0 B7R0.4 C#CCCC=C(C)C Amb30023880 [0,0,0,0,0,0|1,0,3]=4 1 B7R0.4 C#CCCCC(=N)N Amb27429454 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.4 C#CCCCC(=O)O Amb2721705 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.4 C#CCCCC(C)=O Amb18115312 [0,0,0,0,0,0|0,0,2]=2 5 B7R0.4 C#CCCCC(C)C Amb18635315 [0,0,0,0,0,0|1,0,3]=4 6 B7R0.4 C#CCCCC(C)O Amb24360348 [0,0,0,0,0,0|0,0,4]=4 7 B7R0.4 C#CCCCC(N)=O Amb27590599 [0,0,0,0,0,0|1,0,2]=3 8 B7R0.4 C#CCCCN(C)C Amb18116175 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.4 C#CCCCN(C)C Amb33329997 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.4 C#CCCC[C@@H](C)O Amb26936874 [0,0,0,0,0,0|0,0,4]=4 11 B7R0.4 C#CCCC[C@H](C)O Amb27809722 [0,0,0,0,0,0|0,0,4]=4 12 B7R0.4 C#CCCNC(C)=O Amb21942373 [0,0,0,0,0,0|1,0,2]=3 13 B7R0.4 C#CCCNC(N)=O Amb26993283 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,0,0,0,0,0|2,0,2]=4 15 B7R0.4 C#CCCOC(N)=O Amb28364943 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.4 C#CCNCC(=O)O Amb33551387 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.4 C#CCNCC(=O)O Amb6740302 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.4 C#CCOCC(=O)O Amb9208655 [0,0,0,0,0,0|2,0,2]=4 19 B7R0.4 C#CCOCC(C)=O Amb3987398 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.4 C#CCSCC(=C)C Amb27588696 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.4 C=C(Br)CCCC#N Amb6298900 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.4 C=C(Br)CCCCBr Amb4035450 [0,0,0,0,0,0|2,0,1]=3 24 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.4 C=C(Br)COCCN Amb19020783 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.4 C=C(Br)COCCO Amb28453509 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.4 C=C(C)C#CCCC Amb22228884 [0,0,0,0,0,0|1,0,2]=3 28 B7R0.4 C=C(C)C#CCCO Amb2721683 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.4 C=C(C)CCCC#N Amb6298905 [0,0,0,0,0,0|2,0,1]=3 30 B7R0.4 C=C(C)CCCCC Amb6298938 [0,0,0,0,0,0|1,0,0]=1 31 B7R0.4 C=C(C)CCCCO Amb26872404 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.4 C=C(C)CCCNN Amb28345747 [0,0,0,0,0,0|3,0,0]=3 33 B7R0.4 C=C(C)CCN=C=O Amb33199902 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.4 C=C(C)CCN=C=S Amb28457376 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.4 C=C(C)CCN=[N+]=[N-] Amb26011885 [0,0,0,0,0,0|4,0,0]=4 36 B7R0.4 C=C(C)CCNC#N Amb27974817 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.4 C=C(C)CCNC=O Amb27228134 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.4 C=C(C)CCOCCl Amb28366369 [0,0,0,0,0,0|3,0,0]=3 39 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [0,0,0,0,0,0|1,0,2]=3 40 B7R0.4 C=C(C)CNCCC Amb17308631 [0,0,0,0,0,0|2,0,0]=2 41 B7R0.4 C=C(C)CNCCF Amb28316183 [0,0,0,0,0,0|3,0,0]=3 42 B7R0.4 C=C(C)CNOCC Amb27254563 [0,0,0,0,0,0|3,0,0]=3 43 B7R0.4 C=C(C)COCC=O Amb27949608 [0,0,0,0,0,0|3,0,1]=4 44 B7R0.4 C=C(C)COCCN Amb19020764 [0,0,0,0,0,0|3,0,0]=3 45 B7R0.4 C=C(C)COCCN Amb20631068 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.4 C=C(C)COCCO Amb27452088 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.4 C=C(C)COCOC Amb27213685 [0,0,0,0,0,0|3,0,0]=3 48 B7R0.4 C=C(C)CSCC#N Amb17501754 [0,0,0,0,0,0|3,0,1]=4 49 B7R0.4 C=C(C)CSCCC Amb27449649 [0,0,0,0,0,0|2,0,0]=2 50 B7R0.4 C=C(C)CSCCN Amb6259178 [0,0,0,0,0,0|3,0,0]=3 51 B7R0.4 C=C(C)C\C=C\CO Amb27181043 [0,0,0,0,0,0|2,0,2]=4 52 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [0,0,0,0,0,0|2,0,2]=4 53 B7R0.4 C=C(Cl)CNCCC Amb19004838 [0,0,0,0,0,0|2,0,1]=3 54 B7R0.4 C=C(Cl)CNCCN Amb27394577 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.4 C=C(Cl)CNOCC Amb27657345 [0,0,0,0,0,0|3,0,1]=4 56 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,0,0,0,0,0|3,0,1]=4 57 B7R0.4 C=C(Cl)CSCCO Amb9273887 [0,0,0,0,0,0|3,0,1]=4 58 B7R0.4 C=C(F)CCCCO Amb22641473 [0,0,0,0,0,0|2,0,1]=3 59 B7R0.4 C=C=CCCC(C)=O Amb28315801 [0,0,0,0,0,0|0,0,3]=3 60 B7R0.4 C=CCCC=C(C)C Amb25789441 [0,0,0,0,0,0|1,0,3]=4 61 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [0,0,0,0,0,0|1,0,2]=3 62 B7R0.4 C=CCCCC(=O)O Amb3941675 [0,0,0,0,0,0|1,0,2]=3 63 B7R0.4 C=CCCCC(C)=O Amb17593171 [0,0,0,0,0,0|0,0,2]=2 64 B7R0.4 C=CCCCC(C)C Amb25127926 [0,0,0,0,0,0|1,0,3]=4 65 B7R0.4 C=CCCCC(C)N Amb25880150 [0,0,0,0,0,0|1,0,3]=4 66 B7R0.4 C=CCCCC(C)O Amb22059432 [0,0,0,0,0,0|0,0,4]=4 67 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,0,0,0,0,0|2,0,2]=4 68 B7R0.4 C=CCCOC(=O)Cl Amb10844792 [0,0,0,0,0,0|2,0,2]=4 69 B7R0.4 C=CCCOC(C)=O Amb3940828 [0,0,0,0,0,0|1,0,2]=3 70 B7R0.4 C=CCCSC(C)=O Amb24117956 [0,0,0,0,0,0|1,0,2]=3 71 B7R0.4 C=CCNCC(=C)C Amb17308750 [0,0,0,0,0,0|2,0,2]=4 72 B7R0.4 C=CCNCC(=O)O Amb7766404 [0,0,0,0,0,0|2,0,2]=4 73 B7R0.4 C=CCNCC(=O)O Amb8631497 [0,0,0,0,0,0|2,0,2]=4 74 B7R0.4 C=CCNCC(N)=O Amb6706481 [0,0,0,0,0,0|2,0,2]=4 75 B7R0.4 C=CCOCC(=C)C Amb26398441 [0,0,0,0,0,0|2,0,2]=4 76 B7R0.4 C=CCOCC(=O)O Amb9208694 [0,0,0,0,0,0|2,0,2]=4 77 B7R0.4 C=CCOCC(C)=O Amb27829146 [0,0,0,0,0,0|1,0,2]=3 78 B7R0.4 C=CCOCC(N)=O Amb26859258 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.4 C=CCSCC(=C)C Amb28127803 [0,0,0,0,0,0|2,0,2]=4 80 B7R0.4 C=CCSCC(=O)O Amb33526723 [0,0,0,0,0,0|2,0,2]=4 81 B7R0.4 C=CNCCC(=O)O Amb27429817 [0,0,0,0,0,0|2,0,2]=4 82 B7R0.4 C=COCCC(=O)O Amb28350126 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.4 CC#CC#CC(C)=O Amb27433140 [0,0,0,0,0,0|0,0,4]=4 84 B7R0.4 CC#CCCC(=O)O Amb3987196 [0,0,0,0,0,0|1,0,2]=3 85 B7R0.4 CC#CCCC(C)C Amb22052677 [0,0,0,0,0,0|1,0,3]=4 86 B7R0.4 CC#CCCC(C)Cl Amb27978357 [0,0,0,0,0,0|1,0,3]=4 87 B7R0.4 CC#CCNC(C)=O Amb27758151 [0,0,0,0,0,0|1,0,2]=3 88 B7R0.4 CC#CCOC(=O)Cl Amb22001616 [0,0,0,0,0,0|2,0,2]=4 89 B7R0.4 CC(=N)NCCCO Amb27967298 [0,0,0,0,0,0|3,0,0]=3 90 B7R0.4 CC(=O)C#CCCO Amb28316149 [0,0,0,0,0,0|1,0,2]=3 91 B7R0.4 CC(=O)C=C=CCO Amb28284681 [0,0,0,0,0,0|1,0,3]=4 92 B7R0.4 CC(=O)CCCC#N Amb17106756 [0,0,0,0,0,0|1,0,1]=2 93 B7R0.4 CC(=O)CCCCBr Amb16234126 [0,0,0,0,0,0|1,0,0]=1 94 B7R0.4 CC(=O)CCCCCl Amb3941549 [0,0,0,0,0,0|1,0,0]=1 95 B7R0.4 CC(=O)CCCCF Amb27490855 [0,0,0,0,0,0|1,0,0]=1 96 B7R0.4 CC(=O)CCCCN Amb27401218 [0,0,0,0,0,0|1,0,0]=1 97 B7R0.4 CC(=O)CCCCO Amb10603864 [0,0,0,0,0,0|1,0,0]=1 98 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,0,0,0,0,0|3,0,0]=3 99 B7R0.4 CC(=O)CCSC#N Amb28062990 [0,0,0,0,0,0|2,0,1]=3 100 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.4 CC(=O)CNOCO Amb27244723 [0,0,0,0,0,0|3,0,0]=3 102 B7R0.4 CC(=O)COCCCl Amb25346574 [0,0,0,0,0,0|2,0,0]=2 103 B7R0.4 CC(=O)COCCF Amb27463527 [0,0,0,0,0,0|2,0,0]=2 104 B7R0.4 CC(=O)COCCO Amb28122841 [0,0,0,0,0,0|2,0,0]=2 105 B7R0.4 CC(=O)CSCCF Amb24621173 [0,0,0,0,0,0|2,0,0]=2 106 B7R0.4 CC(=O)CSCCN Amb17500454 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.4 CC(=O)CSCCO Amb4165952 [0,0,0,0,0,0|2,0,0]=2 108 B7R0.4 CC(=O)CS\C=N\O Amb27973055 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [0,0,0,0,0,0|1,0,3]=4 110 B7R0.4 CC(=O)C\N=N\C#N Amb28316209 [0,0,0,0,0,0|3,0,1]=4 111 B7R0.4 CC(=O)NCCC#N Amb5787037 [0,0,0,0,0,0|2,0,1]=3 112 B7R0.4 CC(=O)NCCC=O Amb17102165 [0,0,0,0,0,0|2,0,1]=3 113 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,0,0,0,0,0|2,0,0]=2 114 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,0,0,0,0,0|2,0,0]=2 115 B7R0.4 CC(=O)NCCCN Amb10610286 [0,0,0,0,0,0|2,0,0]=2 116 B7R0.4 CC(=O)NCCCN Amb6664982 [0,0,0,0,0,0|2,0,0]=2 117 B7R0.4 CC(=O)NCCCO Amb3429354 [0,0,0,0,0,0|2,0,0]=2 118 B7R0.4 CC(=O)NCCNN Amb24117179 [0,0,0,0,0,0|3,0,0]=3 119 B7R0.4 CC(=O)NCCON Amb17138368 [0,0,0,0,0,0|3,0,0]=3 120 B7R0.4 CC(=O)NOCCO Amb27484242 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.4 CC(=O)OCCCBr Amb26515737 [0,0,0,0,0,0|2,0,0]=2 122 B7R0.4 CC(=O)OCCCCl Amb3940269 [0,0,0,0,0,0|2,0,0]=2 123 B7R0.4 CC(=O)OCCCO Amb25854267 [0,0,0,0,0,0|2,0,0]=2 124 B7R0.4 CC(=O)OCCCS Amb4018773 [0,0,0,0,0,0|2,0,0]=2 125 B7R0.4 CC(=O)OCCNN Amb27769313 [0,0,0,0,0,0|3,0,0]=3 126 B7R0.4 CC(=O)OCN=[N+]=[N-] Amb27596849 [0,0,0,0,0,0|4,0,0]=4 127 B7R0.4 CC(=O)OCOCCl Amb27656207 [0,0,0,0,0,0|3,0,0]=3 128 B7R0.4 CC(=O)OC\C=C/Br Amb26652075 [0,0,0,0,0,0|2,0,2]=4 129 B7R0.4 CC(=O)OC\C=C/Cl Amb27843145 [0,0,0,0,0,0|2,0,2]=4 130 B7R0.4 CC(=O)OC\C=C\Br Amb27467221 [0,0,0,0,0,0|2,0,2]=4 131 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,0,0,0,0,0|2,0,1]=3 132 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,0,0,0,0,0|2,0,1]=3 133 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,0,0,0,0,0|2,0,0]=2 134 B7R0.4 CC(=O)SCCCCl Amb3940270 [0,0,0,0,0,0|2,0,0]=2 135 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [0,0,0,0,0,0|1,0,2]=3 136 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [0,0,0,0,0,0|1,0,2]=3 137 B7R0.4 CC(=S)OCCCO Amb28381661 [0,0,0,0,0,0|2,1,0]=3 138 B7R0.4 CC(Br)CCCCCl Amb27858670 [0,0,0,0,0,0|2,0,1]=3 139 B7R0.4 CC(C)=C=CCCO Amb27265946 [0,0,0,0,0,0|2,0,2]=4 140 B7R0.4 CC(C)=CCCC#N Amb18124144 [0,0,0,0,0,0|2,0,2]=4 141 B7R0.4 CC(C)=CCCC=O Amb17593168 [0,0,0,0,0,0|2,0,2]=4 142 B7R0.4 CC(C)=CCCCN Amb18641749 [0,0,0,0,0,0|2,0,1]=3 143 B7R0.4 CC(C)=CCCCO Amb26478086 [0,0,0,0,0,0|2,0,1]=3 144 B7R0.4 CC(C)=CCCON Amb35588109 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.4 CC(C)=COCCO Amb27662198 [0,0,0,0,0,0|3,0,1]=4 146 B7R0.4 CC(C)=NCCCN Amb28126946 [0,0,0,0,0,0|3,0,0]=3 147 B7R0.4 CC(C)=NOCCCl Amb27467636 [0,0,0,0,0,0|4,0,0]=4 148 B7R0.4 CC(C)=NOCCO Amb8385274 [0,0,0,0,0,0|4,0,0]=4 149 B7R0.4 CC(C)CCCC#N Amb21811944 [0,0,0,0,0,0|2,0,2]=4 150 B7R0.4 CC(C)CCCC=O Amb17940235 [0,0,0,0,0,0|2,0,2]=4 151 B7R0.4 CC(C)CCCCBr Amb2721514 [0,0,0,0,0,0|2,0,1]=3 152 B7R0.4 CC(C)CCCCCl Amb20670590 [0,0,0,0,0,0|2,0,1]=3 153 B7R0.4 CC(C)CCCCN Amb33548422 [0,0,0,0,0,0|2,0,1]=3 154 B7R0.4 CC(C)CCCCN Amb9304907 [0,0,0,0,0,0|2,0,1]=3 155 B7R0.4 CC(C)CCCCO Amb3939382 [0,0,0,0,0,0|2,0,1]=3 156 B7R0.4 CC(C)CCCCS Amb32788388 [0,0,0,0,0,0|2,0,1]=3 157 B7R0.4 CC(C)CCCON Amb28315398 [0,0,0,0,0,0|3,0,1]=4 158 B7R0.4 CC(C)CCNCN Amb27194901 [0,0,0,0,0,0|3,0,1]=4 159 B7R0.4 CC(C)CCNCO Amb27403355 [0,0,0,0,0,0|3,0,1]=4 160 B7R0.4 CC(C)CNCCCl Amb17334145 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.4 CC(C)CNCCI Amb27801831 [0,0,0,0,0,0|3,0,1]=4 162 B7R0.4 CC(C)CNCCN Amb17091016 [0,0,0,0,0,0|3,0,1]=4 163 B7R0.4 CC(C)CNCCO Amb22587152 [0,0,0,0,0,0|3,0,1]=4 164 B7R0.4 CC(C)CNCCO Amb6707299 [0,0,0,0,0,0|3,0,1]=4 165 B7R0.4 CC(C)CNCCS Amb24616771 [0,0,0,0,0,0|3,0,1]=4 166 B7R0.4 CC(C)COCCBr Amb6255231 [0,0,0,0,0,0|3,0,1]=4 167 B7R0.4 CC(C)COCCN Amb33548979 [0,0,0,0,0,0|3,0,1]=4 168 B7R0.4 CC(C)COCCN Amb6247554 [0,0,0,0,0,0|3,0,1]=4 169 B7R0.4 CC(C)COCCO Amb3939640 [0,0,0,0,0,0|3,0,1]=4 170 B7R0.4 CC(C)COCCS Amb24589392 [0,0,0,0,0,0|3,0,1]=4 171 B7R0.4 CC(C)CSCCCl Amb9304957 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.4 CC(C)CSCCN Amb28934790 [0,0,0,0,0,0|3,0,1]=4 173 B7R0.4 CC(C)CSCCN Amb6274135 [0,0,0,0,0,0|3,0,1]=4 174 B7R0.4 CC(C)NCCCF Amb27753882 [0,0,0,0,0,0|3,0,1]=4 175 B7R0.4 CC(C)NCCCN Amb8515462 [0,0,0,0,0,0|3,0,1]=4 176 B7R0.4 CC(C)NCCCO Amb22492397 [0,0,0,0,0,0|3,0,1]=4 177 B7R0.4 CC(C)NCCCO Amb4422880 [0,0,0,0,0,0|3,0,1]=4 178 B7R0.4 CC(C)OCCCBr Amb8828214 [0,0,0,0,0,0|3,0,1]=4 179 B7R0.4 CC(C)OCCCCl Amb6255095 [0,0,0,0,0,0|3,0,1]=4 180 B7R0.4 CC(C)OCCCN Amb6608864 [0,0,0,0,0,0|3,0,1]=4 181 B7R0.4 CC(C)OCCCN Amb6892638 [0,0,0,0,0,0|3,0,1]=4 182 B7R0.4 CC(C)OCCCO Amb10608350 [0,0,0,0,0,0|3,0,1]=4 183 B7R0.4 CC(C)OCCCS Amb24551906 [0,0,0,0,0,0|3,0,1]=4 184 B7R0.4 CC(C)SCCCBr Amb19053955 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.4 CC(C)SCCCN Amb10075505 [0,0,0,0,0,0|3,0,1]=4 186 B7R0.4 CC(C)SCCCO Amb17502841 [0,0,0,0,0,0|3,0,1]=4 187 B7R0.4 CC(Cl)CCCC=O Amb27983674 [0,0,0,0,0,0|2,0,2]=4 188 B7R0.4 CC(Cl)CNCCCl Amb24442200 [0,0,0,0,0,0|3,0,1]=4 189 B7R0.4 CC(Cl)CNCCCl Amb32653331 [0,0,0,0,0,0|3,0,1]=4 190 B7R0.4 CC(F)CCCCCl Amb27596141 [0,0,0,0,0,0|2,0,1]=3 191 B7R0.4 CC(F)CSCCN Amb27782477 [0,0,0,0,0,0|3,0,1]=4 192 B7R0.4 CC(N)CCCCBr Amb27814547 [0,0,0,0,0,0|2,0,1]=3 193 B7R0.4 CC(N)CCCCCl Amb27867737 [0,0,0,0,0,0|2,0,1]=3 194 B7R0.4 CC(N)CCCCF Amb25954668 [0,0,0,0,0,0|2,0,1]=3 195 B7R0.4 CC(N)CCCCN Amb25214697 [0,0,0,0,0,0|2,0,1]=3 196 B7R0.4 CC(N)CCCCN Amb33551364 [0,0,0,0,0,0|2,0,1]=3 197 B7R0.4 CC(N)CCCCO Amb17569907 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.4 CC(N)CCCCO Amb28934868 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.4 CC(N)CNCCN Amb28198270 [0,0,0,0,0,0|3,0,1]=4 200 B7R0.4 CC(N)CSCCF Amb27233247 [0,0,0,0,0,0|3,0,1]=4 201 B7R0.4 CC(O)CCCC=O Amb18641887 [0,0,0,0,0,0|1,0,3]=4 202 B7R0.4 CC(O)CCCCF Amb27486303 [0,0,0,0,0,0|1,0,2]=3 203 B7R0.4 CC(O)CCCCN Amb17569903 [0,0,0,0,0,0|1,0,2]=3 204 B7R0.4 CC(O)CCCCO Amb22227757 [0,0,0,0,0,0|1,0,2]=3 205 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [0,0,0,0,0,0|0,1,2]=3 206 B7R0.4 CC(O)CNCCN Amb4034606 [0,0,0,0,0,0|2,0,2]=4 207 B7R0.4 CC(O)CNCCO Amb4020001 [0,0,0,0,0,0|2,0,2]=4 208 B7R0.4 CC(O)CNCCS Amb27838396 [0,0,0,0,0,0|2,0,2]=4 209 B7R0.4 CC(O)COCCCl Amb27410199 [0,0,0,0,0,0|2,0,2]=4 210 B7R0.4 CC(O)COCCN Amb27404532 [0,0,0,0,0,0|2,0,2]=4 211 B7R0.4 CC(O)CSCCO Amb22055428 [0,0,0,0,0,0|2,0,2]=4 212 B7R0.4 CC(O)CSCCS Amb28074830 [0,0,0,0,0,0|2,0,2]=4 213 B7R0.4 CC(S)CCCCN Amb32788406 [0,0,0,0,0,0|1,1,1]=3 214 B7R0.4 CC(S)COCCN Amb32788415 [0,0,0,0,0,0|2,1,1]=4 215 B7R0.4 CCC#CCC(=O)O Amb26515701 [0,0,0,0,0,0|1,0,2]=3 216 B7R0.4 CCC#CCC(C)=O Amb28040888 [0,0,0,0,0,0|0,0,2]=2 217 B7R0.4 CCC#CCC(C)C Amb6336495 [0,0,0,0,0,0|1,0,3]=4 218 B7R0.4 CCC#CCC(C)O Amb22045231 [0,0,0,0,0,0|0,0,4]=4 219 B7R0.4 CCC#CC[C@@H](C)O Amb27659866 [0,0,0,0,0,0|0,0,4]=4 220 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,0,0,0,0,0|0,0,3]=3 221 B7R0.4 CCCC#CC(=O)O Amb2721706 [0,0,0,0,0,0|1,0,2]=3 222 