0]=3 46 B26R0.26425 CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=O Amb21928759 [0,2,0,0,0,0|0,0,0]=2 47 B26R0.26429 CCCCCCCCCCCCCCCCCCOCC(O)COC(C)=O Amb22731053 [0,2,0,0,0,0|2,0,0]=4 48 B26R0.27988 CCCCCCCCCCCCCCCCCCCCCC(=O)CC([O-])=O Amb22347566 [0,2,0,0,0,0|0,0,1]=3 49 B26R0.28341 CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)O Amb1149489 [0,2,0,0,0,0|0,0,2]=4 50 B26R0.28341 CCCCCCCCCCCCCCCCCCCCCCCCC(O)=O Amb21929000 [0,2,0,0,0,0|0,0,0]=2 51 B26R0.2605327 CCCCCCCCCCCC(=O)CCCCCCCCCCCC(O)=O Amb22347585 [0,2,0,0,0,0|0,0,0]=2 52 B26R0.21009 CCCCCCCCCCCCCCCC(=O)NCCCCC(C(=O)O)N Amb16228303 [0,2,0,0,0,0|1,0,1]=4 53 B26R0.14925 CCCCCCCCCCCCCCCCCCCCCC(O)C(=O)OC Amb21928812 [0,2,0,0,0,0|0,0,0]=2 54 B26R0.28155 CCCCCCCCCCCCCCCCCCCCCCC(=O)OCC Amb22733756 [0,2,0,0,0,0|0,0,0]=2 55 B24R1.55667 CCCCCCCCCCCCCCCCCCC1CCCCC1 Amb22731716 [1,0,0,1,0,0|1,0,1]=4