B7R0.4 CCCC#CC(C)=O Amb26844271 [0,0,0,0,0,0|0,0,2]=2 223 B7R0.4 CCCC#CC(C)Br Amb28384079 [0,0,0,0,0,0|1,0,3]=4 224 B7R0.4 CCCC#CC(C)O Amb24273363 [0,0,0,0,0,0|0,0,4]=4 225 B7R0.4 CCCC#CC(N)=O Amb27175227 [0,0,0,0,0,0|1,0,2]=3 226 B7R0.4 CCCC#C[C@@H](C)O Amb27826359 [0,0,0,0,0,0|0,0,4]=4 227 B7R0.4 CCCCC=C(C)C Amb22228888 [0,0,0,0,0,0|1,0,1]=2 228 B7R0.4 CCCCCB(O)O Amb2447470 [0,0,0,0,0,0|2,0,1]=3 229 B7R0.4 CCCCCC(=N)N Amb19890171 [0,0,0,0,0,0|2,0,0]=2 230 B7R0.4 CCCCCC(=N)N Amb2696574 [0,0,0,0,0,0|2,0,0]=2 231 B7R0.4 CCCCCC(=N)N Amb35747068 [0,0,0,0,0,0|2,0,0]=2 232 B7R0.4 CCCCCC(=O)F Amb26061517 [0,0,0,0,0,0|1,0,0]=1 233 B7R0.4 CCCCCC(=O)O Amb3939846 [0,0,0,0,0,0|1,0,0]=1 234 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [0,0,0,0,0,0|1,0,0]=1 235 B7R0.4 CCCCCC(C)=O Amb6608885 [0,0,0,0,0,0|0,0,0]=0 236 B7R0.4 CCCCCC(C)Br Amb3940202 [0,0,0,0,0,0|1,0,1]=2 237 B7R0.4 CCCCCC(C)C Amb8513253 [0,0,0,0,0,0|1,0,1]=2 238 B7R0.4 CCCCCC(C)Cl Amb22228752 [0,0,0,0,0,0|1,0,1]=2 239 B7R0.4 CCCCCC(C)N Amb21962698 [0,0,0,0,0,0|1,0,1]=2 240 B7R0.4 CCCCCC(C)N Amb3939364 [0,0,0,0,0,0|1,0,1]=2 241 B7R0.4 CCCCCC(C)O Amb8383668 [0,0,0,0,0,0|0,0,2]=2 242 B7R0.4 CCCCCC(C)S Amb17939452 [0,0,0,0,0,0|0,1,1]=2 243 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [0,0,0,0,0,0|2,0,1]=3 244 B7R0.4 CCCCCC(F)Br Amb24641242 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.4 CCCCCC(N)=S Amb6246072 [0,0,0,0,0,0|1,1,0]=2 246 B7R0.4 CCCCCC(O)Cl Amb27232933 [0,0,0,0,0,0|1,0,2]=3 247 B7R0.4 CCCCCC(O)O Amb25921998 [0,0,0,0,0,0|1,0,2]=3 248 B7R0.4 CCCCCN(C)O Amb33428427 [0,0,0,0,0,0|1,0,1]=2 249 B7R0.4 CCCCCS(=O)Cl Amb32720370 [0,0,0,0,0,0|2,0,0]=2 250 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [0,0,0,0,0,0|2,0,0]=2 251 B7R0.4 CCCCCS(C)=O Amb27457494 [0,0,0,0,0,0|1,0,0]=1 252 B7R0.4 CCCCCS(N)=O Amb32720371 [0,0,0,0,0,0|2,0,0]=2 253 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [0,0,0,0,0,0|1,0,1]=2 254 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [0,0,0,0,0,0|0,0,2]=2 255 B7R0.4 CCCCC[C@H](C)N Amb8516349 [0,0,0,0,0,0|1,0,1]=2 256 B7R0.4 CCCCC[C@H](C)O Amb8395591 [0,0,0,0,0,0|0,0,2]=2 257 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [0,0,0,0,0,0|2,0,0]=2 258 B7R0.4 CCCCNC(=N)N Amb19748357 [0,0,0,0,0,0|3,0,0]=3 259 B7R0.4 CCCCNC(=N)N Amb32653258 [0,0,0,0,0,0|3,0,0]=3 260 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,0,0,0,0,0|2,0,0]=2 261 B7R0.4 CCCCNC(C)=N Amb27663050 [0,0,0,0,0,0|2,0,0]=2 262 B7R0.4 CCCCNC(C)=O Amb5835711 [0,0,0,0,0,0|1,0,0]=1 263 B7R0.4 CCCCNC(C)C Amb2111112 [0,0,0,0,0,0|2,0,1]=3 264 B7R0.4 CCCCNC(C)C Amb6251422 [0,0,0,0,0,0|2,0,1]=3 265 B7R0.4 CCCCNC(N)=O Amb6663202 [0,0,0,0,0,0|2,0,0]=2 266 B7R0.4 CCCCNC(N)=S Amb1152044 [0,0,0,0,0,0|2,1,0]=3 267 B7R0.4 CCCCOB(O)O Amb25687500 [0,0,0,0,0,0|3,0,1]=4 268 B7R0.4 CCCCOC(=O)Cl Amb6608833 [0,0,0,0,0,0|2,0,0]=2 269 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [0,0,0,0,0,0|2,1,0]=3 270 B7R0.4 CCCCOC(C)=O Amb6608782 [0,0,0,0,0,0|1,0,0]=1 271 B7R0.4 CCCCOC(C)Cl Amb17689402 [0,0,0,0,0,0|2,0,1]=3 272 B7R0.4 CCCCOC(C)O Amb26537694 [0,0,0,0,0,0|1,0,2]=3 273 B7R0.4 CCCCOC(N)=O Amb4136361 [0,0,0,0,0,0|2,0,0]=2 274 B7R0.4 CCCCOP(Cl)Cl Amb4297340 [0,0,0,0,0,0|4,0,0]=4 275 B7R0.4 CCCCO[PH](=O)O Amb26035392 [0,0,0,0,0,0|3,0,0]=3 276 B7R0.4 CCCCSC(=N)N Amb10552525 [0,0,0,0,0,0|3,0,0]=3 277 B7R0.4 CCCCSC(=N)N Amb4007584 [0,0,0,0,0,0|3,0,0]=3 278 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,0,0,0,0,0|2,0,0]=2 279 B7R0.4 CCCCSC(C)C Amb4020661 [0,0,0,0,0,0|2,0,1]=3 280 B7R0.4 CCCCSC(C)O Amb27191967 [0,0,0,0,0,0|1,0,2]=3 281 B7R0.4 CCCC\N=[N+](/C)[O-] Amb28135976 [0,0,0,0,0,0|2,0,1]=3 282 B7R0.4 CCCNCC(=O)O Amb10609640 [0,0,0,0,0,0|2,0,0]=2 283 B7R0.4 CCCNCC(=O)O Amb1110628 [0,0,0,0,0,0|2,0,0]=2 284 B7R0.4 CCCNCC(C)=O Amb26954588 [0,0,0,0,0,0|1,0,0]=1 285 B7R0.4 CCCNCC(C)C Amb6258024 [0,0,0,0,0,0|2,0,1]=3 286 B7R0.4 CCCNCC(C)O Amb9359420 [0,0,0,0,0,0|1,0,2]=3 287 B7R0.4 CCCNCC(C)S Amb18124358 [0,0,0,0,0,0|1,1,1]=3 288 B7R0.4 CCCNCC(Cl)Cl Amb28064059 [0,0,0,0,0,0|3,0,1]=4 289 B7R0.4 CCCNCC(F)F Amb13951924 [0,0,0,0,0,0|3,0,1]=4 290 B7R0.4 CCCNCC(F)F Amb8853727 [0,0,0,0,0,0|3,0,1]=4 291 B7R0.4 CCCNCC(N)=O Amb1124632 [0,0,0,0,0,0|2,0,0]=2 292 B7R0.4 CCCNCC(N)=O Amb28934788 [0,0,0,0,0,0|2,0,0]=2 293 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [0,0,0,0,0,0|2,0,1]=3 294 B7R0.4 CCCNNC(N)=O Amb27405031 [0,0,0,0,0,0|3,0,0]=3 295 B7R0.4 CCCNNC(N)=S Amb19514593 [0,0,0,0,0,0|3,1,0]=4 296 B7R0.4 CCCNOC(C)C Amb27203616 [0,0,0,0,0,0|3,0,1]=4 297 B7R0.4 CCCN\N=C(\C)N Amb27421320 [0,0,0,0,0,0|3,0,0]=3 298 B7R0.4 CCCOCB(O)O Amb27461328 [0,0,0,0,0,0|3,0,1]=4 299 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,0,0,0,0,0|2,0,0]=2 300 B7R0.4 CCCOCC(=O)O Amb8874504 [0,0,0,0,0,0|2,0,0]=2 301 B7R0.4 CCCOCC(N)=O Amb27844884 [0,0,0,0,0,0|2,0,0]=2 302 B7R0.4 CCCOCC(N)=S Amb8874828 [0,0,0,0,0,0|2,1,0]=3 303 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [0,0,0,0,0,0|2,0,1]=3 304 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [0,0,0,0,0,0|1,0,2]=3 305 B7R0.4 CCCONC(C)=O Amb27764366 [0,0,0,0,0,0|2,0,0]=2 306 B7R0.4 CCCONC(N)=O Amb2899788 [0,0,0,0,0,0|3,0,0]=3 307 B7R0.4 CCCSCC(=O)O Amb1137113 [0,0,0,0,0,0|2,0,0]=2 308 B7R0.4 CCCSCC(C)=O Amb9668676 [0,0,0,0,0,0|1,0,0]=1 309 B7R0.4 CCCSCC(C)C Amb4017817 [0,0,0,0,0,0|2,0,1]=3 310 B7R0.4 CCCSCC(C)O Amb27463818 [0,0,0,0,0,0|1,0,2]=3 311 B7R0.4 CCCSCC(C)S Amb32788151 [0,0,0,0,0,0|1,1,1]=3 312 B7R0.4 CCCSCC(N)=O Amb27424658 [0,0,0,0,0,0|2,0,0]=2 313 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [0,0,0,0,0,0|1,0,2]=3 314 B7R0.4 CCCSSC(C)C Amb25952313 [0,0,0,0,0,0|3,0,1]=4 315 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [0,0,0,0,0,0|0,0,2]=2 316 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [0,0,0,0,0,0|2,0,2]=4 317 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [0,0,0,0,0,0|1,0,2]=3 318 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [0,0,0,0,0,0|1,0,2]=3 319 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,0,0,0,0,0|0,0,2]=2 320 B7R0.4 CCC\C=C\C(C)C Amb4019553 [0,0,0,0,0,0|1,0,3]=4 321 B7R0.4 CCC\C=C\C(C)N Amb33374704 [0,0,0,0,0,0|1,0,3]=4 322 B7R0.4 CCC\C=C\C(C)O Amb25083446 [0,0,0,0,0,0|0,0,4]=4 323 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [0,0,0,0,0,0|1,0,2]=3 324 B7R0.4 CCC\C=C\[C@@H](C)N Amb33327161 [0,0,0,0,0,0|1,0,3]=4 325 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [0,0,0,0,0,0|0,0,4]=4 326 B7R0.4 CCC\C=C\[C@H](C)N Amb33327160 [0,0,0,0,0,0|1,0,3]=4 327 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [0,0,0,0,0,0|0,0,4]=4 328 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [0,0,0,0,0,0|2,0,2]=4 329 B7R0.4 CCC\C=N\S(C)=O Amb29858759 [0,0,0,0,0,0|2,0,1]=3 330 B7R0.4 CCN=C=CC(C)=O Amb24481402 [0,0,0,0,0,0|1,0,2]=3 331 B7R0.4 CCNCC=C(Cl)Cl Amb35684045 [0,0,0,0,0,0|3,0,1]=4 332 B7R0.4 CCNCCC(=O)O Amb28934794 [0,0,0,0,0,0|2,0,0]=2 333 B7R0.4 CCNCCC(=O)O Amb7766402 [0,0,0,0,0,0|2,0,0]=2 334 B7R0.4 CCNCCC(C)=O Amb18641851 [0,0,0,0,0,0|1,0,0]=1 335 B7R0.4 CCNCCC(C)C Amb6244455 [0,0,0,0,0,0|2,0,1]=3 336 B7R0.4 CCNCCC(C)O Amb27239293 [0,0,0,0,0,0|1,0,2]=3 337 B7R0.4 CCNCCC(N)=O Amb33533384 [0,0,0,0,0,0|2,0,0]=2 338 B7R0.4 CCNCCC(N)=O Amb35749820 [0,0,0,0,0,0|2,0,0]=2 339 B7R0.4 CCNCCC(N)=S Amb17231882 [0,0,0,0,0,0|2,1,0]=3 340 B7R0.4 CCNCCN(C)C Amb1128271 [0,0,0,0,0,0|3,0,0]=3 341 B7R0.4 CCNNCC(=O)O Amb28326075 [0,0,0,0,0,0|3,0,0]=3 342 B7R0.4 CCOCCC(=N)N Amb2696677 [0,0,0,0,0,0|3,0,0]=3 343 B7R0.4 CCOCCC(=N)N Amb33551393 [0,0,0,0,0,0|3,0,0]=3 344 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,0,0,0,0,0|2,0,0]=2 345 B7R0.4 CCOCCC(=O)O Amb3939859 [0,0,0,0,0,0|2,0,0]=2 346 B7R0.4 CCOCCC(C)=O Amb7764636 [0,0,0,0,0,0|1,0,0]=1 347 B7R0.4 CCOCCC(C)Cl Amb28422675 [0,0,0,0,0,0|2,0,1]=3 348 B7R0.4 CCOCCC(C)N Amb7772189 [0,0,0,0,0,0|2,0,1]=3 349 B7R0.4 CCOCCC(C)O Amb27852957 [0,0,0,0,0,0|1,0,2]=3 350 B7R0.4 CCOCCC(Cl)Cl Amb27984892 [0,0,0,0,0,0|3,0,1]=4 351 B7R0.4 CCOCCC(N)=S Amb6263797 [0,0,0,0,0,0|2,1,0]=3 352 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,0,0,0,0,0|3,0,0]=3 353 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [0,0,0,0,0,0|3,0,0]=3 354 B7R0.4 CCOCCS(N)=O Amb32720346 [0,0,0,0,0,0|3,0,0]=3 355 B7R0.4 CCOCC[C@H](C)N Amb24439507 [0,0,0,0,0,0|2,0,1]=3 356 B7R0.4 CCOCC[C@H](C)O Amb27946039 [0,0,0,0,0,0|1,0,2]=3 357 B7R0.4 CCOCNC(N)=O Amb25765493 [0,0,0,0,0,0|3,0,0]=3 358 B7R0.4 CCOCOC(=O)Cl Amb27623794 [0,0,0,0,0,0|3,0,0]=3 359 B7R0.4 CCO\C=C\C(=O)Cl Amb33943049 [0,0,0,0,0,0|2,0,2]=4 360 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [0,0,0,0,0,0|2,0,2]=4 361 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [0,0,0,0,0,0|1,0,2]=3 362 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [0,0,0,0,0,0|3,0,1]=4 363 B7R0.4 CCO\N=C\C(N)=O Amb27949484 [0,0,0,0,0,0|3,0,1]=4 364 B7R0.4 CCSCCC(=N)N Amb6680836 [0,0,0,0,0,0|3,0,0]=3 365 B7R0.4 CCSCCC(=O)O Amb6273140 [0,0,0,0,0,0|2,0,0]=2 366 B7R0.4 CCSCCC(C)=O Amb9655821 [0,0,0,0,0,0|1,0,0]=1 367 B7R0.4 CCSCCC(C)Br Amb33435746 [0,0,0,0,0,0|2,0,1]=3 368 B7R0.4 CCSCCC(C)C Amb22230685 [0,0,0,0,0,0|2,0,1]=3 369 B7R0.4 CCSCCC(C)Cl Amb28458510 [0,0,0,0,0,0|2,0,1]=3 370 B7R0.4 CCSCCC(C)N Amb19149259 [0,0,0,0,0,0|2,0,1]=3 371 B7R0.4 CCSCCC(C)O Amb28048927 [0,0,0,0,0,0|1,0,2]=3 372 B7R0.4 CCSCCC(N)=O Amb27258252 [0,0,0,0,0,0|2,0,0]=2 373 B7R0.4 CCSCCC(N)=S Amb17307560 [0,0,0,0,0,0|2,1,0]=3 374 B7R0.4 CCSCCN(C)C Amb27198418 [0,0,0,0,0,0|3,0,0]=3 375 B7R0.4 CCSCCN(C)O Amb33324043 [0,0,0,0,0,0|2,0,1]=3 376 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [0,0,0,0,0,0|2,0,1]=3 377 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [0,0,0,0,0,0|1,0,2]=3 378 B7R0.4 CCSCC[C@H](C)N Amb33323728 [0,0,0,0,0,0|2,0,1]=3 379 B7R0.4 CCSCC[C@H](C)O Amb33323733 [0,0,0,0,0,0|1,0,2]=3 380 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [0,0,0,0,0,0|3,0,0]=3 381 B7R0.4 CCSSCC(C)=O Amb28316151 [0,0,0,0,0,0|2,0,0]=2 382 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [0,0,0,0,0,0|1,0,2]=3 383 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [0,0,0,0,0,0|1,0,2]=3 384 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [0,0,0,0,0,0|0,0,2]=2 385 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [0,0,0,0,0,0|1,0,2]=3 386 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [0,0,0,0,0,0|1,0,2]=3 387 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [0,0,0,0,0,0|0,0,2]=2 388 B7R0.4 CC\C=C\CC(C)Br Amb33009075 [0,0,0,0,0,0|1,0,3]=4 389 B7R0.4 CC\C=C\CC(C)C Amb4016285 [0,0,0,0,0,0|1,0,3]=4 390 B7R0.4 CC\C=C\CC(C)N Amb25357984 [0,0,0,0,0,0|1,0,3]=4 391 B7R0.4 CC\C=C\CC(C)O Amb33079090 [0,0,0,0,0,0|0,0,4]=4 392 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [0,0,0,0,0,0|1,1,2]=4 393 B7R0.4 CC\C=C\CN(C)O Amb33268704 [0,0,0,0,0,0|1,0,3]=4 394 B7R0.4 CC\C=C\C[C@@H](C)N Amb33225016 [0,0,0,0,0,0|1,0,3]=4 395 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [0,0,0,0,0,0|0,0,4]=4 396 B7R0.4 CC\C=C\C[C@H](C)N Amb33267988 [0,0,0,0,0,0|1,0,3]=4 397 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [0,0,0,0,0,0|0,0,4]=4 398 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [0,0,0,0,0,0|2,0,2]=4 399 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [0,0,0,0,0,0|2,0,2]=4 400 B7R0.4 CC\C=N\NC(N)=O Amb26899579 [0,0,0,0,0,0|3,0,1]=4 401 B7R0.4 CN(C)CCCC#N Amb4017486 [0,0,0,0,0,0|3,0,1]=4 402 B7R0.4 CN(C)CCCC=O Amb22753951 [0,0,0,0,0,0|3,0,1]=4 403 B7R0.4 CN(C)CCCC=O Amb24117840 [0,0,0,0,0,0|3,0,1]=4 404 B7R0.4 CN(C)CCCCBr Amb18178257 [0,0,0,0,0,0|3,0,0]=3 405 B7R0.4 CN(C)CCCCBr Amb19148184 [0,0,0,0,0,0|3,0,0]=3 406 B7R0.4 CN(C)CCCCCl Amb17334150 [0,0,0,0,0,0|3,0,0]=3 407 B7R0.4 CN(C)CCCCCl Amb20668164 [0,0,0,0,0,0|3,0,0]=3 408 B7R0.4 CN(C)CCCCN Amb2687444 [0,0,0,0,0,0|3,0,0]=3 409 B7R0.4 CN(C)CCCCO Amb9273966 [0,0,0,0,0,0|3,0,0]=3 410 B7R0.4 CN(C)CCCCS Amb26480331 [0,0,0,0,0,0|3,0,0]=3 411 B7R0.4 CN(C)CCCNN Amb32652854 [0,0,0,0,0,0|4,0,0]=4 412 B7R0.4 CN(C)CCCNN Amb5722660 [0,0,0,0,0,0|4,0,0]=4 413 B7R0.4 CN(C)CCCNO Amb33272652 [0,0,0,0,0,0|4,0,0]=4 414 B7R0.4 CN(C)CCCON Amb17104868 [0,0,0,0,0,0|4,0,0]=4 415 B7R0.4 CN(C)CCCON Amb35747638 [0,0,0,0,0,0|4,0,0]=4 416 B7R0.4 CN(C)CCOCCl Amb28052737 [0,0,0,0,0,0|4,0,0]=4 417 B7R0.4 CN(C)NCCCN Amb28129327 [0,0,0,0,0,0|4,0,0]=4 418 B7R0.4 CN(N)CCCCO Amb28133877 [0,0,0,0,0,0|3,0,0]=3 419 B7R0.4 CNCC#CC(=O)O Amb27218273 [0,0,0,0,0,0|2,0,2]=4 420 B7R0.4 CNCCC=C(Cl)Cl Amb35710754 [0,0,0,0,0,0|3,0,1]=4 421 B7R0.4 CNCCCC(=O)O Amb1153115 [0,0,0,0,0,0|2,0,0]=2 422 B7R0.4 CNCCCC(=O)O Amb4521435 [0,0,0,0,0,0|2,0,0]=2 423 B7R0.4 CNCCCC(C)=O Amb27838406 [0,0,0,0,0,0|1,0,0]=1 424 B7R0.4 CNCCCC(C)C Amb32757651 [0,0,0,0,0,0|2,0,1]=3 425 B7R0.4 CNCCCC(C)C Amb8853654 [0,0,0,0,0,0|2,0,1]=3 426 B7R0.4 CNCCCC(C)O Amb17569899 [0,0,0,0,0,0|1,0,2]=3 427 B7R0.4 CNCCCC(N)=O Amb18303611 [0,0,0,0,0,0|2,0,0]=2 428 B7R0.4 CNCCCC(N)=O Amb31307731 [0,0,0,0,0,0|2,0,0]=2 429 B7R0.4 CNCCCN(C)C Amb3939356 [0,0,0,0,0,0|3,0,0]=3 430 B7R0.4 CNCCCS(C)=O Amb27827686 [0,0,0,0,0,0|2,0,0]=2 431 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [0,0,0,0,0,0|1,0,2]=3 432 B7R0.4 CNCCNC(=S)S Amb28397261 [0,0,0,0,0,0|3,1,0]=4 433 B7R0.4 CNCCNC(C)=O Amb28934797 [0,0,0,0,0,0|2,0,0]=2 434 B7R0.4 CNCCNC(C)=O Amb9256137 [0,0,0,0,0,0|2,0,0]=2 435 B7R0.4 CNCCNC(N)=O Amb18299975 [0,0,0,0,0,0|3,0,0]=3 436 B7R0.4 CNCCNS(C)=O Amb28286115 [0,0,0,0,0,0|3,0,0]=3 437 B7R0.4 CNCCOC(C)=O Amb18124262 [0,0,0,0,0,0|2,0,0]=2 438 B7R0.4 CNCCOC(C)=O Amb33621071 [0,0,0,0,0,0|2,0,0]=2 439 B7R0.4 CNCCOC(C)C Amb33538267 [0,0,0,0,0,0|3,0,1]=4 440 B7R0.4 CNCCOC(N)=O Amb25136928 [0,0,0,0,0,0|3,0,0]=3 441 B7R0.4 CNCCOC(N)=O Amb32693459 [0,0,0,0,0,0|3,0,0]=3 442 B7R0.4 CNCCSC(=N)N Amb23590673 [0,0,0,0,0,0|4,0,0]=4 443 B7R0.4 CNCCSC(C)C Amb19024679 [0,0,0,0,0,0|3,0,1]=4 444 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [0,0,0,0,0,0|2,0,2]=4 445 B7R0.4 COCC#CC(=O)O Amb33544473 [0,0,0,0,0,0|2,0,2]=4 446 B7R0.4 COCC#CC(C)=O Amb28053950 [0,0,0,0,0,0|1,0,2]=3 447 B7R0.4 COCC#CC(N)=O Amb33495809 [0,0,0,0,0,0|2,0,2]=4 448 B7R0.4 COCCCB(O)O Amb27754195 [0,0,0,0,0,0|3,0,1]=4 449 B7R0.4 COCCCC(=N)N Amb19269156 [0,0,0,0,0,0|3,0,0]=3 450 B7R0.4 COCCCC(=N)N Amb6266770 [0,0,0,0,0,0|3,0,0]=3 451 B7R0.4 COCCCC(=O)O Amb6275629 [0,0,0,0,0,0|2,0,0]=2 452 B7R0.4 COCCCC(C)=O Amb9031556 [0,0,0,0,0,0|1,0,0]=1 453 B7R0.4 COCCCC(C)Br Amb18185551 [0,0,0,0,0,0|2,0,1]=3 454 B7R0.4 COCCCC(C)Cl Amb26489622 [0,0,0,0,0,0|2,0,1]=3 455 B7R0.4 COCCCC(C)N Amb9031757 [0,0,0,0,0,0|2,0,1]=3 456 B7R0.4 COCCCC(C)O Amb4020863 [0,0,0,0,0,0|1,0,2]=3 457 B7R0.4 COCCCC(C)S Amb25810805 [0,0,0,0,0,0|1,1,1]=3 458 B7R0.4 COCCCC(Cl)Cl Amb28396614 [0,0,0,0,0,0|3,0,1]=4 459 B7R0.4 COCCCC(N)=S Amb6270649 [0,0,0,0,0,0|2,1,0]=3 460 B7R0.4 COCCCN(C)C Amb2779456 [0,0,0,0,0,0|3,0,0]=3 461 B7R0.4 COCCCN(C)C Amb30585124 [0,0,0,0,0,0|3,0,0]=3 462 B7R0.4 COCCCN(C)O Amb33377831 [0,0,0,0,0,0|2,0,1]=3 463 B7R0.4 COCCCS(=O)Cl Amb26013061 [0,0,0,0,0,0|3,0,0]=3 464 B7R0.4 COCCCS(=O)[O-] Amb27974844 [0,0,0,0,0,0|3,0,0]=3 465 B7R0.4 COCCCS(N)=O Amb32720360 [0,0,0,0,0,0|3,0,0]=3 466 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [0,0,0,0,0,0|2,0,1]=3 467 B7R0.4 COCCC[C@@H](C)N Amb24749054 [0,0,0,0,0,0|2,0,1]=3 468 B7R0.4 COCCC[C@@H](C)O Amb33428680 [0,0,0,0,0,0|1,0,2]=3 469 B7R0.4 COCCC[C@H](C)N Amb27164382 [0,0,0,0,0,0|2,0,1]=3 470 B7R0.4 COCCC[C@H](C)O Amb27396064 [0,0,0,0,0,0|1,0,2]=3 471 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [0,0,0,0,0,0|3,0,0]=3 472 B7R0.4 COCCNC(=N)N Amb22587024 [0,0,0,0,0,0|4,0,0]=4 473 B7R0.4 COCCNC(=N)N Amb33547913 [0,0,0,0,0,0|4,0,0]=4 474 B7R0.4 COCCNC(=N)N Amb845676 [0,0,0,0,0,0|4,0,0]=4 475 B7R0.4 COCCNC(C)=O Amb3358082 [0,0,0,0,0,0|2,0,0]=2 476 B7R0.4 COCCNC(C)C Amb2785295 [0,0,0,0,0,0|3,0,1]=4 477 B7R0.4 COCCNC(N)=O Amb1104938 [0,0,0,0,0,0|3,0,0]=3 478 B7R0.4 COCCNC(N)=S Amb379929 [0,0,0,0,0,0|3,1,0]=4 479 B7R0.4 COCCNN(C)C Amb28284648 [0,0,0,0,0,0|4,0,0]=4 480 B7R0.4 COCCOC(=O)Cl Amb2689125 [0,0,0,0,0,0|3,0,0]=3 481 B7R0.4 COCCOC(=S)[S-] Amb20671928 [0,0,0,0,0,0|3,1,0]=4 482 B7R0.4 COCCOC(C)=O Amb4037074 [0,0,0,0,0,0|2,0,0]=2 483 B7R0.4 COCCOC(N)=O Amb25054225 [0,0,0,0,0,0|3,0,0]=3 484 B7R0.4 COCCSC(=N)N Amb20675994 [0,0,0,0,0,0|4,0,0]=4 485 B7R0.4 COCOCC(=N)N Amb27259902 [0,0,0,0,0,0|4,0,0]=4 486 B7R0.4 COCOCC(=N)N Amb28934863 [0,0,0,0,0,0|4,0,0]=4 487 B7R0.4 COCOCC(=O)O Amb28059312 [0,0,0,0,0,0|3,0,0]=3 488 B7R0.4 COCSCC(=O)O Amb27466837 [0,0,0,0,0,0|3,0,0]=3 489 B7R0.4 COCSCC(C)C Amb28142603 [0,0,0,0,0,0|3,0,1]=4 490 B7R0.4 COCSCC(C)Cl Amb27401952 [0,0,0,0,0,0|3,0,1]=4 491 B7R0.4 COC\C=C\C(=O)O Amb33986212 [0,0,0,0,0,0|2,0,2]=4 492 B7R0.4 COC\C=C\C(C)=O Amb33359822 [0,0,0,0,0,0|1,0,2]=3 493 B7R0.4 CONCCC(C)C Amb20669574 [0,0,0,0,0,0|3,0,1]=4 494 B7R0.4 CONCCC(C)F Amb28120126 [0,0,0,0,0,0|3,0,1]=4 495 B7R0.4 CONCCS(C)=O Amb27469149 [0,0,0,0,0,0|3,0,0]=3 496 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [0,0,0,0,0,0|2,0,2]=4 497 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [0,0,0,0,0,0|2,0,2]=4 498 B7R0.4 CP(O)OCCCCl Amb28254545 [0,0,0,0,0,0|3,0,1]=4 499 B7R0.4 CS(=O)CCCC#N Amb26007802 [0,0,0,0,0,0|2,0,1]=3 500 B7R0.4 CS(=O)CCCCBr Amb27874454 [0,0,0,0,0,0|2,0,0]=2 501 B7R0.4 CS(=O)CCCCCl Amb27253421 [0,0,0,0,0,0|2,0,0]=2 502 B7R0.4 CS(=O)CCCCN Amb17617794 [0,0,0,0,0,0|2,0,0]=2 503 B7R0.4 CS(=O)CCCON Amb28324081 [0,0,0,0,0,0|3,0,0]=3 504 B7R0.4 CS(=O)CCN=C=O Amb27169747 [0,0,0,0,0,0|3,0,1]=4 505 B7R0.4 CS(=O)CCN=[N+]=[N-] Amb28285203 [0,0,0,0,0,0|4,0,0]=4 506 B7R0.4 CS(=O)CCNC#N Amb27622587 [0,0,0,0,0,0|3,0,1]=4 507 B7R0.4 CS(=O)NCCCCl Amb27265745 [0,0,0,0,0,0|3,0,0]=3 508 B7R0.4 CSCCCC(=N)N Amb27829199 [0,0,0,0,0,0|3,0,0]=3 509 B7R0.4 CSCCCC(=O)O Amb17503622 [0,0,0,0,0,0|2,0,0]=2 510 B7R0.4 CSCCCC(C)=O Amb25122381 [0,0,0,0,0,0|1,0,0]=1 511 B7R0.4 CSCCCC(C)Br Amb27798199 [0,0,0,0,0,0|2,0,1]=3 512 B7R0.4 CSCCCC(C)C Amb28289938 [0,0,0,0,0,0|2,0,1]=3 513 B7R0.4 CSCCCC(C)N Amb18124381 [0,0,0,0,0,0|2,0,1]=3 514 B7R0.4 CSCCCC(C)O Amb25958947 [0,0,0,0,0,0|1,0,2]=3 515 B7R0.4 CSCCCC(N)=S Amb28048945 [0,0,0,0,0,0|2,1,0]=3 516 B7R0.4 CSCCCN(C)O Amb33198763 [0,0,0,0,0,0|2,0,1]=3 517 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [0,0,0,0,0,0|2,0,1]=3 518 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [0,0,0,0,0,0|1,0,2]=3 519 B7R0.4 CSCCC[C@H](C)N Amb33200176 [0,0,0,0,0,0|2,0,1]=3 520 B7R0.4 CSCCC[C@H](C)O Amb33198288 [0,0,0,0,0,0|1,0,2]=3 521 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [0,0,0,0,0,0|3,0,0]=3 522 B7R0.4 CSCCNC(=O)Cl Amb29882959 [0,0,0,0,0,0|3,0,0]=3 523 B7R0.4 CSCCNC(C)=O Amb8504699 [0,0,0,0,0,0|2,0,0]=2 524 B7R0.4 CSCCNC(N)=O Amb27424586 [0,0,0,0,0,0|3,0,0]=3 525 B7R0.4 CSCCNC(N)=S Amb24414359 [0,0,0,0,0,0|3,1,0]=4 526 B7R0.4 CSCCSC(=N)N Amb27984752 [0,0,0,0,0,0|4,0,0]=4 527 B7R0.4 CSCCSC(C)=O Amb27635033 [0,0,0,0,0,0|2,0,0]=2 528 B7R0.4 CSCSCC(=O)O Amb27858824 [0,0,0,0,0,0|3,0,0]=3 529 B7R0.4 CSCSCC(C)C Amb28324036 [0,0,0,0,0,0|3,0,1]=4 530 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,0,0,0,0,0|1,0,2]=3 531 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [0,0,0,0,0,0|1,0,2]=3 532 B7R0.4 CSSCCC(=O)O Amb26848465 [0,0,0,0,0,0|3,0,0]=3 533 B7R0.4 CSSCCC(C)N Amb28316247 [0,0,0,0,0,0|3,0,1]=4 534 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [0,0,0,0,0,0|2,0,2]=4 535 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [0,0,0,0,0,0|2,0,1]=3 536 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [0,0,0,0,0,0|1,0,2]=3 537 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [0,0,0,0,0,0|1,0,2]=3 538 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [0,0,0,0,0,0|1,0,2]=3 539 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [0,0,0,0,0,0|1,0,2]=3 540 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [0,0,0,0,0,0|2,0,2]=4 541 B7R0.4 C[C@H](F)CCCCO Amb27945000 [0,0,0,0,0,0|2,0,1]=3 542 B7R0.4 C[C@H](N)CCCCF Amb33480694 [0,0,0,0,0,0|2,0,1]=3 543 B7R0.4 C[C@H](N)CNCCF Amb27449099 [0,0,0,0,0,0|3,0,1]=4 544 B7R0.4 C[C@H](O)CCCC#N Amb27979195 [0,0,0,0,0,0|1,0,3]=4 545 B7R0.4 C[C@H](O)CCCCF Amb33196129 [0,0,0,0,0,0|1,0,2]=3 546 B7R0.4 C[C@H](O)CCCCO Amb28381637 [0,0,0,0,0,0|1,0,2]=3 547 B7R0.4 C[SiH](C)OCCCO Amb28065227 [0,0,0,0,0,0|3,1,0]=4 548 B7R0.4 C\C(Br)=C\CCCBr Amb22347606 [0,0,0,0,0,0|2,0,1]=3 549 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [0,0,0,0,0,0|2,0,2]=4 550 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [0,0,0,0,0,0|2,0,1]=3 551 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [0,0,0,0,0,0|0,0,4]=4 552 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [0,0,0,0,0,0|0,0,4]=4 553 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [0,0,0,0,0,0|1,0,2]=3 554 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,0,0,0,0,0|0,0,2]=2 555 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [0,0,0,0,0,0|1,0,3]=4 556 B7R0.4 C\C=C\CCC(C)C Amb24401080 [0,0,0,0,0,0|1,0,3]=4 557 B7R0.4 C\C=C\CCC(C)N Amb27838292 [0,0,0,0,0,0|1,0,3]=4 558 B7R0.4 C\C=C\CCC(C)O Amb32665057 [0,0,0,0,0,0|0,0,4]=4 559 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [0,0,0,0,0,0|0,0,4]=4 560 B7R0.4 C\C=C\CNC(=O)S Amb26417290 [0,0,0,0,0,0|2,0,2]=4 561 B7R0.4 C\C=C\COC(C)=O Amb6366590 [0,0,0,0,0,0|1,0,2]=3 562 B7R0.4 ClCCCC=C(Cl)Cl Amb28284505 [0,0,0,0,0,0|3,0,1]=4 563 B7R0.4 N#CCCCC(=O)O Amb33542831 [0,0,0,0,0,0|2,0,1]=3 564 B7R0.4 N#CCCCS(=O)Cl Amb32720313 [0,0,0,0,0,0|3,0,1]=4 565 B7R0.4 N#CCCCS(=O)[O-] Amb32753961 [0,0,0,0,0,0|3,0,1]=4 566 B7R0.4 N#CCCCS(N)=O Amb32720314 [0,0,0,0,0,0|3,0,1]=4 567 B7R0.4 N#CCCC[N+](=O)[O-] Amb27437950 [0,0,0,0,0,0|3,0,1]=4 568 B7R0.4 N#CCSCC(=O)O Amb6243720 [0,0,0,0,0,0|3,0,1]=4 569 B7R0.4 N#CNCCC(=O)O Amb30031691 [0,0,0,0,0,0|3,0,1]=4 570 B7R0.4 N=C(N)CCCCBr Amb4297024 [0,0,0,0,0,0|3,0,0]=3 571 B7R0.4 N=C(N)CCCCCl Amb4297063 [0,0,0,0,0,0|3,0,0]=3 572 B7R0.4 N=C(N)CCCCF Amb27486600 [0,0,0,0,0,0|3,0,0]=3 573 B7R0.4 N=C(N)CCCCN Amb25714813 [0,0,0,0,0,0|3,0,0]=3 574 B7R0.4 N=C(N)CCCCN Amb33299438 [0,0,0,0,0,0|3,0,0]=3 575 B7R0.4 N=C(N)SCCCBr Amb27970087 [0,0,0,0,0,0|4,0,0]=4 576 B7R0.4 NC(=O)CCCCBr Amb27875083 [0,0,0,0,0,0|2,0,0]=2 577 B7R0.4 NC(=O)CCCCCl Amb7782532 [0,0,0,0,0,0|2,0,0]=2 578 B7R0.4 NC(=O)CCCCO Amb3939470 [0,0,0,0,0,0|2,0,0]=2 579 B7R0.4 NC(=O)CCCCS Amb27839239 [0,0,0,0,0,0|2,0,0]=2 580 B7R0.4 NC(=O)CCSCCl Amb27430706 [0,0,0,0,0,0|3,0,0]=3 581 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,0,0,0,0,0|2,0,2]=4 582 B7R0.4 NC(=O)CNCCO Amb6714605 [0,0,0,0,0,0|3,0,0]=3 583 B7R0.4 NC(=O)COCCBr Amb25133475 [0,0,0,0,0,0|3,0,0]=3 584 B7R0.4 NC(=O)COCCCl Amb5722397 [0,0,0,0,0,0|3,0,0]=3 585 B7R0.4 NC(=O)CSCCBr Amb28193514 [0,0,0,0,0,0|3,0,0]=3 586 B7R0.4 NC(=O)CSCCO Amb6754148 [0,0,0,0,0,0|3,0,0]=3 587 B7R0.4 NC(=O)CSCCS Amb27651871 [0,0,0,0,0,0|3,0,0]=3 588 B7R0.4 NC(=O)NCCCF Amb27396406 [0,0,0,0,0,0|3,0,0]=3 589 B7R0.4 NC(=O)NCCCO Amb9248133 [0,0,0,0,0,0|3,0,0]=3 590 B7R0.4 NC(=O)NCCN=O Amb27796959 [0,0,0,0,0,0|4,0,0]=4 591 B7R0.4 NC(=O)OCCCBr Amb28316236 [0,0,0,0,0,0|3,0,0]=3 592 B7R0.4 NC(=S)CCCCBr Amb27622634 [0,0,0,0,0,0|2,1,0]=3 593 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,0,0,0,0,0|2,1,0]=3 594 B7R0.4 NCC#CCC(=O)O Amb27976019 [0,0,0,0,0,0|2,0,2]=4 595 B7R0.4 NCCC#CC(=O)O Amb32656225 [0,0,0,0,0,0|2,0,2]=4 596 B7R0.4 NCCCC=C(Cl)Cl Amb27400339 [0,0,0,0,0,0|3,0,1]=4 597 B7R0.4 NCCCCB(O)O Amb27436221 [0,0,0,0,0,0|3,0,1]=4 598 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,0,0,0,0,0|2,0,0]=2 599 B7R0.4 NCCCCC(=O)O Amb2780021 [0,0,0,0,0,0|2,0,0]=2 600 B7R0.4 NCCCCC(=O)O Amb3941646 [0,0,0,0,0,0|2,0,0]=2 601 B7R0.4 NCCCCC(=O)O Amb9825855 [0,0,0,0,0,0|2,0,0]=2 602 B7R0.4 NCCCCC(F)F Amb32812804 [0,0,0,0,0,0|3,0,1]=4 603 B7R0.4 NCCCCC(N)=O Amb18641897 [0,0,0,0,0,0|2,0,0]=2 604 B7R0.4 NCCCCC(N)=O Amb33552086 [0,0,0,0,0,0|2,0,0]=2 605 B7R0.4 NCCCCS(=O)O Amb27882127 [0,0,0,0,0,0|3,0,0]=3 606 B7R0.4 NCCCNC(=O)O Amb24093884 [0,0,0,0,0,0|3,0,0]=3 607 B7R0.4 NCCCNC(=O)S Amb27839485 [0,0,0,0,0,0|3,0,0]=3 608 B7R0.4 NCCCNC(=S)S Amb27772303 [0,0,0,0,0,0|3,1,0]=4 609 B7R0.4 NCCCNC(N)=O Amb18296186 [0,0,0,0,0,0|3,0,0]=3 610 B7R0.4 NCCCNC(N)=O Amb20622408 [0,0,0,0,0,0|3,0,0]=3 611 B7R0.4 NCCCOC(N)=O Amb26334419 [0,0,0,0,0,0|3,0,0]=3 612 B7R0.4 NCCCOC(N)=O Amb33299259 [0,0,0,0,0,0|3,0,0]=3 613 B7R0.4 NCCCOS(=O)O Amb26007874 [0,0,0,0,0,0|4,0,0]=4 614 B7R0.4 NCCNCC(=O)O Amb17608063 [0,0,0,0,0,0|3,0,0]=3 615 B7R0.4 NCCNCC(=O)O Amb33339058 [0,0,0,0,0,0|3,0,0]=3 616 B7R0.4 NCCNCC(N)=O Amb28388338 [0,0,0,0,0,0|3,0,0]=3 617 B7R0.4 NCCOCC(=O)O Amb18630146 [0,0,0,0,0,0|3,0,0]=3 618 B7R0.4 NCCOCC(=O)O Amb33550947 [0,0,0,0,0,0|3,0,0]=3 619 B7R0.4 NCCOCC(N)=O Amb18523830 [0,0,0,0,0,0|3,0,0]=3 620 B7R0.4 NCCOCC(N)=O Amb33549549 [0,0,0,0,0,0|3,0,0]=3 621 B7R0.4 NCCSCC(=O)O Amb17500446 [0,0,0,0,0,0|3,0,0]=3 622 B7R0.4 NCCSCC(=O)O Amb20622325 [0,0,0,0,0,0|3,0,0]=3 623 B7R0.4 NCCSCC(N)=O Amb6266329 [0,0,0,0,0,0|3,0,0]=3 624 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [0,0,0,0,0,0|2,0,2]=4 625 B7R0.4 NOCCCC(=O)O Amb10975956 [0,0,0,0,0,0|3,0,0]=3 626 B7R0.4 NOCCCC(=O)O Amb22011795 [0,0,0,0,0,0|3,0,0]=3 627 B7R0.4 NOCCCC(=O)O Amb31283653 [0,0,0,0,0,0|3,0,0]=3 628 B7R0.4 NS(=O)CCCCCl Amb32720307 [0,0,0,0,0,0|3,0,0]=3 629 B7R0.4 NS(=O)CCCCF Amb32720393 [0,0,0,0,0,0|3,0,0]=3 630 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [0,0,0,0,0,0|2,0,0]=2 631 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [0,0,0,0,0,0|2,0,0]=2 632 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,0,0,0,0,0|3,0,0]=3 633 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,0,0,0,0,0|3,0,0]=3 634 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,0,0,0,0,0|3,0,0]=3 635 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [0,0,0,0,0,0|3,0,0]=3 636 B7R0.4 O=C(Cl)OCCCF Amb26994902 [0,0,0,0,0,0|3,0,0]=3 637 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [0,0,0,0,0,0|2,0,2]=4 638 B7R0.4 O=C(O)C#CCCO Amb25844914 [0,0,0,0,0,0|2,0,2]=4 639 B7R0.4 O=C(O)CCCCBr Amb6608763 [0,0,0,0,0,0|2,0,0]=2 640 B7R0.4 O=C(O)CCCCCl Amb3940369 [0,0,0,0,0,0|2,0,0]=2 641 B7R0.4 O=C(O)CCCCF Amb26639920 [0,0,0,0,0,0|2,0,0]=2 642 B7R0.4 O=C(O)CCCCO Amb9214971 [0,0,0,0,0,0|2,0,0]=2 643 B7R0.4 O=C(O)CCCCS Amb17503767 [0,0,0,0,0,0|2,0,0]=2 644 B7R0.4 O=C(O)CCCNCl Amb27173950 [0,0,0,0,0,0|3,0,0]=3 645 B7R0.4 O=C(O)CCN=C=S Amb24562253 [0,0,0,0,0,0|3,0,1]=4 646 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [0,0,0,0,0,0|2,0,2]=4 647 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [0,0,0,0,0,0|3,0,1]=4 648 B7R0.4 O=C(O)CNCCF Amb28076282 [0,0,0,0,0,0|3,0,0]=3 649 B7R0.4 O=C(O)CNCCO Amb9325653 [0,0,0,0,0,0|3,0,0]=3 650 B7R0.4 O=C(O)COCCCl Amb21857870 [0,0,0,0,0,0|3,0,0]=3 651 B7R0.4 O=C(O)COCCF Amb27866609 [0,0,0,0,0,0|3,0,0]=3 652 B7R0.4 O=C(O)COCCO Amb6680914 [0,0,0,0,0,0|3,0,0]=3 653 B7R0.4 O=C(O)CSCCCl Amb18644703 [0,0,0,0,0,0|3,0,0]=3 654 B7R0.4 O=C(O)CSSCCl Amb27983630 [0,0,0,0,0,0|4,0,0]=4 655 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [0,0,0,0,0,0|2,0,2]=4 656 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [0,0,0,0,0,0|2,0,2]=4 657 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [0,0,0,0,0,0|2,0,2]=4 658 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [0,0,0,0,0,0|2,0,2]=4 659 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [0,0,0,0,0,0|2,0,2]=4 660 B7R0.4 O=C([O-])CCCCF Amb33527827 [0,0,0,0,0,0|2,0,0]=2 661 B7R0.4 O=C([O-])CCCCO Amb13952763 [0,0,0,0,0,0|2,0,0]=2 662 B7R0.4 O=C([O-])CCCCO Amb22749314 [0,0,0,0,0,0|2,0,0]=2 663 B7R0.4 O=C([O-])COCCO Amb33553026 [0,0,0,0,0,0|3,0,0]=3 664 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,0,0,0,0,0|3,0,1]=4 665 B7R0.4 O=C=NCCC(=O)O Amb26053417 [0,0,0,0,0,0|3,0,1]=4 666 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,0,0,0,0,0|2,0,1]=3 667 B7R0.4 O=CNCCC(=O)O Amb18290434 [0,0,0,0,0,0|3,0,1]=4 668 B7R0.4 O=NSCCC(=O)O Amb28429846 [0,0,0,0,0,0|4,0,0]=4 669 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [0,0,0,0,0,0|3,0,0]=3 670 B7R0.4 O=S(Cl)CCCCF Amb32720392 [0,0,0,0,0,0|3,0,0]=3 671 B7R0.4 O=S(Cl)OCCCF Amb34916628 [0,0,0,0,0,0|4,0,0]=4 672 B7R0.4 O=S([O-])CCCCCl Amb28400114 [0,0,0,0,0,0|3,0,0]=3 673 B7R0.4 O=S([O-])CCCCF Amb32754733 [0,0,0,0,0,0|3,0,0]=3 674 B7R0.4 O=S([O-])CCCCO Amb27181023 [0,0,0,0,0,0|3,0,0]=3 675 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [0,0,0,0,0,0|3,0,0]=3 676 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [0,0,0,0,0,0|3,0,0]=3 677 B7R0.4 O=[N+]([O-])OCCCBr Amb21953589 [0,0,0,0,0,0|4,0,0]=4 678 B7R0.4 OB(O)CCCCBr Amb20171450 [0,0,0,0,0,0|3,0,1]=4 679 B7R0.4 OC(Cl)CCCCCl Amb27410884 [0,0,0,0,0,0|2,0,2]=4 680 B7R0.4 OCCCC=C(F)F Amb28287397 [0,0,0,0,0,0|3,0,1]=4 681 B7R0.4 OCCCCB(O)O Amb25351122 [0,0,0,0,0,0|3,0,1]=4 682 B7R0.4 [C-]#[N+]CCCC(C)C Amb27792444 [0,0,0,0,0,0|2,0,2]=4 683 B7R0.4 [C-]#[N+]CCCN(C)C Amb1981034 [0,0,0,0,0,0|3,0,1]=4 684 B7R0.4 [N-]=[N+]=NCCC(=O)Cl Amb27831534 [0,0,0,0,0,0|4,0,0]=4 685 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [0,0,0,0,0,0|4,0,0]=4 686 B6R0.4 C#CCCC(=C)C Amb18634222 [1,0,0,0,0,0|1,0,2]=4 687 B6R0.4 C#CCCC(=O)Cl Amb26949181 [1,0,0,0,0,0|1,0,2]=4 688 B6R0.4 C#CCCC(=O)O Amb33532622 [1,0,0,0,0,0|1,0,2]=4 689 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [1,0,0,0,0,0|1,0,2]=4 690 B6R0.4 C#CCCC(C)=O Amb8869638 [1,0,0,0,0,0|0,0,2]=3 691 B6R0.4 C#CCNC(C)=O Amb20623038 [1,0,0,0,0,0|1,0,2]=4 692 B6R0.4 C#CCOC(C)=O Amb8517415 [1,0,0,0,0,0|1,0,2]=4 693 B6R0.4 C#CCSC(C)=O Amb32683409 [1,0,0,0,0,0|1,0,2]=4 694 B6R0.4 C=C(Br)CCCCl Amb28320778 [1,0,0,0,0,0|2,0,1]=4 695 B6R0.4 C=C(Br)CCCN Amb27219336 [1,0,0,0,0,0|2,0,1]=4 696 B6R0.4 C=C(Br)CCCO Amb27471781 [1,0,0,0,0,0|2,0,1]=4 697 B6R0.4 C=C(Br)CSCC Amb28063803 [1,0,0,0,0,0|2,0,1]=4 698 B6R0.4 C=C(C)C#CCC Amb2721682 [1,0,0,0,0,0|1,0,2]=4 699 B6R0.4 C=C(C)CCC#N Amb2778548 [1,0,0,0,0,0|2,0,1]=4 700 B6R0.4 C=C(C)CCCBr Amb22886717 [1,0,0,0,0,0|2,0,0]=3 701 B6R0.4 C=C(C)CCCC Amb2721685 [1,0,0,0,0,0|1,0,0]=2 702 B6R0.4 C=C(C)CCCCl Amb24089299 [1,0,0,0,0,0|2,0,0]=3 703 B6R0.4 C=C(C)CCCN Amb24761452 [1,0,0,0,0,0|2,0,0]=3 704 B6R0.4 C=C(C)CCCN Amb33534233 [1,0,0,0,0,0|2,0,0]=3 705 B6R0.4 C=C(C)CCCO Amb22886814 [1,0,0,0,0,0|2,0,0]=3 706 B6R0.4 C=C(C)CCCS Amb33198962 [1,0,0,0,0,0|2,0,0]=3 707 B6R0.4 C=C(C)CCNC Amb18993045 [1,0,0,0,0,0|2,0,0]=3 708 B6R0.4 C=C(C)CCOC Amb33546340 [1,0,0,0,0,0|2,0,0]=3 709 B6R0.4 C=C(C)CCON Amb25862621 [1,0,0,0,0,0|3,0,0]=4 710 B6R0.4 C=C(C)CCSC Amb28400079 [1,0,0,0,0,0|2,0,0]=3 711 B6R0.4 C=C(C)CNCC Amb3940049 [1,0,0,0,0,0|2,0,0]=3 712 B6R0.4 C=C(C)COCCl Amb27424965 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,0,0,0,0,0|2,0,1]=4 714 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,0,0,0,0,0|2,0,1]=4 715 B6R0.4 C=C(Cl)CCCN Amb27413032 [1,0,0,0,0,0|2,0,1]=4 716 B6R0.4 C=C(Cl)CCCO Amb28065233 [1,0,0,0,0,0|2,0,1]=4 717 B6R0.4 C=C(Cl)CSCC Amb27972493 [1,0,0,0,0,0|2,0,1]=4 718 B6R0.4 C=C(F)CCCO Amb25811029 [1,0,0,0,0,0|2,0,1]=4 719 B6R0.4 C=C(I)CCCCl Amb27239930 [1,0,0,0,0,0|2,0,1]=4 720 B6R0.4 C=CCCC(=C)C Amb22228883 [1,0,0,0,0,0|1,0,2]=4 721 B6R0.4 C=CCCC(=O)Cl Amb3939003 [1,0,0,0,0,0|1,0,2]=4 722 B6R0.4 C=CCCC(=O)O Amb3940112 [1,0,0,0,0,0|1,0,2]=4 723 B6R0.4 C=CCCC(C)=O Amb2721704 [1,0,0,0,0,0|0,0,2]=3 724 B6R0.4 C=CCCC(N)=O Amb28136349 [1,0,0,0,0,0|1,0,2]=4 725 B6R0.4 C=CCNC(C)=O Amb5797445 [1,0,0,0,0,0|1,0,2]=4 726 B6R0.4 C=COCC(C)=O Amb27838258 [1,0,0,0,0,0|1,0,2]=4 727 B6R0.4 CC#CCC(=O)O Amb17939740 [1,0,0,0,0,0|1,0,2]=4 728 B6R0.4 CC#CCC(C)=O Amb27648528 [1,0,0,0,0,0|0,0,2]=3 729 B6R0.4 CC(=N)NCCF Amb28123831 [1,0,0,0,0,0|3,0,0]=4 730 B6R0.4 CC(=O)CC#CO Amb27463647 [1,0,0,0,0,0|1,0,2]=4 731 B6R0.4 CC(=O)CCC#N Amb17334046 [1,0,0,0,0,0|1,0,1]=3 732 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,1]=3 733 B6R0.4 CC(=O)CCCBr Amb8394105 [1,0,0,0,0,0|1,0,0]=2 734 B6R0.4 CC(=O)CCCCl Amb3940272 [1,0,0,0,0,0|1,0,0]=2 735 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|1,0,0]=2 736 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|1,0,0]=2 737 B6R0.4 CC(=O)CCCN Amb32661221 [1,0,0,0,0,0|1,0,0]=2 738 B6R0.4 CC(=O)CCCN Amb32661286 [1,0,0,0,0,0|1,0,0]=2 739 B6R0.4 CC(=O)CCCO Amb3940340 [1,0,0,0,0,0|1,0,0]=2 740 B6R0.4 CC(=O)CN=C=S Amb27490781 [1,0,0,0,0,0|2,0,1]=4 741 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [1,0,0,0,0,0|3,0,0]=4 742 B6R0.4 CC(=O)CSC#N Amb9788383 [1,0,0,0,0,0|2,0,1]=4 743 B6R0.4 CC(=O)C\C=N\O Amb27750272 [1,0,0,0,0,0|2,0,1]=4 744 B6R0.4 CC(=O)NCC#N Amb3886527 [1,0,0,0,0,0|2,0,1]=4 745 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,1]=4 746 B6R0.4 CC(=O)NCCBr Amb4311522 [1,0,0,0,0,0|2,0,0]=3 747 B6R0.4 CC(=O)NCCCl Amb423758 [1,0,0,0,0,0|2,0,0]=3 748 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|2,0,0]=3 749 B6R0.4 CC(=O)NCCO Amb2720909 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|2,0,0]=3 751 B6R0.4 CC(=O)OCC#N Amb9677308 [1,0,0,0,0,0|2,0,1]=4 752 B6R0.4 CC(=O)OCCBr Amb3940209 [1,0,0,0,0,0|2,0,0]=3 753 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|2,0,0]=3 754 B6R0.4 CC(=O)OCCN Amb28827650 [1,0,0,0,0,0|2,0,0]=3 755 B6R0.4 CC(=O)OCCO Amb3941004 [1,0,0,0,0,0|2,0,0]=3 756 B6R0.4 CC(=O)SCC=O Amb27873378 [1,0,0,0,0,0|2,0,1]=4 757 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|2,0,0]=3 758 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|2,0,0]=3 759 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|2,0,0]=3 760 B6R0.4 CC(=O)SCCN Amb31291049 [1,0,0,0,0,0|2,0,0]=3 761 B6R0.4 CC(=O)SCCO Amb27481182 [1,0,0,0,0,0|2,0,0]=3 762 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,0,0,0,0,0|1,0,2]=4 763 B6R0.4 CC(=O)\C=C\CF Amb33379250 [1,0,0,0,0,0|1,0,2]=4 764 B6R0.4 CC(=S)SCCCl Amb27952185 [1,0,0,0,0,0|2,1,0]=4 765 B6R0.4 CC(=S)SCCO Amb28350218 [1,0,0,0,0,0|2,1,0]=4 766 B6R0.4 CC(Br)CCCBr Amb2686750 [1,0,0,0,0,0|2,0,1]=4 767 B6R0.4 CC(Br)CCCF Amb33334194 [1,0,0,0,0,0|2,0,1]=4 768 B6R0.4 CC(C)=CCCBr Amb3941652 [1,0,0,0,0,0|2,0,1]=4 769 B6R0.4 CC(C)=CCCCl Amb27865707 [1,0,0,0,0,0|2,0,1]=4 770 B6R0.4 CC(C)=CCCI Amb22395000 [1,0,0,0,0,0|2,0,1]=4 771 B6R0.4 CC(C)=CCCN Amb18962494 [1,0,0,0,0,0|2,0,1]=4 772 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|2,0,1]=4 773 B6R0.4 CC(C)=CCCS Amb35588788 [1,0,0,0,0,0|2,0,1]=4 774 B6R0.4 CC(C)=NCCO Amb27612560 [1,0,0,0,0,0|3,0,0]=4 775 B6R0.4 CC(C)CCCBr Amb3940143 [1,0,0,0,0,0|2,0,1]=4 776 B6R0.4 CC(C)CCCCl Amb33546075 [1,0,0,0,0,0|2,0,1]=4 777 B6R0.4 CC(C)CCCI Amb27814431 [1,0,0,0,0,0|2,0,1]=4 778 B6R0.4 CC(C)CCCN Amb1136518 [1,0,0,0,0,0|2,0,1]=4 779 B6R0.4 CC(C)CCCN Amb13952127 [1,0,0,0,0,0|2,0,1]=4 780 B6R0.4 CC(C)CCCO Amb3939329 [1,0,0,0,0,0|2,0,1]=4 781 B6R0.4 CC(C)CCCS Amb26425936 [1,0,0,0,0,0|2,0,1]=4 782 B6R0.4 CC(Cl)CCCCl Amb19516004 [1,0,0,0,0,0|2,0,1]=4 783 B6R0.4 CC(Cl)CCCO Amb28138028 [1,0,0,0,0,0|2,0,1]=4 784 B6R0.4 CC(F)CCCBr Amb27760484 [1,0,0,0,0,0|2,0,1]=4 785 B6R0.4 CC(F)CCCO Amb27186289 [1,0,0,0,0,0|2,0,1]=4 786 B6R0.4 CC(N)CCCF Amb27612972 [1,0,0,0,0,0|2,0,1]=4 787 B6R0.4 CC(N)CCCN Amb22168271 [1,0,0,0,0,0|2,0,1]=4 788 B6R0.4 CC(N)CCCN Amb28827626 [1,0,0,0,0,0|2,0,1]=4 789 B6R0.4 CC(N)CCCO Amb17569888 [1,0,0,0,0,0|2,0,1]=4 790 B6R0.4 CC(O)CCCBr Amb25889007 [1,0,0,0,0,0|1,0,2]=4 791 B6R0.4 CC(O)CCCCl Amb22270232 [1,0,0,0,0,0|1,0,2]=4 792 B6R0.4 CC(O)CCCF Amb24385806 [1,0,0,0,0,0|1,0,2]=4 793 B6R0.4 CC(O)CCCN Amb8630414 [1,0,0,0,0,0|1,0,2]=4 794 B6R0.4 CC(O)CCCO Amb22227752 [1,0,0,0,0,0|1,0,2]=4 795 B6R0.4 CC(S)CCCN Amb18251084 [1,0,0,0,0,0|1,1,1]=4 796 B6R0.4 CC(S)CCCO Amb24412207 [1,0,0,0,0,0|1,1,1]=4 797 B6R0.4 CCC#CC(=O)O Amb6336503 [1,0,0,0,0,0|1,0,2]=4 798 B6R0.4 CCC#CC(C)=O Amb2721702 [1,0,0,0,0,0|0,0,2]=3 799 B6R0.4 CCCC=C(C)C Amb4035860 [1,0,0,0,0,0|1,0,1]=3 800 B6R0.4 CCCCB(Cl)Cl Amb22230362 [1,0,0,0,0,0|3,0,0]=4 801 B6R0.4 CCCCB(F)F Amb27268214 [1,0,0,0,0,0|3,0,0]=4 802 B6R0.4 CCCCB(O)O Amb2447142 [1,0,0,0,0,0|2,0,1]=4 803 B6R0.4 CCCCC(=N)N Amb10066937 [1,0,0,0,0,0|2,0,0]=3 804 B6R0.4 CCCCC(=N)N Amb2696360 [1,0,0,0,0,0|2,0,0]=3 805 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,0,0,0,0,0|1,0,0]=2 806 B6R0.4 CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|1,0,0]=2 807 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,0,0,0,0,0|1,0,0]=2 808 B6R0.4 CCCCC(=S)S Amb27195855 [1,0,0,0,0,0|1,1,0]=3 809 B6R0.4 CCCCC(C)=O Amb6608652 [1,0,0,0,0,0|0,0,0]=1 810 B6R0.4 CCCCC(C)Br Amb4015489 [1,0,0,0,0,0|1,0,1]=3 811 B6R0.4 CCCCC(C)C Amb8513255 [1,0,0,0,0,0|1,0,1]=3 812 B6R0.4 CCCCC(C)I Amb17673919 [1,0,0,0,0,0|1,0,1]=3 813 B6R0.4 CCCCC(C)N Amb33527132 [1,0,0,0,0,0|1,0,1]=3 814 B6R0.4 CCCCC(C)N Amb33532410 [1,0,0,0,0,0|1,0,1]=3 815 B6R0.4 CCCCC(C)O Amb4605977 [1,0,0,0,0,0|0,0,2]=3 816 B6R0.4 CCCCC(C)S Amb26326801 [1,0,0,0,0,0|0,1,1]=3 817 B6R0.4 CCCCC(Cl)Br Amb28050002 [1,0,0,0,0,0|2,0,1]=4 818 B6R0.4 CCCCC(Cl)Cl Amb26420376 [1,0,0,0,0,0|2,0,1]=4 819 B6R0.4 CCCCC(F)Br Amb27211132 [1,0,0,0,0,0|2,0,1]=4 820 B6R0.4 CCCCC(N)=O Amb6891958 [1,0,0,0,0,0|1,0,0]=2 821 B6R0.4 CCCCC(N)=S Amb6249558 [1,0,0,0,0,0|1,1,0]=3 822 B6R0.4 CCCCN(C)N Amb22730468 [1,0,0,0,0,0|2,0,0]=3 823 B6R0.4 CCCCN(C)O Amb33204268 [1,0,0,0,0,0|1,0,1]=3 824 B6R0.4 CCCCP(Cl)Cl Amb25051489 [1,0,0,0,0,0|3,0,0]=4 825 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,0,0,0,0,0|2,0,0]=3 826 B6R0.4 CCCCS(=O)[O-] Amb19889352 [1,0,0,0,0,0|2,0,0]=3 827 B6R0.4 CCCCS(N)=O Amb32720302 [1,0,0,0,0,0|2,0,0]=3 828 B6R0.4 CCCC[C@@H](C)N Amb20242479 [1,0,0,0,0,0|1,0,1]=3 829 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,0,0,0,0,0|0,0,2]=3 830 B6R0.4 CCCC[C@H](C)N Amb20242478 [1,0,0,0,0,0|1,0,1]=3 831 B6R0.4 CCCC[C@H](C)O Amb8515092 [1,0,0,0,0,0|0,0,2]=3 832 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [1,0,0,0,0,0|2,0,0]=3 833 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,0,0,0,0,0|2,0,0]=3 834 B6R0.4 CCCC[SiH](C)C Amb9807507 [1,0,0,0,0,0|1,1,0]=3 835 B6R0.4 CCCNC(=N)N Amb10844865 [1,0,0,0,0,0|3,0,0]=4 836 B6R0.4 CCCNC(=N)N Amb20667746 [1,0,0,0,0,0|3,0,0]=4 837 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,0]=3 838 B6R0.4 CCCNC(=S)S Amb28128280 [1,0,0,0,0,0|2,1,0]=4 839 B6R0.4 CCCNC(C)=O Amb5835710 [1,0,0,0,0,0|1,0,0]=2 840 B6R0.4 CCCNC(C)C Amb6248300 [1,0,0,0,0,0|2,0,1]=4 841 B6R0.4 CCCNC(N)=O Amb1152241 [1,0,0,0,0,0|2,0,0]=3 842 B6R0.4 CCCNC(N)=S Amb1152085 [1,0,0,0,0,0|2,1,0]=4 843 B6R0.4 CCCNN(C)C Amb25791383 [1,0,0,0,0,0|3,0,0]=4 844 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [1,0,0,0,0,0|3,0,0]=4 845 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,0]=3 846 B6R0.4 CCCOC(=O)F Amb32667886 [1,0,0,0,0,0|2,0,0]=3 847 B6R0.4 CCCOC(=S)[S-] Amb594778 [1,0,0,0,0,0|2,1,0]=4 848 B6R0.4 CCCOC(C)C Amb27234578 [1,0,0,0,0,0|2,0,1]=4 849 B6R0.4 CCCOC(C)Cl Amb26350769 [1,0,0,0,0,0|2,0,1]=4 850 B6R0.4 CCCOC(N)=O Amb6334809 [1,0,0,0,0,0|2,0,0]=3 851 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [1,0,0,0,0,0|3,0,0]=4 852 B6R0.4 CCCSC(=N)N Amb20676008 [1,0,0,0,0,0|3,0,0]=4 853 B6R0.4 CCCSC(=N)N Amb23482968 [1,0,0,0,0,0|3,0,0]=4 854 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|1,0,0]=2 855 B6R0.4 CCCSC(C)C Amb4017934 [1,0,0,0,0,0|2,0,1]=4 856 B6R0.4 CCCSC(N)=O Amb27167907 [1,0,0,0,0,0|2,0,0]=3 857 B6R0.4 CCNCC(=N)N Amb28050789 [1,0,0,0,0,0|3,0,0]=4 858 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,0,0,0,0,0|2,0,0]=3 859 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|2,0,0]=3 860 B6R0.4 CCNCC(=O)O Amb7764661 [1,0,0,0,0,0|2,0,0]=3 861 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|1,0,0]=2 862 B6R0.4 CCNCC(C)=O Amb32661185 [1,0,0,0,0,0|1,0,0]=2 863 B6R0.4 CCNCC(C)Br Amb35693406 [1,0,0,0,0,0|2,0,1]=4 864 B6R0.4 CCNCC(C)C Amb6247357 [1,0,0,0,0,0|2,0,1]=4 865 B6R0.4 CCNCC(C)C Amb6893129 [1,0,0,0,0,0|2,0,1]=4 866 B6R0.4 CCNCC(C)N Amb18299415 [1,0,0,0,0,0|2,0,1]=4 867 B6R0.4 CCNCC(C)O Amb32666214 [1,0,0,0,0,0|1,0,2]=4 868 B6R0.4 CCNCC(C)O Amb9247475 [1,0,0,0,0,0|1,0,2]=4 869 B6R0.4 CCNCC(C)S Amb18640729 [1,0,0,0,0,0|1,1,1]=4 870 B6R0.4 CCNCC(N)=O Amb1128676 [1,0,0,0,0,0|2,0,0]=3 871 B6R0.4 CCNCC(N)=O Amb4035424 [1,0,0,0,0,0|2,0,0]=3 872 B6R0.4 CCNC[C@@H](C)N Amb25888487 [1,0,0,0,0,0|2,0,1]=4 873 B6R0.4 CCNC[C@@H](C)O Amb27827890 [1,0,0,0,0,0|1,0,2]=4 874 B6R0.4 CCNC[C@@H](C)O Amb32652513 [1,0,0,0,0,0|1,0,2]=4 875 B6R0.4 CCNC[C@H](C)N Amb24720969 [1,0,0,0,0,0|2,0,1]=4 876 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|1,0,2]=4 877 B6R0.4 CCNC[C@H](C)O Amb32652535 [1,0,0,0,0,0|1,0,2]=4 878 B6R0.4 CCOC=C(C)C Amb27667358 [1,0,0,0,0,0|2,0,1]=4 879 B6R0.4 CCOCC(=N)N Amb19890012 [1,0,0,0,0,0|3,0,0]=4 880 B6R0.4 CCOCC(=N)N Amb6268669 [1,0,0,0,0,0|3,0,0]=4 881 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,0,0,0,0,0|2,0,0]=3 882 B6R0.4 CCOCC(=O)O Amb3939880 [1,0,0,0,0,0|2,0,0]=3 883 B6R0.4 CCOCC(=O)S Amb27813482 [1,0,0,0,0,0|2,0,0]=3 884 B6R0.4 CCOCC(C)=O Amb9666086 [1,0,0,0,0,0|1,0,0]=2 885 B6R0.4 CCOCC(C)Br Amb4012959 [1,0,0,0,0,0|2,0,1]=4 886 B6R0.4 CCOCC(C)N Amb10610346 [1,0,0,0,0,0|2,0,1]=4 887 B6R0.4 CCOCC(C)N Amb1133021 [1,0,0,0,0,0|2,0,1]=4 888 B6R0.4 CCOCC(C)O Amb33535096 [1,0,0,0,0,0|1,0,2]=4 889 B6R0.4 CCOCC(C)S Amb27451431 [1,0,0,0,0,0|1,1,1]=4 890 B6R0.4 CCOCC(N)=S Amb6276655 [1,0,0,0,0,0|2,1,0]=4 891 B6R0.4 CCOC[C@@H](C)N Amb18016634 [1,0,0,0,0,0|2,0,1]=4 892 B6R0.4 CCOC[C@@H](C)N Amb33483972 [1,0,0,0,0,0|2,0,1]=4 893 B6R0.4 CCOC[C@@H](C)O Amb27203934 [1,0,0,0,0,0|1,0,2]=4 894 B6R0.4 CCOC[C@H](C)N Amb17061642 [1,0,0,0,0,0|2,0,1]=4 895 B6R0.4 CCOC[C@H](C)N Amb33109791 [1,0,0,0,0,0|2,0,1]=4 896 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|2,0,0]=3 897 B6R0.4 CCONS(C)=O Amb27974850 [1,0,0,0,0,0|3,0,0]=4 898 B6R0.4 CCPCC(=O)O Amb28321137 [1,0,0,0,0,0|2,0,0]=3 899 B6R0.4 CCSCC(=N)N Amb6680834 [1,0,0,0,0,0|3,0,0]=4 900 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|2,0,0]=3 901 B6R0.4 CCSCC(C)=O Amb4018179 [1,0,0,0,0,0|1,0,0]=2 902 B6R0.4 CCSCC(C)C Amb22230686 [1,0,0,0,0,0|2,0,1]=4 903 B6R0.4 CCSCC(C)Cl Amb28050300 [1,0,0,0,0,0|2,0,1]=4 904 B6R0.4 CCSCC(C)N Amb19149261 [1,0,0,0,0,0|2,0,1]=4 905 B6R0.4 CCSCC(C)S Amb32788341 [1,0,0,0,0,0|1,1,1]=4 906 B6R0.4 CCSCC(N)=S Amb27188472 [1,0,0,0,0,0|2,1,0]=4 907 B6R0.4 CCSC[C@@H](C)N Amb26396040 [1,0,0,0,0,0|2,0,1]=4 908 B6R0.4 CCSC[C@@H](C)O Amb26059442 [1,0,0,0,0,0|1,0,2]=4 909 B6R0.4 CCSC[C@H](C)N Amb26058583 [1,0,0,0,0,0|2,0,1]=4 910 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,0,0,0,0,0|1,0,2]=4 911 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,0,0,0,0,0|1,0,2]=4 912 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,0,0,0,0,0|0,0,2]=3 913 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [1,0,0,0,0,0|1,0,2]=4 914 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,0,0,0,0,0|1,0,2]=4 915 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,0,0,0,0,0|0,0,2]=3 916 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 917 B6R0.4 CC\C=N\S(C)=O Amb35681661 [1,0,0,0,0,0|2,0,1]=4 918 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,0,0,0,0,0|2,0,1]=4 919 B6R0.4 CC\N=C\C(C)=O Amb27854982 [1,0,0,0,0,0|1,0,1]=3 920 B6R0.4 CN(C)CCCBr Amb10603677 [1,0,0,0,0,0|3,0,0]=4 921 B6R0.4 CN(C)CCCCl Amb33537241 [1,0,0,0,0,0|3,0,0]=4 922 B6R0.4 CN(C)CCCCl Amb8513141 [1,0,0,0,0,0|3,0,0]=4 923 B6R0.4 CN(C)CCCI Amb35781980 [1,0,0,0,0,0|3,0,0]=4 924 B6R0.4 CN(C)CCCN Amb3939839 [1,0,0,0,0,0|3,0,0]=4 925 B6R0.4 CN(C)CCCO Amb3939321 [1,0,0,0,0,0|3,0,0]=4 926 B6R0.4 CN(C)CCCS Amb24078629 [1,0,0,0,0,0|3,0,0]=4 927 B6R0.4 CN(C)CCCS Amb27974610 [1,0,0,0,0,0|3,0,0]=4 928 B6R0.4 CN(O)CCCF Amb33480871 [1,0,0,0,0,0|2,0,1]=4 929 B6R0.4 CNCCC(=O)Cl Amb27422890 [1,0,0,0,0,0|2,0,0]=3 930 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|2,0,0]=3 931 B6R0.4 CNCCC(=O)O Amb7766400 [1,0,0,0,0,0|2,0,0]=3 932 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|1,0,0]=2 933 B6R0.4 CNCCC(C)=O Amb28827637 [1,0,0,0,0,0|1,0,0]=2 934 B6R0.4 CNCCC(C)C Amb10609494 [1,0,0,0,0,0|2,0,1]=4 935 B6R0.4 CNCCC(C)C Amb1114399 [1,0,0,0,0,0|2,0,1]=4 936 B6R0.4 CNCCC(C)N Amb18288833 [1,0,0,0,0,0|2,0,1]=4 937 B6R0.4 CNCCC(C)O Amb17569889 [1,0,0,0,0,0|1,0,2]=4 938 B6R0.4 CNCCC(C)O Amb34141241 [1,0,0,0,0,0|1,0,2]=4 939 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,0]=3 940 B6R0.4 CNCCC(N)=O Amb33538309 [1,0,0,0,0,0|2,0,0]=3 941 B6R0.4 CNCCN(C)C Amb19958398 [1,0,0,0,0,0|3,0,0]=4 942 B6R0.4 CNCCN(C)C Amb3939354 [1,0,0,0,0,0|3,0,0]=4 943 B6R0.4 CNCCN(C)O Amb27628863 [1,0,0,0,0,0|2,0,1]=4 944 B6R0.4 CNCCP(C)C Amb28068836 [1,0,0,0,0,0|3,0,0]=4 945 B6R0.4 CNCCS(C)=O Amb21984676 [1,0,0,0,0,0|2,0,0]=3 946 B6R0.4 CNCC[C@@H](C)N Amb28429755 [1,0,0,0,0,0|2,0,1]=4 947 B6R0.4 CNCC[C@H](C)O Amb27801301 [1,0,0,0,0,0|1,0,2]=4 948 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [1,0,0,0,0,0|3,0,0]=4 949 B6R0.4 CN\C=C\C(C)=O Amb17593076 [1,0,0,0,0,0|1,0,2]=4 950 B6R0.4 COCCC(=N)N Amb2696283 [1,0,0,0,0,0|3,0,0]=4 951 B6R0.4 COCCC(=N)N Amb8630184 [1,0,0,0,0,0|3,0,0]=4 952 B6R0.4 COCCC(=O)Cl Amb2689274 [1,0,0,0,0,0|2,0,0]=3 953 B6R0.4 COCCC(=O)O Amb3938990 [1,0,0,0,0,0|2,0,0]=3 954 B6R0.4 COCCC(C)=O Amb7764907 [1,0,0,0,0,0|1,0,0]=2 955 B6R0.4 COCCC(C)Br Amb18805533 [1,0,0,0,0,0|2,0,1]=4 956 B6R0.4 COCCC(C)Cl Amb27207909 [1,0,0,0,0,0|2,0,1]=4 957 B6R0.4 COCCC(C)N Amb7772188 [1,0,0,0,0,0|2,0,1]=4 958 B6R0.4 COCCC(C)O Amb20621489 [1,0,0,0,0,0|1,0,2]=4 959 B6R0.4 COCCC(C)S Amb27836211 [1,0,0,0,0,0|1,1,1]=4 960 B6R0.4 COCCC(N)=O Amb33538943 [1,0,0,0,0,0|2,0,0]=3 961 B6R0.4 COCCC(N)=S Amb6250669 [1,0,0,0,0,0|2,1,0]=4 962 B6R0.4 COCCN(C)C Amb16231530 [1,0,0,0,0,0|3,0,0]=4 963 B6R0.4 COCCN(C)N Amb25326276 [1,0,0,0,0,0|3,0,0]=4 964 B6R0.4 COCCN(C)O Amb33428857 [1,0,0,0,0,0|2,0,1]=4 965 B6R0.4 COCCS(=O)Cl Amb25914790 [1,0,0,0,0,0|3,0,0]=4 966 B6R0.4 COCCS(=O)[O-] Amb26874008 [1,0,0,0,0,0|3,0,0]=4 967 B6R0.4 COCCS(N)=O Amb32720336 [1,0,0,0,0,0|3,0,0]=4 968 B6R0.4 COCC[C@@H](C)N Amb25934655 [1,0,0,0,0,0|2,0,1]=4 969 B6R0.4 COCC[C@@H](C)N Amb33620890 [1,0,0,0,0,0|2,0,1]=4 970 B6R0.4 COCC[C@@H](C)O Amb27237141 [1,0,0,0,0,0|1,0,2]=4 971 B6R0.4 COCC[C@H](C)N Amb25888528 [1,0,0,0,0,0|2,0,1]=4 972 B6R0.4 COCC[C@H](C)N Amb33741910 [1,0,0,0,0,0|2,0,1]=4 973 B6R0.4 COCC[C@H](C)O Amb26559043 [1,0,0,0,0,0|1,0,2]=4 974 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 975 B6R0.4 CONCC(N)=O Amb28455463 [1,0,0,0,0,0|3,0,0]=4 976 B6R0.4 CO\C=C/C(C)=O Amb27264758 [1,0,0,0,0,0|1,0,2]=4 977 B6R0.4 CO\C=C\C(C)=O Amb8385700 [1,0,0,0,0,0|1,0,2]=4 978 B6R0.4 CS(=O)CCCN Amb18974527 [1,0,0,0,0,0|2,0,0]=3 979 B6R0.4 CS(=O)CCCN Amb32684177 [1,0,0,0,0,0|2,0,0]=3 980 B6R0.4 CS(=O)NCCN Amb25888549 [1,0,0,0,0,0|3,0,0]=4 981 B6R0.4 CS(=O)OCCCl Amb27471823 [1,0,0,0,0,0|3,0,0]=4 982 B6R0.4 CSCC=C(C)C Amb27594692 [1,0,0,0,0,0|2,0,1]=4 983 B6R0.4 CSCCC(=N)N Amb19373501 [1,0,0,0,0,0|3,0,0]=4 984 B6R0.4 CSCCC(=N)N Amb19516878 [1,0,0,0,0,0|3,0,0]=4 985 B6R0.4 CSCCC(=O)O Amb3939879 [1,0,0,0,0,0|2,0,0]=3 986 B6R0.4 CSCCC(C)=O Amb8392858 [1,0,0,0,0,0|1,0,0]=2 987 B6R0.4 CSCCC(C)Br Amb33007127 [1,0,0,0,0,0|2,0,1]=4 988 B6R0.4 CSCCC(C)C Amb4016370 [1,0,0,0,0,0|2,0,1]=4 989 B6R0.4 CSCCC(C)N Amb19515505 [1,0,0,0,0,0|2,0,1]=4 990 B6R0.4 CSCCC(C)O Amb27860401 [1,0,0,0,0,0|1,0,2]=4 991 B6R0.4 CSCCC(N)=S Amb17307559 [1,0,0,0,0,0|2,1,0]=4 992 B6R0.4 CSCCN(=O)=O Amb24179458 [1,0,0,0,0,0|3,0,0]=4 993 B6R0.4 CSCCN(C)O Amb33272058 [1,0,0,0,0,0|2,0,1]=4 994 B6R0.4 CSCC[C@@H](C)N Amb33200180 [1,0,0,0,0,0|2,0,1]=4 995 B6R0.4 CSCC[C@@H](C)O Amb33198759 [1,0,0,0,0,0|1,0,2]=4 996 B6R0.4 CSCC[C@H](C)N Amb33200178 [1,0,0,0,0,0|2,0,1]=4 997 B6R0.4 CSCC[C@H](C)O Amb33198747 [1,0,0,0,0,0|1,0,2]=4 998 B6R0.4 CSCSC(C)=O Amb27876851 [1,0,0,0,0,0|2,0,0]=3 999 B6R0.4 CSSCC(=O)O Amb25378801 [1,0,0,0,0,0|3,0,0]=4 1000 B6R0.4 CS\C=C/C(C)=O Amb27471812 [1,0,0,0,0,0|1,0,2]=4 1001 B6R0.4 C[C@@H](Cl)CCCO Amb27233570 [1,0,0,0,0,0|2,0,1]=4 1002 B6R0.4 C[C@@H](N)CCCF Amb33377445 [1,0,0,0,0,0|2,0,1]=4 1003 B6R0.4 C[C@@H](N)CCCO Amb27602210 [1,0,0,0,0,0|2,0,1]=4 1004 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,0,0,0,0,0|1,0,2]=4 1005 B6R0.4 C[C@@H](O)CCCF Amb33376908 [1,0,0,0,0,0|1,0,2]=4 1006 B6R0.4 C[C@@H](O)CCCO Amb28047449 [1,0,0,0,0,0|1,0,2]=4 1007 B6R0.4 C[C@H](N)CCCF Amb33377444 [1,0,0,0,0,0|2,0,1]=4 1008 B6R0.4 C[C@H](O)CCCF Amb33376887 [1,0,0,0,0,0|1,0,2]=4 1009 B6R0.4 C[PH](=O)OCCCl Amb28340992 [1,0,0,0,0,0|3,0,0]=4 1010 B6R0.4 C[SiH](C)CCCCl Amb27655852 [1,0,0,0,0,0|2,1,0]=4 1011 B6R0.4 C[SiH](Cl)CCCCl Amb28364265 [1,0,0,0,0,0|2,1,0]=4 1012 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [1,0,0,0,0,0|2,0,1]=4 1013 B6R0.4 C\C(Br)=C\CCN Amb28060834 [1,0,0,0,0,0|2,0,1]=4 1014 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [1,0,0,0,0,0|2,0,1]=4 1015 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [1,0,0,0,0,0|2,0,1]=4 1016 B6R0.4 C\C(N)=N\CCO Amb26857579 [1,0,0,0,0,0|3,0,0]=4 1017 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,0,0,0,0,0|1,0,2]=4 1018 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,0,0,0,0,0|1,0,2]=4 1019 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,0,0,0,0,0|1,0,1]=3 1020 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,0,0,0,0,0|2,0,1]=4 1021 B6R0.4 N#CCCC(=O)O Amb2694975 [1,0,0,0,0,0|2,0,1]=4 1022 B6R0.4 N#CCCC(N)=O Amb8841150 [1,0,0,0,0,0|2,0,1]=4 1023 B6R0.4 N=C(N)CCCBr Amb4297022 [1,0,0,0,0,0|3,0,0]=4 1024 B6R0.4 N=C(N)CCCCl Amb4297061 [1,0,0,0,0,0|3,0,0]=4 1025 B6R0.4 N=C(N)CCCF Amb27231400 [1,0,0,0,0,0|3,0,0]=4 1026 B6R0.4 N=C(N)CCCN Amb25888970 [1,0,0,0,0,0|3,0,0]=4 1027 B6R0.4 N=C(N)CCCN Amb33299271 [1,0,0,0,0,0|3,0,0]=4 1028 B6R0.4 N=C(N)CCCO Amb33038287 [1,0,0,0,0,0|3,0,0]=4 1029 B6R0.4 NC(=O)CCCCl Amb1138237 [1,0,0,0,0,0|2,0,0]=3 1030 B6R0.4 NC(=O)CCCF Amb28073400 [1,0,0,0,0,0|2,0,0]=3 1031 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,0]=3 1032 B6R0.4 NC(=O)CCCS Amb27174778 [1,0,0,0,0,0|2,0,0]=3 1033 B6R0.4 NC(=O)NCCBr Amb28385599 [1,0,0,0,0,0|3,0,0]=4 1034 B6R0.4 NC(=O)NCCF Amb27446994 [1,0,0,0,0,0|3,0,0]=4 1035 B6R0.4 NC(=O)NCCI Amb27454955 [1,0,0,0,0,0|3,0,0]=4 1036 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|3,0,0]=4 1037 B6R0.4 NC(=O)OCCCl Amb3940645 [1,0,0,0,0,0|3,0,0]=4 1038 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|3,0,0]=4 1039 B6R0.4 NC(=O)SCCCl Amb27619850 [1,0,0,0,0,0|3,0,0]=4 1040 B6R0.4 NC(=S)CCCBr Amb33328371 [1,0,0,0,0,0|2,1,0]=4 1041 B6R0.4 NC(=S)CCCCl Amb33328364 [1,0,0,0,0,0|2,1,0]=4 1042 B6R0.4 NC(=S)CCCO Amb9215001 [1,0,0,0,0,0|2,1,0]=4 1043 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,0,0,0,0,0|2,0,0]=3 1044 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|2,0,0]=3 1045 B6R0.4 NCCCC(N)=O Amb2099583 [1,0,0,0,0,0|2,0,0]=3 1046 B6R0.4 NCCCC(N)=O Amb6543438 [1,0,0,0,0,0|2,0,0]=3 1047 B6R0.4 NCCCS(=O)O Amb25185942 [1,0,0,0,0,0|3,0,0]=4 1048 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [1,0,0,0,0,0|3,0,0]=4 1049 B6R0.4 NCCC[PH](=O)O Amb22370049 [1,0,0,0,0,0|3,0,0]=4 1050 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|3,0,0]=4 1051 B6R0.4 NCCNC(N)=O Amb32665340 [1,0,0,0,0,0|3,0,0]=4 1052 B6R0.4 NCCNC(N)=O Amb6254968 [1,0,0,0,0,0|3,0,0]=4 1053 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|3,0,0]=4 1054 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|3,0,0]=4 1055 B6R0.4 NNCCC(=O)O Amb33756816 [1,0,0,0,0,0|3,0,0]=4 1056 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|3,0,0]=4 1057 B6R0.4 NOCCC(=O)O Amb32693437 [1,0,0,0,0,0|3,0,0]=4 1058 B6R0.4 NOCCC(N)=O Amb27838275 [1,0,0,0,0,0|3,0,0]=4 1059 B6R0.4 NS(=O)CCCBr Amb32720400 [1,0,0,0,0,0|3,0,0]=4 1060 B6R0.4 NS(=O)CCCCl Amb32720303 [1,0,0,0,0,0|3,0,0]=4 1061 B6R0.4 NS(=O)CCCF Amb32720390 [1,0,0,0,0,0|3,0,0]=4 1062 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,0,0,0,0,0|2,0,0]=3 1063 B6R0.4 O=C(Cl)CCCBr Amb3940241 [1,0,0,0,0,0|2,0,0]=3 1064 B6R0.4 O=C(Cl)CCCCl Amb6608638 [1,0,0,0,0,0|2,0,0]=3 1065 B6R0.4 O=C(Cl)NCCBr Amb28123956 [1,0,0,0,0,0|3,0,0]=4 1066 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|3,0,0]=4 1067 B6R0.4 O=C(Cl)NCCF Amb35633248 [1,0,0,0,0,0|3,0,0]=4 1068 B6R0.4 O=C(Cl)OCCBr Amb8514406 [1,0,0,0,0,0|3,0,0]=4 1069 B6R0.4 O=C(Cl)OCCCl Amb6608837 [1,0,0,0,0,0|3,0,0]=4 1070 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,0,0,0,0,0|3,0,0]=4 1071 B6R0.4 O=C(O)CCCBr Amb8393276 [1,0,0,0,0,0|2,0,0]=3 1072 B6R0.4 O=C(O)CCCCl Amb3940333 [1,0,0,0,0,0|2,0,0]=3 1073 B6R0.4 O=C(O)CCCF Amb17593104 [1,0,0,0,0,0|2,0,0]=3 1074 B6R0.4 O=C(O)CCCI Amb22295911 [1,0,0,0,0,0|2,0,0]=3 1075 B6R0.4 O=C(O)CCCO Amb18640332 [1,0,0,0,0,0|2,0,0]=3 1076 B6R0.4 O=C(O)CCCS Amb16185429 [1,0,0,0,0,0|2,0,0]=3 1077 B6R0.4 O=C(O)CCNO Amb28067767 [1,0,0,0,0,0|3,0,0]=4 1078 B6R0.4 O=C(O)CCSCl Amb28387511 [1,0,0,0,0,0|3,0,0]=4 1079 B6R0.4 O=C(O)COCF Amb33378705 [1,0,0,0,0,0|3,0,0]=4 1080 B6R0.4 O=C(O)CPCO Amb28340565 [1,0,0,0,0,0|3,0,0]=4 1081 B6R0.4 O=C(S)NCCO Amb27430045 [1,0,0,0,0,0|3,0,0]=4 1082 B6R0.4 O=C([O-])CCCO Amb3429667 [1,0,0,0,0,0|2,0,0]=3 1083 B6R0.4 O=C([O-])CNCO Amb8383630 [1,0,0,0,0,0|3,0,0]=4 1084 B6R0.4 O=CCCC(=O)O Amb17673897 [1,0,0,0,0,0|2,0,1]=4 1085 B6R0.4 O=S(Cl)CCCBr Amb32720399 [1,0,0,0,0,0|3,0,0]=4 1086 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,0,0,0,0,0|3,0,0]=4 1087 B6R0.4 O=S(Cl)CCCF Amb32720389 [1,0,0,0,0,0|3,0,0]=4 1088 B6R0.4 O=S([O-])CCCBr Amb32754123 [1,0,0,0,0,0|3,0,0]=4 1089 B6R0.4 O=S([O-])CCCCl Amb26370094 [1,0,0,0,0,0|3,0,0]=4 1090 B6R0.4 O=S([O-])CCCF Amb32754093 [1,0,0,0,0,0|3,0,0]=4 1091 B6R0.4 O=S([O-])CCCO Amb27221257 [1,0,0,0,0,0|3,0,0]=4 1092 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [1,0,0,0,0,0|3,0,0]=4 1093 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [1,0,0,0,0,0|3,0,0]=4 1094 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [1,0,0,0,0,0|3,0,0]=4 1095 B6R0.4 O=[PH](O)CCCO Amb28345330 [1,0,0,0,0,0|3,0,0]=4 1096 B6R0.4 [C-]#[N+]CCC(=C)C Amb33199608 [1,0,0,0,0,0|2,0,1]=4 1097 B6R0.6 BrCCCCCBr Amb6608668 [1,0,0,0,0,0|2,0,1]=4 1098 B6R0.6 C#CCCCC=C Amb22227961 [1,0,0,0,0,0|0,0,3]=4 1099 B6R0.6 C#CCCCC=O Amb17593060 [1,0,0,0,0,0|0,0,2]=3 1100 B6R0.6 C#CCCCCC Amb6297206 [1,0,0,0,0,0|0,0,2]=3 1101 B6R0.6 C#CCCCCCl Amb6336487 [1,0,0,0,0,0|1,0,2]=4 1102 B6R0.6 C#CCCCCF Amb33196082 [1,0,0,0,0,0|1,0,2]=4 1103 B6R0.6 C#CCCCCI Amb22752649 [1,0,0,0,0,0|1,0,2]=4 1104 B6R0.6 C#CCCCCN Amb22059283 [1,0,0,0,0,0|1,0,2]=4 1105 B6R0.6 C#CCCCCN Amb33549738 [1,0,0,0,0,0|1,0,2]=4 1106 B6R0.6 C#CCCCCO Amb6336500 [1,0,0,0,0,0|1,0,2]=4 1107 B6R0.6 C#CCCCNC Amb29083253 [1,0,0,0,0,0|1,0,2]=4 1108 B6R0.6 C#CCCCOC Amb25694831 [1,0,0,0,0,0|1,0,2]=4 1109 B6R0.6 C#CCCCSC Amb26996684 [1,0,0,0,0,0|1,0,2]=4 1110 B6R0.6 C#CCCNC=O Amb27447032 [1,0,0,0,0,0|1,0,2]=4 1111 B6R0.6 C#CCCOCC Amb33169090 [1,0,0,0,0,0|1,0,2]=4 1112 B6R0.6 C#CCCSCC Amb24670860 [1,0,0,0,0,0|1,0,2]=4 1113 B6R0.6 C#CCNCCC Amb10610181 [1,0,0,0,0,0|1,0,2]=4 1114 B6R0.6 C#CCNCCC Amb5262802 [1,0,0,0,0,0|1,0,2]=4 1115 B6R0.6 C=C=CCCC=O Amb28208489 [1,0,0,0,0,0|0,0,3]=4 1116 B6R0.6 C=CC#CCCC Amb17673843 [1,0,0,0,0,0|0,0,3]=4 1117 B6R0.6 C=CCC#CCC Amb22227956 [1,0,0,0,0,0|0,0,3]=4 1118 B6R0.6 C=CCCC#CC Amb35680296 [1,0,0,0,0,0|0,0,3]=4 1119 B6R0.6 C=CCCCC#N Amb6298890 [1,0,0,0,0,0|1,0,2]=4 1120 B6R0.6 C=CCCCC=C Amb22227760 [1,0,0,0,0,0|0,0,3]=4 1121 B6R0.6 C=CCCCC=O Amb13883672 [1,0,0,0,0,0|0,0,2]=3 1122 B6R0.6 C=CCCCCBr Amb3940222 [1,0,0,0,0,0|1,0,1]=3 1123 B6R0.6 C=CCCCCC Amb3940498 [1,0,0,0,0,0|0,0,1]=2 1124 B6R0.6 C=CCCCCCl Amb2692039 [1,0,0,0,0,0|1,0,1]=3 1125 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,1]=3 1126 B6R0.6 C=CCCCCI Amb26858458 [1,0,0,0,0,0|1,0,1]=3 1127 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,1]=3 1128 B6R0.6 C=CCCCCO Amb3940341 [1,0,0,0,0,0|1,0,1]=3 1129 B6R0.6 C=CCCCNC Amb18523846 [1,0,0,0,0,0|1,0,1]=3 1130 B6R0.6 C=CCCCNC Amb32651835 [1,0,0,0,0,0|1,0,1]=3 1131 B6R0.6 C=CCCCNO Amb27437399 [1,0,0,0,0,0|2,0,1]=4 1132 B6R0.6 C=CCCCOC Amb24432882 [1,0,0,0,0,0|1,0,1]=3 1133 B6R0.6 C=CCCOCCl Amb2696084 [1,0,0,0,0,0|2,0,1]=4 1134 B6R0.6 C=CCCSCC Amb27213772 [1,0,0,0,0,0|1,0,1]=3 1135 B6R0.6 C=CCC\C=C\C Amb22734684 [1,0,0,0,0,0|0,0,3]=4 1136 B6R0.6 C=CCNCCC Amb22587187 [1,0,0,0,0,0|1,0,1]=3 1137 B6R0.6 C=CCNCCC Amb6683949 [1,0,0,0,0,0|1,0,1]=3 1138 B6R0.6 C=CCNCCCl Amb17334072 [1,0,0,0,0,0|2,0,1]=4 1139 B6R0.6 C=CCNCCN Amb17091015 [1,0,0,0,0,0|2,0,1]=4 1140 B6R0.6 C=CCNCCO Amb6706545 [1,0,0,0,0,0|2,0,1]=4 1141 B6R0.6 C=CCNCOC Amb27973157 [1,0,0,0,0,0|2,0,1]=4 1142 B6R0.6 C=CCOCC=O Amb27402231 [1,0,0,0,0,0|1,0,2]=4 1143 B6R0.6 C=CCOCCBr Amb33531510 [1,0,0,0,0,0|2,0,1]=4 1144 B6R0.6 C=CCOCCC Amb3940491 [1,0,0,0,0,0|1,0,1]=3 1145 B6R0.6 C=CCOCCCl Amb2696085 [1,0,0,0,0,0|2,0,1]=4 1146 B6R0.6 C=CCOCCI Amb24739964 [1,0,0,0,0,0|2,0,1]=4 1147 B6R0.6 C=CCOCCN Amb32667523 [1,0,0,0,0,0|2,0,1]=4 1148 B6R0.6 C=CCOCCN Amb33530047 [1,0,0,0,0,0|2,0,1]=4 1149 B6R0.6 C=CCOCCO Amb3940609 [1,0,0,0,0,0|2,0,1]=4 1150 B6R0.6 C=CCOCOC Amb24385255 [1,0,0,0,0,0|2,0,1]=4 1151 B6R0.6 C=CCSCC=O Amb18641509 [1,0,0,0,0,0|1,0,2]=4 1152 B6R0.6 C=CCSCCCl Amb28042684 [1,0,0,0,0,0|2,0,1]=4 1153 B6R0.6 C=CCSCCN Amb13951462 [1,0,0,0,0,0|2,0,1]=4 1154 B6R0.6 C=CCSCCN Amb6273787 [1,0,0,0,0,0|2,0,1]=4 1155 B6R0.6 C=COCCCC Amb8513427 [1,0,0,0,0,0|1,0,1]=3 1156 B6R0.6 C=COCCCCl Amb27613489 [1,0,0,0,0,0|2,0,1]=4 1157 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|2,0,1]=4 1158 B6R0.6 C=COCCCN Amb3997182 [1,0,0,0,0,0|2,0,1]=4 1159 B6R0.6 C=COCCOC Amb21520356 [1,0,0,0,0,0|2,0,1]=4 1160 B6R0.6 C=CSCCCN Amb27800121 [1,0,0,0,0,0|2,0,1]=4 1161 B6R0.6 C=C\C=C\CCC Amb33171502 [1,0,0,0,0,0|0,0,3]=4 1162 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 1163 B6R0.6 CC#CCCCCl Amb27865837 [1,0,0,0,0,0|1,0,2]=4 1164 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|1,0,2]=4 1165 B6R0.6 CC#CCCSC Amb27594693 [1,0,0,0,0,0|1,0,2]=4 1166 B6R0.6 CC#CCOCC Amb24332856 [1,0,0,0,0,0|1,0,2]=4 1167 B6R0.6 CC=C=CCCI Amb27777241 [1,0,0,0,0,0|1,0,2]=4 1168 B6R0.6 CC=C=CCCO Amb25888408 [1,0,0,0,0,0|1,0,2]=4 1169 B6R0.6 CCC#CCC=O Amb28396959 [1,0,0,0,0,0|0,0,2]=3 1170 B6R0.6 CCC#CCCC Amb9134713 [1,0,0,0,0,0|0,0,3]=4 1171 B6R0.6 CCC=C=CC=O Amb27237589 [1,0,0,0,0,0|0,0,3]=4 1172 B6R0.6 CCCC#CC=O Amb27244852 [1,0,0,0,0,0|0,0,2]=3 1173 B6R0.6 CCCC=C=CBr Amb27477883 [1,0,0,0,0,0|1,0,2]=4 1174 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,0]=3 1175 B6R0.6 CCCCC#CI Amb27632377 [1,0,0,0,0,0|1,0,2]=4 1176 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,0,0,0,0,0|2,0,1]=4 1177 B6R0.6 CCCCCC#N Amb6250301 [1,0,0,0,0,0|1,0,1]=3 1178 B6R0.6 CCCCCC=O Amb3939522 [1,0,0,0,0,0|0,0,0]=1 1179 B6R0.6 CCCCCCBr Amb3940085 [1,0,0,0,0,0|1,0,1]=3 1180 B6R0.6 CCCCCCC Amb8513177 [1,0,0,0,0,0|0,0,1]=2 1181 B6R0.6 CCCCCCCl Amb7764628 [1,0,0,0,0,0|1,0,1]=3 1182 B6R0.6 CCCCCCF Amb8516643 [1,0,0,0,0,0|1,0,1]=3 1183 B6R0.6 CCCCCCI Amb6608700 [1,0,0,0,0,0|1,0,1]=3 1184 B6R0.6 CCCCCCN Amb2721179 [1,0,0,0,0,0|1,0,1]=3 1185 B6R0.6 CCCCCCN Amb3940465 [1,0,0,0,0,0|1,0,1]=3 1186 B6R0.6 CCCCCCO Amb3941500 [1,0,0,0,0,0|0,0,2]=3 1187 B6R0.6 CCCCCCS Amb8514502 [1,0,0,0,0,0|0,1,1]=3 1188 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|0,1,1]=3 1189 B6R0.6 CCCCCNC Amb3939381 [1,0,0,0,0,0|1,0,0]=2 1190 B6R0.6 CCCCCNN Amb32693399 [1,0,0,0,0,0|2,0,0]=3 1191 B6R0.6 CCCCCNN Amb6249376 [1,0,0,0,0,0|2,0,0]=3 1192 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,1]=3 1193 B6R0.6 CCCCCOC Amb9787609 [1,0,0,0,0,0|1,0,0]=2 1194 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,0]=3 1195 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|1,0,0]=2 1196 B6R0.6 CCCCN=C=O Amb3939310 [1,0,0,0,0,0|1,0,1]=3 1197 B6R0.6 CCCCN=C=S Amb6572520 [1,0,0,0,0,0|1,1,1]=4 1198 B6R0.6 CCCCN=[N+]=N Amb34916661 [1,0,0,0,0,0|3,0,0]=4 1199 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,0,0,0,0,0|3,0,0]=4 1200 B6R0.6 CCCCN=[N+]=[N-] Amb33526892 [1,0,0,0,0,0|3,0,0]=4 1201 B6R0.6 CCCCNC=O Amb4017838 [1,0,0,0,0,0|1,0,0]=2 1202 B6R0.6 CCCCNCC Amb3939842 [1,0,0,0,0,0|1,0,1]=3 1203 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,0]=3 1204 B6R0.6 CCCCOB=O Amb26900238 [1,0,0,0,0,0|2,0,0]=3 1205 B6R0.6 CCCCOC=O Amb6608882 [1,0,0,0,0,0|1,0,0]=2 1206 B6R0.6 CCCCOCC Amb2685642 [1,0,0,0,0,0|1,0,1]=3 1207 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|1,0,2]=4 1208 B6R0.6 CCCCON=O Amb8515227 [1,0,0,0,0,0|2,0,0]=3 1209 B6R0.6 CCCCSC#N Amb4035931 [1,0,0,0,0,0|2,0,1]=4 1210 B6R0.6 CCCCSCC Amb9787545 [1,0,0,0,0,0|1,0,1]=3 1211 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|2,0,1]=4 1212 B6R0.6 CCCCSCO Amb27623932 [1,0,0,0,0,0|1,0,2]=4 1213 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|1,0,1]=3 1214 B6R0.6 CCCNCC#N Amb6714443 [1,0,0,0,0,0|2,0,1]=4 1215 B6R0.6 CCCNCCC Amb3939352 [1,0,0,0,0,0|1,0,1]=3 1216 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,1]=4 1217 B6R0.6 CCCNCCN Amb8515461 [1,0,0,0,0,0|2,0,1]=4 1218 B6R0.6 CCCNCCO Amb3939869 [1,0,0,0,0,0|1,0,2]=4 1219 B6R0.6 CCCNCOC Amb27830080 [1,0,0,0,0,0|2,0,0]=3 1220 B6R0.6 CCCNNCC Amb27409240 [1,0,0,0,0,0|2,0,1]=4 1221 B6R0.6 CCCOCC#N Amb8874819 [1,0,0,0,0,0|2,0,1]=4 1222 B6R0.6 CCCOCCC Amb8513440 [1,0,0,0,0,0|1,0,1]=3 1223 B6R0.6 CCCOCCCl Amb8514866 [1,0,0,0,0,0|2,0,1]=4 1224 B6R0.6 CCCOCCI Amb27596856 [1,0,0,0,0,0|2,0,1]=4 1225 B6R0.6 CCCOCCN Amb3939563 [1,0,0,0,0,0|2,0,1]=4 1226 B6R0.6 CCCOCCO Amb3939227 [1,0,0,0,0,0|1,0,2]=4 1227 B6R0.6 CCCSCC#N Amb6680723 [1,0,0,0,0,0|2,0,1]=4 1228 B6R0.6 CCCSCCBr Amb9304990 [1,0,0,0,0,0|2,0,1]=4 1229 B6R0.6 CCCSCCC Amb9787473 [1,0,0,0,0,0|1,0,1]=3 1230 B6R0.6 CCCSCCCl Amb9304987 [1,0,0,0,0,0|2,0,1]=4 1231 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|2,0,1]=4 1232 B6R0.6 CCCSCCN Amb6268693 [1,0,0,0,0,0|2,0,1]=4 1233 B6R0.6 CCCSCCS Amb28050075 [1,0,0,0,0,0|1,1,1]=4 1234 B6R0.6 CCCSCNC Amb27879006 [1,0,0,0,0,0|2,0,0]=3 1235 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|2,0,1]=4 1236 B6R0.6 CCCSSSC Amb8392859 [1,0,0,0,0,0|3,0,0]=4 1237 B6R0.6 CCC\C=C/C=O Amb25885814 [1,0,0,0,0,0|0,0,2]=3 1238 B6R0.6 CCC\C=C\C=O Amb3940431 [1,0,0,0,0,0|0,0,2]=3 1239 B6R0.6 CCNCCC#N Amb2720499 [1,0,0,0,0,0|2,0,1]=4 1240 B6R0.6 CCNCCCBr Amb27265760 [1,0,0,0,0,0|2,0,1]=4 1241 B6R0.6 CCNCCCF Amb28050218 [1,0,0,0,0,0|2,0,1]=4 1242 B6R0.6 CCNCCCN Amb17315269 [1,0,0,0,0,0|2,0,1]=4 1243 B6R0.6 CCNCCCO Amb6733726 [1,0,0,0,0,0|1,0,2]=4 1244 B6R0.6 CCNCCOC Amb32653021 [1,0,0,0,0,0|2,0,0]=3 1245 B6R0.6 CCNCCOC Amb3939818 [1,0,0,0,0,0|2,0,0]=3 1246 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,0]=3 1247 B6R0.6 CCNCCSC Amb28941534 [1,0,0,0,0,0|2,0,0]=3 1248 B6R0.6 CCNCNC=O Amb27252409 [1,0,0,0,0,0|2,0,0]=3 1249 B6R0.6 CCNCNCC Amb27174562 [1,0,0,0,0,0|2,0,1]=4 1250 B6R0.6 CCNC\C=C/I Amb23539308 [1,0,0,0,0,0|2,0,1]=4 1251 B6R0.6 CCN\C=C/C=O Amb27793118 [1,0,0,0,0,0|1,0,2]=4 1252 B6R0.6 CCOCCC#N Amb4019489 [1,0,0,0,0,0|2,0,1]=4 1253 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,0]=2 1254 B6R0.6 CCOCCCBr Amb8828206 [1,0,0,0,0,0|2,0,1]=4 1255 B6R0.6 CCOCCCCl Amb6255304 [1,0,0,0,0,0|2,0,1]=4 1256 B6R0.6 CCOCCCN Amb3939347 [1,0,0,0,0,0|2,0,1]=4 1257 B6R0.6 CCOCCCO Amb3939322 [1,0,0,0,0,0|1,0,2]=4 1258 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|2,0,0]=3 1259 B6R0.6 CCOCCNC Amb33529221 [1,0,0,0,0,0|2,0,0]=3 1260 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|3,0,0]=4 1261 B6R0.6 CCOCCNN Amb6744628 [1,0,0,0,0,0|3,0,0]=4 1262 B6R0.6 CCOCCOC Amb22052684 [1,0,0,0,0,0|2,0,0]=3 1263 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|3,0,0]=4 1264 B6R0.6 CCOCNC=O Amb28252363 [1,0,0,0,0,0|2,0,0]=3 1265 B6R0.6 CCOCOCC Amb8515183 [1,0,0,0,0,0|2,0,1]=4 1266 B6R0.6 CCOC\C=C\Br Amb28244732 [1,0,0,0,0,0|2,0,1]=4 1267 B6R0.6 CCO\C=C/C=O Amb27423444 [1,0,0,0,0,0|1,0,2]=4 1268 B6R0.6 CCO\C=C\C=O Amb18639560 [1,0,0,0,0,0|1,0,2]=4 1269 B6R0.6 CCSCCC#N Amb6680683 [1,0,0,0,0,0|2,0,1]=4 1270 B6R0.6 CCSCCC=O Amb27254551 [1,0,0,0,0,0|1,0,0]=2 1271 B6R0.6 CCSCCCBr Amb9305000 [1,0,0,0,0,0|2,0,1]=4 1272 B6R0.6 CCSCCCI Amb28461625 [1,0,0,0,0,0|2,0,1]=4 1273 B6R0.6 CCSCCCN Amb6680223 [1,0,0,0,0,0|2,0,1]=4 1274 B6R0.6 CCSCCCO Amb3939588 [1,0,0,0,0,0|1,0,2]=4 1275 B6R0.6 CCSCCCS Amb26476929 [1,0,0,0,0,0|1,1,1]=4 1276 B6R0.6 CCSCCNC Amb16186669 [1,0,0,0,0,0|2,0,0]=3 1277 B6R0.6 CCSCCNN Amb27218047 [1,0,0,0,0,0|3,0,0]=4 1278 B6R0.6 CCSCCNO Amb33324087 [1,0,0,0,0,0|2,0,1]=4 1279 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|3,0,0]=4 1280 B6R0.6 CCSCNC=O Amb28315587 [1,0,0,0,0,0|2,0,0]=3 1281 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|2,0,1]=4 1282 B6R0.6 CC\C=C/CC=O Amb18639157 [1,0,0,0,0,0|0,0,2]=3 1283 B6R0.6 CC\C=C/CCC Amb26600858 [1,0,0,0,0,0|0,0,3]=4 1284 B6R0.6 CC\C=C\CCC Amb19930065 [1,0,0,0,0,0|0,0,3]=4 1285 B6R0.6 CC\C=C\CNC Amb26618015 [1,0,0,0,0,0|1,0,2]=4 1286 B6R0.6 CNCCCCCl Amb34916601 [1,0,0,0,0,0|2,0,0]=3 1287 B6R0.6 CNCCCCF Amb27231439 [1,0,0,0,0,0|2,0,0]=3 1288 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,0]=3 1289 B6R0.6 CNCCCCN Amb2698063 [1,0,0,0,0,0|2,0,0]=3 1290 B6R0.6 CNCCCCO Amb33539277 [1,0,0,0,0,0|2,0,0]=3 1291 B6R0.6 CNCCCNC Amb3940467 [1,0,0,0,0,0|2,0,0]=3 1292 B6R0.6 CNCCCOC Amb33801534 [1,0,0,0,0,0|2,0,0]=3 1293 B6R0.6 CNCCCOC Amb9204018 [1,0,0,0,0,0|2,0,0]=3 1294 B6R0.6 CNCCCON Amb27430260 [1,0,0,0,0,0|3,0,0]=4 1295 B6R0.6 CNCCCSC Amb6718995 [1,0,0,0,0,0|2,0,0]=3 1296 B6R0.6 CNCCSSC Amb28146208 [1,0,0,0,0,0|3,0,0]=4 1297 B6R0.6 CNCC\C=C\Cl Amb27605601 [1,0,0,0,0,0|2,0,1]=4 1298 B6R0.6 CNOCCOC Amb32412843 [1,0,0,0,0,0|3,0,0]=4 1299 B6R0.6 COCCCC#N Amb6258835 [1,0,0,0,0,0|2,0,1]=4 1300 B6R0.6 COCCCC=O Amb33530955 [1,0,0,0,0,0|1,0,0]=2 1301 B6R0.6 COCCCCBr Amb8855443 [1,0,0,0,0,0|2,0,0]=3 1302 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,0]=3 1303 B6R0.6 COCCCCI Amb25933499 [1,0,0,0,0,0|2,0,0]=3 1304 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,0]=3 1305 B6R0.6 COCCCCN Amb6251056 [1,0,0,0,0,0|2,0,0]=3 1306 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|2,0,0]=3 1307 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|2,0,0]=3 1308 B6R0.6 COCCCNN Amb25887940 [1,0,0,0,0,0|3,0,0]=4 1309 B6R0.6 COCCCNN Amb33204509 [1,0,0,0,0,0|3,0,0]=4 1310 B6R0.6 COCCCNN Amb33553392 [1,0,0,0,0,0|3,0,0]=4 1311 B6R0.6 COCCCNO Amb33378127 [1,0,0,0,0,0|2,0,1]=4 1312 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|2,0,0]=3 1313 B6R0.6 COCCCON Amb18559290 [1,0,0,0,0,0|3,0,0]=4 1314 B6R0.6 COCCCSC Amb28139052 [1,0,0,0,0,0|2,0,0]=3 1315 B6R0.6 COCCN=C=O Amb901883 [1,0,0,0,0,0|2,0,1]=4 1316 B6R0.6 COCCNC=O Amb24334241 [1,0,0,0,0,0|2,0,0]=3 1317 B6R0.6 COCCOCCl Amb6608984 [1,0,0,0,0,0|3,0,0]=4 1318 B6R0.6 COCCOCO Amb28281708 [1,0,0,0,0,0|3,0,0]=4 1319 B6R0.6 COCCSCCl Amb33545127 [1,0,0,0,0,0|3,0,0]=4 1320 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|3,0,0]=4 1321 B6R0.6 COCOCC=O Amb27409311 [1,0,0,0,0,0|2,0,0]=3 1322 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|3,0,0]=4 1323 B6R0.6 COCOCCI Amb26443893 [1,0,0,0,0,0|3,0,0]=4 1324 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|3,0,0]=4 1325 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|3,0,0]=4 1326 B6R0.6 COC\C=C\C=O Amb33473884 [1,0,0,0,0,0|1,0,2]=4 1327 B6R0.6 CONCCCN Amb26953498 [1,0,0,0,0,0|3,0,0]=4 1328 B6R0.6 CONCCCN Amb30584683 [1,0,0,0,0,0|3,0,0]=4 1329 B6R0.6 CONCCCN Amb32666616 [1,0,0,0,0,0|3,0,0]=4 1330 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|3,0,0]=4 1331 B6R0.6 CONCCCO Amb33456216 [1,0,0,0,0,0|3,0,0]=4 1332 B6R0.6 CSCCCC#N Amb17504231 [1,0,0,0,0,0|2,0,1]=4 1333 B6R0.6 CSCCCC=O Amb25992553 [1,0,0,0,0,0|1,0,0]=2 1334 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,0]=3 1335 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,0]=3 1336 B6R0.6 CSCCCCF Amb27620229 [1,0,0,0,0,0|2,0,0]=3 1337 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,0]=3 1338 B6R0.6 CSCCCCO Amb9825911 [1,0,0,0,0,0|2,0,0]=3 1339 B6R0.6 CSCCCCS Amb27461555 [1,0,0,0,0,0|2,0,0]=3 1340 B6R0.6 CSCCCNN Amb24093854 [1,0,0,0,0,0|3,0,0]=4 1341 B6R0.6 CSCCCNO Amb27948053 [1,0,0,0,0,0|2,0,1]=4 1342 B6R0.6 CSCCCON Amb27947150 [1,0,0,0,0,0|3,0,0]=4 1343 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|2,0,0]=3 1344 B6R0.6 CSCCN=C=O Amb19889355 [1,0,0,0,0,0|2,0,1]=4 1345 B6R0.6 CSCCNC=O Amb28437305 [1,0,0,0,0,0|2,0,0]=3 1346 B6R0.6 CSCSCSC Amb25025600 [1,0,0,0,0,0|3,0,0]=4 1347 B6R0.6 CSC\C=C\C=O Amb33271737 [1,0,0,0,0,0|1,0,2]=4 1348 B6R0.6 C\C=C/CCC=O Amb28202620 [1,0,0,0,0,0|0,0,2]=3 1349 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|0,0,1]=2 1350 B6R0.6 C\C=C/CCCN Amb27658374 [1,0,0,0,0,0|1,0,1]=3 1351 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|1,0,1]=3 1352 B6R0.6 C\C=C\CCC=O Amb17593074 [1,0,0,0,0,0|0,0,2]=3 1353 B6R0.6 C\C=C\CCCC Amb8515158 [1,0,0,0,0,0|0,0,1]=2 1354 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,1]=3 1355 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|1,0,1]=3 1356 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|1,0,1]=3 1357 B6R0.6 C\C=N\NCCO Amb25888442 [1,0,0,0,0,0|3,0,0]=4 1358 B6R0.6 ClCCCCCBr Amb2724373 [1,0,0,0,0,0|2,0,1]=4 1359 B6R0.6 ClCCCCCCl Amb6608828 [1,0,0,0,0,0|2,0,1]=4 1360 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,1]=4 1361 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,1]=4 1362 B6R0.6 FCCCCCF Amb27397467 [1,0,0,0,0,0|2,0,1]=4 1363 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,1]=4 1364 B6R0.6 ICCCCCI Amb8514835 [1,0,0,0,0,0|2,0,1]=4 1365 B6R0.6 N#CCCCC=O Amb18120556 [1,0,0,0,0,0|1,0,1]=3 1366 B6R0.6 N#CCCCCBr Amb2685556 [1,0,0,0,0,0|2,0,1]=4 1367 B6R0.6 N#CCCCCCl Amb3940299 [1,0,0,0,0,0|2,0,1]=4 1368 B6R0.6 N#CCCCCF Amb26935678 [1,0,0,0,0,0|2,0,1]=4 1369 B6R0.6 N#CCCCCI Amb27650166 [1,0,0,0,0,0|2,0,1]=4 1370 B6R0.6 N#CCCCCN Amb30628578 [1,0,0,0,0,0|2,0,1]=4 1371 B6R0.6 N#CCCCCN Amb33532899 [1,0,0,0,0,0|2,0,1]=4 1372 B6R0.6 N#CCCCCO Amb33531864 [1,0,0,0,0,0|2,0,1]=4 1373 B6R0.6 NCCCCC=O Amb26627836 [1,0,0,0,0,0|1,0,0]=2 1374 B6R0.6 NCCCCCBr Amb26581378 [1,0,0,0,0,0|2,0,1]=4 1375 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,1]=4 1376 B6R0.6 NCCCCCF Amb28383861 [1,0,0,0,0,0|2,0,1]=4 1377 B6R0.6 NCCCCCF Amb35747648 [1,0,0,0,0,0|2,0,1]=4 1378 B6R0.6 NCCCCCI Amb27596855 [1,0,0,0,0,0|2,0,1]=4 1379 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,1]=4 1380 B6R0.6 NCCCCCN Amb8513099 [1,0,0,0,0,0|2,0,1]=4 1381 B6R0.6 NCCCCCO Amb3939337 [1,0,0,0,0,0|1,0,2]=4 1382 B6R0.6 NCCCCCS Amb33362345 [1,0,0,0,0,0|1,1,1]=4 1383 B6R0.6 NCCCCCS Amb33527075 [1,0,0,0,0,0|1,1,1]=4 1384 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,1]=4 1385 B6R0.6 NCCCCNO Amb27668394 [1,0,0,0,0,0|2,0,1]=4 1386 B6R0.6 NCCCCON Amb28188672 [1,0,0,0,0,0|3,0,0]=4 1387 B6R0.6 NCCCNC=O Amb5723517 [1,0,0,0,0,0|2,0,0]=3 1388 B6R0.6 NCCC\C=C/I Amb28050291 [1,0,0,0,0,0|2,0,1]=4 1389 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|3,0,0]=4 1390 B6R0.6 NOCCCCF Amb27160797 [1,0,0,0,0,0|3,0,0]=4 1391 B6R0.6 O=C=NCCCBr Amb27859638 [1,0,0,0,0,0|2,0,1]=4 1392 B6R0.6 O=C=NCCCCl Amb3939153 [1,0,0,0,0,0|2,0,1]=4 1393 B6R0.6 O=C=NCCCF Amb27838244 [1,0,0,0,0,0|2,0,1]=4 1394 B6R0.6 O=CCCCC=O Amb6600455 [1,0,0,0,0,0|1,0,1]=3 1395 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|1,0,0]=2 1396 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|1,0,0]=2 1397 B6R0.6 O=CCCCCO Amb10603837 [1,0,0,0,0,0|1,0,0]=2 1398 B6R0.6 O=CCCCN=O Amb27838215 [1,0,0,0,0,0|2,0,0]=3 1399 B6R0.6 O=CCC\C=C/Br Amb27838206 [1,0,0,0,0,0|1,0,2]=4 1400 B6R0.6 O=CCC\C=C\Cl Amb27955198 [1,0,0,0,0,0|1,0,2]=4 1401 B6R0.6 O=CNCCCO Amb27248821 [1,0,0,0,0,0|2,0,0]=3 1402 B6R0.6 O=C\C=C/CCO Amb27235316 [1,0,0,0,0,0|1,0,2]=4 1403 B6R0.6 O=C\C=C\CCF Amb33429802 [1,0,0,0,0,0|1,0,2]=4 1404 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,0,0,0,0,0|3,0,0]=4 1405 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,2]=4 1406 B6R0.6 OCCCCCCl Amb8386939 [1,0,0,0,0,0|1,0,2]=4 1407 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,2]=4 1408 B6R0.6 OCCCCCO Amb6296608 [1,0,0,0,0,0|1,0,2]=4 1409 B6R0.6 OCCCCNO Amb27396013 [1,0,0,0,0,0|2,0,1]=4 1410 B6R0.6 OCCC\C=C\Br Amb27483322 [1,0,0,0,0,0|2,0,1]=4 1411 B6R0.6 OCCC\C=C\I Amb27879078 [1,0,0,0,0,0|2,0,1]=4 1412 B6R0.6 SCCCCCS Amb8514611 [1,0,0,0,0,0|1,1,1]=4 1413 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,0,0,0,0,0|1,0,1]=3 1414 B6R0.6 [C-]#[N+]CCCCF Amb26005128 [1,0,0,0,0,0|2,0,1]=4 1415 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,0,0,0,0,0|2,0,1]=4 1416 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [1,0,0,0,0,0|2,0,1]=4 1417 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|2,0,1]=4 1418 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,0,0,0,0,0|2,0,1]=4 1419 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [1,0,0,0,0,0|3,0,0]=4 1420 B8R0.5 C#CCC(C)CC(C)=O Amb24707587 [0,1,0,0,0,0|0,0,2]=3 1421 B8R0.5 C#CCC(N)CC(=O)O Amb26909337 [0,1,0,0,0,0|1,0,2]=4 1422 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb22746284 [0,1,0,0,0,0|1,0,2]=4 1423 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb24539924 [0,1,0,0,0,0|1,0,2]=4 1424 B8R0.5 C=C(Br)CC(O)CCC Amb27194656 [0,1,0,0,0,0|1,0,1]=3 1425 B8R0.5 C=C(Br)CN(C)CCC Amb27877357 [0,1,0,0,0,0|2,0,1]=4 1426 B8R0.5 C=C(C)CC(=O)CNC Amb28126869 [0,1,0,0,0,0|2,0,1]=4 1427 B8R0.5 C=C(C)CC(=O)CSC Amb28314038 [0,1,0,0,0,0|2,0,1]=4 1428 B8R0.5 C=C(C)CC(=O)OCC Amb17940814 [0,1,0,0,0,0|2,0,1]=4 1429 B8R0.5 C=C(C)CC(Br)\C=C\C Amb27161189 [0,1,0,0,0,0|1,0,2]=4 1430 B8R0.5 C=C(C)CC(C)CCC Amb22730409 [0,1,0,0,0,0|1,0,0]=2 1431 B8R0.5 C=C(C)CC(C)CCN Amb27210688 [0,1,0,0,0,0|2,0,0]=3 1432 B8R0.5 C=C(C)CC(C)NCC Amb27648467 [0,1,0,0,0,0|2,0,0]=3 1433 B8R0.5 C=C(C)CC(Cl)CCC Amb27842029 [0,1,0,0,0,0|1,0,0]=2 1434 B8R0.5 C=C(C)CC(N)COC Amb27171032 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.5 C=C(C)CC(N)CSC Amb27794207 [0,1,0,0,0,0|2,0,0]=3 1436 B8R0.5 C=C(C)CC(O)CCC Amb28058869 [0,1,0,0,0,0|1,0,0]=2 1437 B8R0.5 C=C(C)CC(O)CCO Amb28049190 [0,1,0,0,0,0|2,0,0]=3 1438 B8R0.5 C=C(C)CC(O)CSC Amb28313018 [0,1,0,0,0,0|2,0,0]=3 1439 B8R0.5 C=C(C)CC(O)\C=C\C Amb4020595 [0,1,0,0,0,0|1,0,2]=4 1440 B8R0.5 C=C(C)CS(=O)CCO Amb28248269 [0,1,0,0,0,0|3,0,0]=4 1441 B8R0.5 C=C(C)C[C@@H](O)CCC Amb27217651 [0,1,0,0,0,0|1,0,0]=2 1442 B8R0.5 C=C(C)C[C@H](O)\C=C\C Amb27602520 [0,1,0,0,0,0|1,0,2]=4 1443 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [0,1,0,0,0,0|1,0,2]=4 1444 B8R0.5 C=CCC(C)CC(C)=O Amb17593320 [0,1,0,0,0,0|0,0,2]=3 1445 B8R0.5 C=CCC(C)NC(C)=O Amb28118292 [0,1,0,0,0,0|1,0,2]=4 1446 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [0,1,0,0,0,0|1,0,2]=4 1447 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [0,1,0,0,0,0|1,0,2]=4 1448 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [0,1,0,0,0,0|1,0,2]=4 1449 B8R0.5 C=CC[C@@H](C)CC(C)=O Amb27974516 [0,1,0,0,0,0|0,0,2]=3 1450 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [0,1,0,0,0,0|1,0,2]=4 1451 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [0,1,0,0,0,0|1,0,2]=4 1452 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [0,1,0,0,0,0|1,0,2]=4 1453 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [0,1,0,0,0,0|1,0,2]=4 1454 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [0,1,0,0,0,0|1,0,2]=4 1455 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [0,1,0,0,0,0|1,0,2]=4 1456 B8R0.5 C=COC(C)CC(C)=O Amb27780768 [0,1,0,0,0,0|1,0,2]=4 1457 B8R0.5 CC(=O)CC(=O)CC#N Amb24456593 [0,1,0,0,0,0|1,0,2]=4 1458 B8R0.5 CC(=O)CC(C)CC=O Amb28076874 [0,1,0,0,0,0|1,0,1]=3 1459 B8R0.5 CC(=O)CC(C)NC=O Amb24477804 [0,1,0,0,0,0|2,0,1]=4 1460 B8R0.5 CC(=O)CC(O)CCBr Amb28290412 [0,1,0,0,0,0|1,0,0]=2 1461 B8R0.5 CC(=O)CN(C)CCO Amb10608107 [0,1,0,0,0,0|2,0,0]=3 1462 B8R0.5 CC(=O)C[C@@H](O)CCBr Amb27400290 [0,1,0,0,0,0|1,0,0]=2 1463 B8R0.5 CC(=O)C[C@H](C)CC=O Amb27265839 [0,1,0,0,0,0|1,0,1]=3 1464 B8R0.5 CC(=O)C\C(Br)=C\CCl Amb27957896 [0,1,0,0,0,0|1,0,2]=4 1465 B8R0.5 CC(=O)C\C(Cl)=C\CCl Amb27256456 [0,1,0,0,0,0|1,0,2]=4 1466 B8R0.5 CC(=O)NC(C)CCO Amb27656183 [0,1,0,0,0,0|2,0,0]=3 1467 B8R0.5 CC(=O)NC(C)CON Amb17138376 [0,1,0,0,0,0|3,0,0]=4 1468 B8R0.5 CC(=O)N[C@H](C)CCO Amb28454929 [0,1,0,0,0,0|2,0,0]=3 1469 B8R0.5 CC(=O)OC(C)CC=O Amb18642743 [0,1,0,0,0,0|2,0,1]=4 1470 B8R0.5 CC(=O)OC(C)CCCl Amb27801962 [0,1,0,0,0,0|2,0,0]=3 1471 B8R0.5 CC(=O)SC(C)CC=O Amb27797287 [0,1,0,0,0,0|2,0,1]=4 1472 B8R0.5 CC(C)CC(Br)CCBr Amb23456162 [0,1,0,0,0,0|2,0,1]=4 1473 B8R0.5 CC(C)CC(C)CCBr Amb26456422 [0,1,0,0,0,0|2,0,1]=4 1474 B8R0.5 CC(C)CC(C)CCCl Amb26988421 [0,1,0,0,0,0|2,0,1]=4 1475 B8R0.5 CC(C)CC(C)CCN Amb25848784 [0,1,0,0,0,0|2,0,1]=4 1476 B8R0.5 CC(C)CC(C)CCO Amb26460233 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.5 CC(C)CC(F)CCN Amb24690000 [0,1,0,0,0,0|2,0,1]=4 1478 B8R0.5 CC(C)CC(N)CCO Amb18203172 [0,1,0,0,0,0|2,0,1]=4 1479 B8R0.5 CC(C)CC(O)CCN Amb17231876 [0,1,0,0,0,0|2,0,1]=4 1480 B8R0.5 CC(C)C[C@@H](C)CCBr Amb27856715 [0,1,0,0,0,0|2,0,1]=4 1481 B8R0.5 CC(C)C[C@@H](O)CCN Amb33203515 [0,1,0,0,0,0|2,0,1]=4 1482 B8R0.5 CC(C)C[C@H](N)CCN Amb26543915 [0,1,0,0,0,0|2,0,1]=4 1483 B8R0.5 CC(C)C[C@H](N)CCO Amb24446600 [0,1,0,0,0,0|2,0,1]=4 1484 B8R0.5 CC(C)C[C@H](O)CCN Amb33203516 [0,1,0,0,0,0|2,0,1]=4 1485 B8R0.5 CC(CC#N)CC(=O)O Amb18642506 [0,1,0,0,0,0|2,0,1]=4 1486 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [0,1,0,0,0,0|2,0,0]=3 1487 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [0,1,0,0,0,0|2,0,0]=3 1488 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [0,1,0,0,0,0|2,0,0]=3 1489 B8R0.5 CC(CCN)CN(C)C Amb17334120 [0,1,0,0,0,0|3,0,0]=4 1490 B8R0.5 CC(CCN)C[PH](=O)O Amb28250150 [0,1,0,0,0,0|3,0,0]=4 1491 B8R0.5 CC(CCN)NS(C)=O Amb27185835 [0,1,0,0,0,0|3,0,0]=4 1492 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [0,1,0,0,0,0|2,0,0]=3 1493 B8R0.5 CC(N)CC(Br)CCN Amb25069225 [0,1,0,0,0,0|2,0,1]=4 1494 B8R0.5 CC(N)CC(Cl)CCN Amb24605143 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.5 CC(N)CC(N)CCN Amb28341774 [0,1,0,0,0,0|2,0,1]=4 1496 B8R0.5 CC(O)CC(C)CCO Amb27970261 [0,1,0,0,0,0|1,0,2]=4 1497 B8R0.5 CC(O)CC(O)CCBr Amb27841515 [0,1,0,0,0,0|1,0,2]=4 1498 B8R0.5 CCCC(=O)CC(C)=O Amb9775079 [0,1,0,0,0,0|0,0,1]=2 1499 B8R0.5 CCCC(=O)CC(C)C Amb4011926 [0,1,0,0,0,0|1,0,2]=4 1500 B8R0.5 CCCC(=O)CC(N)=O Amb28290969 [0,1,0,0,0,0|1,0,1]=3 1501 B8R0.5 CCCC(=O)\C=C(\C)N Amb25059647 [0,1,0,0,0,0|1,0,2]=4 1502 B8R0.5 CCCC(Br)CC(C)=O Amb27974270 [0,1,0,0,0,0|0,0,0]=1 1503 B8R0.5 CCCC(Br)CC(C)C Amb27478078 [0,1,0,0,0,0|1,0,1]=3 1504 B8R0.5 CCCC(C)CC(=N)N Amb25771598 [0,1,0,0,0,0|2,0,0]=3 1505 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [0,1,0,0,0,0|1,0,0]=2 1506 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,1,0,0,0,0|0,0,0]=1 1507 B8R0.5 CCCC(C)CC(C)Br Amb27779289 [0,1,0,0,0,0|1,0,1]=3 1508 B8R0.5 CCCC(C)CC(C)C Amb22228271 [0,1,0,0,0,0|1,0,1]=3 1509 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,1,0,0,0,0|0,0,2]=3 1510 B8R0.5 CCCC(C)CC(Cl)Cl Amb26949701 [0,1,0,0,0,0|2,0,1]=4 1511 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,1,0,0,0,0|1,0,0]=2 1512 B8R0.5 CCCC(C)CC(N)=S Amb26066806 [0,1,0,0,0,0|1,1,0]=3 1513 B8R0.5 CCCC(C)CN(C)O Amb33322352 [0,1,0,0,0,0|1,0,1]=3 1514 B8R0.5 CCCC(C)CS(=O)[O-] Amb32755301 [0,1,0,0,0,0|2,0,0]=3 1515 B8R0.5 CCCC(C)C[C@@H](C)N Amb33321142 [0,1,0,0,0,0|1,0,1]=3 1516 B8R0.5 CCCC(C)C[C@@H](C)O Amb33321139 [0,1,0,0,0,0|0,0,2]=3 1517 B8R0.5 CCCC(C)C[C@H](C)N Amb33321141 [0,1,0,0,0,0|1,0,1]=3 1518 B8R0.5 CCCC(C)C[C@H](C)O Amb33321088 [0,1,0,0,0,0|0,0,2]=3 1519 B8R0.5 CCCC(C)C[N+](=O)[O-] Amb33321122 [0,1,0,0,0,0|2,0,0]=3 1520 B8R0.5 CCCC(C)NC(=O)Cl Amb35637095 [0,1,0,0,0,0|2,0,0]=3 1521 B8R0.5 CCCC(C)NC(C)C Amb6685546 [0,1,0,0,0,0|2,0,1]=4 1522 B8R0.5 CCCC(C)NC(N)=S Amb9212106 [0,1,0,0,0,0|2,1,0]=4 1523 B8R0.5 CCCC(C)OC(=O)Cl Amb27205395 [0,1,0,0,0,0|2,0,0]=3 1524 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,1,0,0,0,0|1,0,0]=2 1525 B8R0.5 CCCC(C)OC(N)=O Amb27150798 [0,1,0,0,0,0|2,0,0]=3 1526 B8R0.5 CCCC(Cl)OC(C)=O Amb27490997 [0,1,0,0,0,0|1,0,0]=2 1527 B8R0.5 CCCC(N)C=C(C)C Amb28240518 [0,1,0,0,0,0|1,0,1]=3 1528 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [0,1,0,0,0,0|1,0,0]=2 1529 B8R0.5 CCCC(N)CC(C)=O Amb28069229 [0,1,0,0,0,0|0,0,0]=1 1530 B8R0.5 CCCC(N)CC(C)C Amb18307059 [0,1,0,0,0,0|1,0,1]=3 1531 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,1,0,0,0,0|1,0,0]=2 1532 B8R0.5 CCCC(N)CS(C)=O Amb27475787 [0,1,0,0,0,0|1,0,0]=2 1533 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [0,1,0,0,0,0|1,0,0]=2 1534 B8R0.5 CCCC(O)CC(C)=O Amb17593376 [0,1,0,0,0,0|0,0,0]=1 1535 B8R0.5 CCCC(O)CC(C)Br Amb28325578 [0,1,0,0,0,0|1,0,1]=3 1536 B8R0.5 CCCC(O)CC(C)C Amb22730597 [0,1,0,0,0,0|1,0,1]=3 1537 B8R0.5 CCCC(O)CC(C)O Amb27484551 [0,1,0,0,0,0|0,0,2]=3 1538 B8R0.5 CCCC(O)CN(C)C Amb27262225 [0,1,0,0,0,0|2,0,0]=3 1539 B8R0.5 CCCC(O)OS(=O)[O-] Amb28139797 [0,1,0,0,0,0|3,0,0]=4 1540 B8R0.5 CCCC(O)SC(C)=O Amb27807055 [0,1,0,0,0,0|1,0,0]=2 1541 B8R0.5 CCCN(C)CC(=O)O Amb19373314 [0,1,0,0,0,0|2,0,0]=3 1542 B8R0.5 CCCN(C)CC(=O)O Amb8899167 [0,1,0,0,0,0|2,0,0]=3 1543 B8R0.5 CCCN(C)CC(C)Cl Amb28201473 [0,1,0,0,0,0|2,0,1]=4 1544 B8R0.5 CCCN(C)CC(C)O Amb17334132 [0,1,0,0,0,0|1,0,2]=4 1545 B8R0.5 CCCN(C)C[C@H](C)N Amb27435517 [0,1,0,0,0,0|2,0,1]=4 1546 B8R0.5 CCCN(O)CC(=O)O Amb27850231 [0,1,0,0,0,0|2,0,0]=3 1547 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,1,0,0,0,0|2,0,0]=3 1548 B8R0.5 CCCS(=O)CC(C)=O Amb27180126 [0,1,0,0,0,0|1,0,0]=2 1549 B8R0.5 CCCS(=O)C[C@H](C)N Amb27168638 [0,1,0,0,0,0|2,0,1]=4 1550 B8R0.5 CCCS(=O)N=C(C)C Amb35718883 [0,1,0,0,0,0|3,0,0]=4 1551 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [0,1,0,0,0,0|1,0,0]=2 1552 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [0,1,0,0,0,0|1,0,0]=2 1553 B8R0.5 CCC[C@@H](N)CC(C)C Amb28187619 [0,1,0,0,0,0|1,0,1]=3 1554 B8R0.5 CCC[C@@H](N)CN(C)C Amb28313757 [0,1,0,0,0,0|2,0,0]=3 1555 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [0,1,0,0,0,0|1,0,0]=2 1556 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,1,0,0,0,0|0,0,0]=1 1557 B8R0.5 CCC[C@@H](O)CC(C)C Amb27603567 [0,1,0,0,0,0|1,0,1]=3 1558 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [0,1,0,0,0,0|1,0,0]=2 1559 B8R0.5 CCC[C@H](C)NC(C)=O Amb27655527 [0,1,0,0,0,0|1,0,0]=2 1560 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [0,1,0,0,0,0|1,0,0]=2 1561 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [0,1,0,0,0,0|1,0,0]=2 1562 B8R0.5 CCC[C@H](N)CC(C)C Amb27211349 [0,1,0,0,0,0|1,0,1]=3 1563 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [0,1,0,0,0,0|1,0,0]=2 1564 B8R0.5 CCC[C@H](O)C[C@H](C)O Amb27653094 [0,1,0,0,0,0|0,0,2]=3 1565 B8R0.5 CCC[C@H](S)C[C@H](C)O Amb28049110 [0,1,0,0,0,0|0,0,2]=3 1566 B8R0.5 CCC\C(C)=C\C(=O)O Amb33528454 [0,1,0,0,0,0|1,0,2]=4 1567 B8R0.5 CCC\C(C)=C\C(C)=O Amb28289440 [0,1,0,0,0,0|0,0,2]=3 1568 B8R0.5 CCC\C(C)=C\C(N)=O Amb27799064 [0,1,0,0,0,0|1,0,2]=4 1569 B8R0.5 CCC\C(C)=N\S(C)=O Amb29849336 [0,1,0,0,0,0|2,0,1]=4 1570 B8R0.5 CCC\C(N)=C\C(N)=O Amb27620335 [0,1,0,0,0,0|1,0,2]=4 1571 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,1,0,0,0,0|2,0,1]=4 1572 B8R0.5 CCNC(=O)CC(C)=O Amb6254356 [0,1,0,0,0,0|1,0,1]=3 1573 B8R0.5 CCNC(=O)CC(N)=O Amb28058296 [0,1,0,0,0,0|2,0,1]=4 1574 B8R0.5 CCNC(C)C=C(C)C Amb27225629 [0,1,0,0,0,0|2,0,1]=4 1575 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [0,1,0,0,0,0|2,0,0]=3 1576 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [0,1,0,0,0,0|2,0,0]=3 1577 B8R0.5 CCNC(C)CC(N)=O Amb17231866 [0,1,0,0,0,0|2,0,0]=3 1578 B8R0.5 CCNC(C)CN(C)C Amb9783249 [0,1,0,0,0,0|3,0,0]=4 1579 B8R0.5 CCN\C(C)=C\C(C)=O Amb27843358 [0,1,0,0,0,0|1,0,2]=4 1580 B8R0.5 CCOC(=N)CC(=O)O Amb26612803 [0,1,0,0,0,0|2,0,1]=4 1581 B8R0.5 CCOC(=N)CC(N)=O Amb26328004 [0,1,0,0,0,0|2,0,1]=4 1582 B8R0.5 CCOC(=O)CC(=O)Cl Amb3939375 [0,1,0,0,0,0|2,0,1]=4 1583 B8R0.5 CCOC(=O)CC(=O)O Amb22492654 [0,1,0,0,0,0|2,0,1]=4 1584 B8R0.5 CCOC(=O)CC(=O)O Amb3939916 [0,1,0,0,0,0|2,0,1]=4 1585 B8R0.5 CCOC(=O)CC(=O)[O-] Amb2221978 [0,1,0,0,0,0|2,0,1]=4 1586 B8R0.5 CCOC(=O)CC(C)=O Amb2793050 [0,1,0,0,0,0|1,0,1]=3 1587 B8R0.5 CCOC(=O)CC(N)=O Amb8390795 [0,1,0,0,0,0|2,0,1]=4 1588 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [0,1,0,0,0,0|2,0,1]=4 1589 B8R0.5 CCOC(=O)NC(C)=O Amb4017539 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.5 CCOC(C)CC(=N)N Amb33424963 [0,1,0,0,0,0|3,0,0]=4 1591 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,1,0,0,0,0|2,0,0]=3 1592 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,1,0,0,0,0|1,0,0]=2 1593 B8R0.5 CCOC(C)CC(C)Br Amb26064110 [0,1,0,0,0,0|2,0,1]=4 1594 B8R0.5 CCOC(C)CC(C)O Amb26629604 [0,1,0,0,0,0|1,0,2]=4 1595 B8R0.5 CCOC(C)CC(N)=S Amb33424942 [0,1,0,0,0,0|2,1,0]=4 1596 B8R0.5 CCOC(C)CN(C)O Amb33425716 [0,1,0,0,0,0|2,0,1]=4 1597 B8R0.5 CCOC(C)C[C@@H](C)N Amb33425065 [0,1,0,0,0,0|2,0,1]=4 1598 B8R0.5 CCOC(C)C[C@@H](C)O Amb33425062 [0,1,0,0,0,0|1,0,2]=4 1599 B8R0.5 CCOC(C)C[C@H](C)N Amb33425064 [0,1,0,0,0,0|2,0,1]=4 1600 B8R0.5 CCOC(C)C[C@H](C)O Amb33225080 [0,1,0,0,0,0|1,0,2]=4 1601 B8R0.5 CCOC(C)C[N+](=O)[O-] Amb33425047 [0,1,0,0,0,0|3,0,0]=4 1602 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,1,0,0,0,0|2,0,0]=3 1603 B8R0.5 CCOC(Cl)CC(C)Cl Amb27658952 [0,1,0,0,0,0|2,0,1]=4 1604 B8R0.5 CCOC(Cl)CS(=O)Cl Amb27591703 [0,1,0,0,0,0|3,0,0]=4 1605 B8R0.5 CCOC(Cl)OC(C)=O Amb28145161 [0,1,0,0,0,0|2,0,0]=3 1606 B8R0.5 CCO[C@@H](C)CC(C)=O Amb27424691 [0,1,0,0,0,0|1,0,0]=2 1607 B8R0.5 CCO[C@@H](C)C[C@@H](C)O Amb27481375 [0,1,0,0,0,0|1,0,2]=4 1608 B8R0.5 CCO[C@@H](C)C[C@H](C)O Amb27424949 [0,1,0,0,0,0|1,0,2]=4 1609 B8R0.5 CCO[C@H](O)CC(C)=O Amb27838621 [0,1,0,0,0,0|1,0,0]=2 1610 B8R0.5 CCO\C(C)=C/C(C)=O Amb25147210 [0,1,0,0,0,0|1,0,2]=4 1611 B8R0.5 CCO\C(C)=C\C(C)=O Amb28134099 [0,1,0,0,0,0|1,0,2]=4 1612 B8R0.5 CCSC(=O)CC(=O)O Amb27406351 [0,1,0,0,0,0|2,0,1]=4 1613 B8R0.5 CCSC(=O)CC(C)=O Amb27234619 [0,1,0,0,0,0|1,0,1]=3 1614 B8R0.5 CCSC(=S)CC(C)=O Amb27838746 [0,1,0,0,0,0|1,0,1]=3 1615 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [0,1,0,0,0,0|2,0,0]=3 1616 B8R0.5 CC\C=C(/Br)CC(=O)O Amb28208655 [0,1,0,0,0,0|1,0,2]=4 1617 B8R0.5 CC\C=C(\C)CC(N)=O Amb27771837 [0,1,0,0,0,0|1,0,2]=4 1618 B8R0.5 CC\N=C(/C)CC(C)=O Amb28052216 [0,1,0,0,0,0|1,0,1]=3 1619 B8R0.5 CN(C)CC(N)CCO Amb27444083 [0,1,0,0,0,0|3,0,0]=4 1620 B8R0.5 CN(C)CC(O)CCN Amb18063241 [0,1,0,0,0,0|3,0,0]=4 1621 B8R0.5 CN(C)CC(O)CCO Amb27653015 [0,1,0,0,0,0|3,0,0]=4 1622 B8R0.5 CN(C)C[C@H](N)CCO Amb27180812 [0,1,0,0,0,0|3,0,0]=4 1623 B8R0.5 CN(CCF)CC(N)=O Amb27254943 [0,1,0,0,0,0|3,0,0]=4 1624 B8R0.5 CN(CCN)CC(=O)O Amb18313585 [0,1,0,0,0,0|3,0,0]=4 1625 B8R0.5 CN(CCN)CC(=O)O Amb32701580 [0,1,0,0,0,0|3,0,0]=4 1626 B8R0.5 CN(CCO)CC(=O)O Amb5767486 [0,1,0,0,0,0|3,0,0]=4 1627 B8R0.5 CNCC(C)CC(C)O Amb27786755 [0,1,0,0,0,0|1,0,2]=4 1628 B8R0.5 CNCC(C)OC(N)=O Amb28078033 [0,1,0,0,0,0|3,0,0]=4 1629 B8R0.5 CNCC(N)CC(C)C Amb19009731 [0,1,0,0,0,0|2,0,1]=4 1630 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [0,1,0,0,0,0|2,0,0]=3 1631 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [0,1,0,0,0,0|2,0,0]=3 1632 B8R0.5 CNCC(O)CC(C)C Amb19031253 [0,1,0,0,0,0|2,0,1]=4 1633 B8R0.5 CNCC(O)CN(C)C Amb9740991 [0,1,0,0,0,0|3,0,0]=4 1634 B8R0.5 CNCC(O)CS(C)=O Amb27477065 [0,1,0,0,0,0|2,0,0]=3 1635 B8R0.5 CNC[C@H](N)CC(=O)O Amb27798881 [0,1,0,0,0,0|2,0,0]=3 1636 B8R0.5 CN\N=C(/C)CC(C)=O Amb27850029 [0,1,0,0,0,0|2,0,1]=4 1637 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [0,1,0,0,0,0|2,0,1]=4 1638 B8R0.5 COCC(=O)CC(C)=O Amb15701314 [0,1,0,0,0,0|1,0,1]=3 1639 B8R0.5 COCC(Br)CN(C)C Amb28136096 [0,1,0,0,0,0|3,0,0]=4 1640 B8R0.5 COCC(C)CC(=O)O Amb19024342 [0,1,0,0,0,0|2,0,0]=3 1641 B8R0.5 COCC(C)CC(C)=O Amb27464321 [0,1,0,0,0,0|1,0,0]=2 1642 B8R0.5 COCC(C)CC(C)Br Amb27838446 [0,1,0,0,0,0|2,0,1]=4 1643 B8R0.5 COCC(C)CC(C)Cl Amb27225461 [0,1,0,0,0,0|2,0,1]=4 1644 B8R0.5 COCC(C)CC(C)N Amb27838441 [0,1,0,0,0,0|2,0,1]=4 1645 B8R0.5 COCC(C)CC(C)O Amb27796096 [0,1,0,0,0,0|1,0,2]=4 1646 B8R0.5 COCC(C)CC(N)=O Amb27860801 [0,1,0,0,0,0|2,0,0]=3 1647 B8R0.5 COCC(C)CS(=O)Cl Amb32720532 [0,1,0,0,0,0|3,0,0]=4 1648 B8R0.5 COCC(C)CS(=O)[O-] Amb32754752 [0,1,0,0,0,0|3,0,0]=4 1649 B8R0.5 COCC(C)CS(N)=O Amb32720533 [0,1,0,0,0,0|3,0,0]=4 1650 B8R0.5 COCC(C)NC(=O)Cl Amb35637106 [0,1,0,0,0,0|3,0,0]=4 1651 B8R0.5 COCC(C)NC(C)=N Amb28049795 [0,1,0,0,0,0|3,0,0]=4 1652 B8R0.5 COCC(C)NC(N)=O Amb405922 [0,1,0,0,0,0|3,0,0]=4 1653 B8R0.5 COCC(C)OC(=O)Cl Amb27395128 [0,1,0,0,0,0|3,0,0]=4 1654 B8R0.5 COCC(C)OC(C)=O Amb8516695 [0,1,0,0,0,0|2,0,0]=3 1655 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,1,0,0,0,0|3,0,0]=4 1656 B8R0.5 COCC(N)C=C(C)C Amb27413277 [0,1,0,0,0,0|2,0,1]=4 1657 B8R0.5 COCC(N)CC(=O)O Amb26641146 [0,1,0,0,0,0|2,0,0]=3 1658 B8R0.5 COCC(N)CC(C)O Amb27433240 [0,1,0,0,0,0|1,0,2]=4 1659 B8R0.5 COCC(N)CC(N)=O Amb33308419 [0,1,0,0,0,0|2,0,0]=3 1660 B8R0.5 COCC(O)CC(=N)N Amb24665644 [0,1,0,0,0,0|3,0,0]=4 1661 B8R0.5 COCC(O)CC(=O)O Amb18832518 [0,1,0,0,0,0|2,0,0]=3 1662 B8R0.5 COCC(O)CC(C)C Amb19301971 [0,1,0,0,0,0|2,0,1]=4 1663 B8R0.5 COCC(O)CC(N)=S Amb27657699 [0,1,0,0,0,0|2,1,0]=4 1664 B8R0.5 COC[C@@H](C)OC(C)=O Amb27460270 [0,1,0,0,0,0|2,0,0]=3 1665 B8R0.5 COC[C@@H](N)CC(C)C Amb17061639 [0,1,0,0,0,0|2,0,1]=4 1666 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [0,1,0,0,0,0|2,0,0]=3 1667 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [0,1,0,0,0,0|2,0,0]=3 1668 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [0,1,0,0,0,0|2,0,0]=3 1669 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [0,1,0,0,0,0|2,0,0]=3 1670 B8R0.5 COC\C(C)=C\C(C)=O Amb28323854 [0,1,0,0,0,0|1,0,2]=4 1671 B8R0.5 CONC(C)CC(=O)O Amb26844930 [0,1,0,0,0,0|3,0,0]=4 1672 B8R0.5 COOC(=O)CC(C)=O Amb24096083 [0,1,0,0,0,0|2,0,1]=4 1673 B8R0.5 CO\N=C(/C)CC(C)=O Amb25179533 [0,1,0,0,0,0|2,0,1]=4 1674 B8R0.5 CPCC(N)CC(=O)O Amb27184896 [0,1,0,0,0,0|2,0,0]=3 1675 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [0,1,0,0,0,0|2,0,0]=3 1676 B8R0.5 CSCC(C)CC(C)C Amb27180886 [0,1,0,0,0,0|2,0,1]=4 1677 B8R0.5 CSCC(C)NC(=O)Cl Amb35633391 [0,1,0,0,0,0|3,0,0]=4 1678 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,1,0,0,0,0|2,0,0]=3 1679 B8R0.5 CSCC(N)CC(=O)O Amb25960719 [0,1,0,0,0,0|2,0,0]=3 1680 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [0,1,0,0,0,0|2,0,0]=3 1681 B8R0.5 CSCC(O)CC(C)C Amb27593158 [0,1,0,0,0,0|2,0,1]=4 1682 B8R0.5 CSC[C@@H](N)CC(=O)O Amb27961000 [0,1,0,0,0,0|2,0,0]=3 1683 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [0,1,0,0,0,0|2,0,0]=3 1684 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [0,1,0,0,0,0|2,0,0]=3 1685 B8R0.5 C[C@@H](O)C[C@H](C)CCO Amb27766934 [0,1,0,0,0,0|1,0,2]=4 1686 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [0,1,0,0,0,0|2,0,0]=3 1687 B8R0.5 C[C@H](O)C[C@@H](C)CCO Amb27598607 [0,1,0,0,0,0|1,0,2]=4 1688 B8R0.5 C[C@H](O)C[C@H](O)CCBr Amb27983593 [0,1,0,0,0,0|1,0,2]=4 1689 B8R0.5 C\C=C\C(C)NC(C)=O Amb27405355 [0,1,0,0,0,0|1,0,2]=4 1690 B8R0.5 C\C=C\C(Cl)CC(=O)Cl Amb27407059 [0,1,0,0,0,0|1,0,2]=4 1691 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [0,1,0,0,0,0|1,0,2]=4 1692 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,1,0,0,0,0|1,0,2]=4 1693 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [0,1,0,0,0,0|1,0,2]=4 1694 B8R0.5 C\C=C\C(O)SC(C)=O Amb27653044 [0,1,0,0,0,0|1,0,2]=4 1695 B8R0.5 C\C=C\[C@@H](C)CC(C)=O Amb27598952 [0,1,0,0,0,0|0,0,2]=3 1696 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [0,1,0,0,0,0|1,0,2]=4 1697 B8R0.5 C\C=C\[C@H](C)CC(C)=O Amb28246522 [0,1,0,0,0,0|0,0,2]=3 1698 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [0,1,0,0,0,0|2,0,1]=4 1699 B8R0.5 N#CCC(O)CC(N)=O Amb27259184 [0,1,0,0,0,0|2,0,1]=4 1700 B8R0.5 N#CC[C@@H](O)CC(N)=O Amb22225367 [0,1,0,0,0,0|2,0,1]=4 1701 B8R0.5 N#CC[C@H](O)CC(N)=O Amb22226710 [0,1,0,0,0,0|2,0,1]=4 1702 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [0,1,0,0,0,0|2,0,0]=3 1703 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [0,1,0,0,0,0|2,0,0]=3 1704 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [0,1,0,0,0,0|2,0,0]=3 1705 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [0,1,0,0,0,0|2,0,0]=3 1706 B8R0.5 NCCS(=O)CC(N)=O Amb28456172 [0,1,0,0,0,0|3,0,0]=4 1707 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [0,1,0,0,0,0|2,0,0]=3 1708 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [0,1,0,0,0,0|2,0,0]=3 1709 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [0,1,0,0,0,0|2,0,0]=3 1710 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [0,1,0,0,0,0|2,0,0]=3 1711 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [0,1,0,0,0,0|2,0,0]=3 1712 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [0,1,0,0,0,0|3,0,0]=4 1713 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [0,1,0,0,0,0|2,0,0]=3 1714 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [0,1,0,0,0,0|2,0,0]=3 1715 B8R0.5 [C-]#[N+]CC(C)NC(C)=O Amb27967258 [0,1,0,0,0,0|2,0,1]=4 1716 B8R0.6 C#CC(=O)CCCCC Amb27844075 [0,1,0,0,0,0|0,0,1]=2 1717 B8R0.6 C#CC(=O)CCNCC Amb27252840 [0,1,0,0,0,0|1,0,1]=3 1718 B8R0.6 C#CC(=O)COCCN Amb28194342 [0,1,0,0,0,0|2,0,1]=4 1719 B8R0.6 C#CC(=O)CSCCC Amb27436447 [0,1,0,0,0,0|1,0,1]=3 1720 B8R0.6 C#CC(=O)NCCCF Amb27977478 [0,1,0,0,0,0|2,0,1]=4 1721 B8R0.6 C#CC(=O)NCCCN Amb18296191 [0,1,0,0,0,0|2,0,1]=4 1722 B8R0.6 C#CC(=O)NCCOC Amb26516143 [0,1,0,0,0,0|2,0,1]=4 1723 B8R0.6 C#CC(=O)NOCCC Amb35735987 [0,1,0,0,0,0|2,0,1]=4 1724 B8R0.6 C#CC(=O)OCCCC Amb25839203 [0,1,0,0,0,0|1,0,1]=3 1725 B8R0.6 C#CC(C)NCCCC Amb25918608 [0,1,0,0,0,0|2,0,1]=4 1726 B8R0.6 C#CC(O)CCCCC Amb2721717 [0,1,0,0,0,0|0,0,3]=4 1727 B8R0.6 C#CCCCC(=O)CBr Amb27164981 [0,1,0,0,0,0|0,0,2]=3 1728 B8R0.6 C#CCCCC(=O)CC Amb27837514 [0,1,0,0,0,0|0,0,2]=3 1729 B8R0.6 C#CCCCC(=O)CN Amb27788268 [0,1,0,0,0,0|0,0,2]=3 1730 B8R0.6 C#CCCCC(=O)NC Amb27482425 [0,1,0,0,0,0|0,0,2]=3 1731 B8R0.6 C#CCCCC(=O)NN Amb28342617 [0,1,0,0,0,0|1,0,2]=4 1732 B8R0.6 C#CCCCC(=O)OC Amb2721693 [0,1,0,0,0,0|0,0,2]=3 1733 B8R0.6 C#CCCCC(=O)SC Amb27457790 [0,1,0,0,0,0|0,0,2]=3 1734 B8R0.6 C#CCCNC(=O)CBr Amb22896651 [0,1,0,0,0,0|1,0,2]=4 1735 B8R0.6 C#CCCNC(=O)CCl Amb27461693 [0,1,0,0,0,0|1,0,2]=4 1736 B8R0.6 C#CCCNC(=O)CS Amb28191980 [0,1,0,0,0,0|1,0,2]=4 1737 B8R0.6 C#CCCNC(=O)NC Amb28239416 [0,1,0,0,0,0|1,0,2]=4 1738 B8R0.6 C#CCCNC(=O)OC Amb24477847 [0,1,0,0,0,0|1,0,2]=4 1739 B8R0.6 C#CCCOC(=O)CO Amb27632704 [0,1,0,0,0,0|1,0,2]=4 1740 B8R0.6 C#CCNCC(=O)OC Amb6706474 [0,1,0,0,0,0|1,0,2]=4 1741 B8R0.6 C#CCOCC(=O)OC Amb9208653 [0,1,0,0,0,0|1,0,2]=4 1742 B8R0.6 C#C[C@@H](O)CCCCC Amb8516365 [0,1,0,0,0,0|0,0,3]=4 1743 B8R0.6 C#C[C@H](C)CCCCO Amb27766839 [0,1,0,0,0,0|2,0,1]=4 1744 B8R0.6 C#C[C@H](O)CCCCC Amb8516404 [0,1,0,0,0,0|0,0,3]=4 1745 B8R0.6 C=C(C=O)CCCCC Amb18642442 [0,1,0,0,0,0|0,0,1]=2 1746 B8R0.6 C=C(C=O)CCCCCl Amb27621755 [0,1,0,0,0,0|1,0,1]=3 1747 B8R0.6 C=C(CBr)CCCCC Amb27875113 [0,1,0,0,0,0|1,0,0]=2 1748 B8R0.6 C=C(CBr)CNOCC Amb27431603 [0,1,0,0,0,0|3,0,0]=4 1749 B8R0.6 C=C(CC)CCCCCl Amb27430621 [0,1,0,0,0,0|2,0,0]=3 1750 B8R0.6 C=C(CC)CCCCO Amb25057130 [0,1,0,0,0,0|2,0,0]=3 1751 B8R0.6 C=C(CC)CNCCC Amb27456809 [0,1,0,0,0,0|2,0,0]=3 1752 B8R0.6 C=C(CC)CNCCF Amb27979485 [0,1,0,0,0,0|3,0,0]=4 1753 B8R0.6 C=C(CC)CSCCN Amb27174810 [0,1,0,0,0,0|3,0,0]=4 1754 B8R0.6 C=C(CC)NCCCC Amb27230099 [0,1,0,0,0,0|2,0,0]=3 1755 B8R0.6 C=C(CCCCCl)OC Amb27470874 [0,1,0,0,0,0|2,0,0]=3 1756 B8R0.6 C=C(CCl)COCCC Amb27629932 [0,1,0,0,0,0|2,0,0]=3 1757 B8R0.6 C=C(CCl)OCOCC Amb28045981 [0,1,0,0,0,0|3,0,0]=4 1758 B8R0.6 C=C(CN)CSCCC Amb27771737 [0,1,0,0,0,0|2,0,0]=3 1759 B8R0.6 C=C(CO)CCCC#N Amb27801561 [0,1,0,0,0,0|2,0,1]=4 1760 B8R0.6 C=C(CO)CCCCO Amb27405284 [0,1,0,0,0,0|2,0,0]=3 1761 B8R0.6 C=C(CO)CSCCO Amb27959258 [0,1,0,0,0,0|3,0,0]=4 1762 B8R0.6 C=C(\C=C\CCC)CBr Amb33335674 [0,1,0,0,0,0|1,0,2]=4 1763 B8R0.6 C=C(\C=C\CCC)CN Amb33424828 [0,1,0,0,0,0|1,0,2]=4 1764 B8R0.6 C=C=C(C)COCCCl Amb27881456 [0,1,0,0,0,0|3,0,0]=4 1765 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [0,1,0,0,0,0|0,0,3]=4 1766 B8R0.6 C=CC(=O)CCCCC Amb20671146 [0,1,0,0,0,0|0,0,1]=2 1767 B8R0.6 C=CC(=O)CC\C=C/C Amb27838702 [0,1,0,0,0,0|0,0,3]=4 1768 B8R0.6 C=CC(=O)COCCN Amb27410002 [0,1,0,0,0,0|2,0,1]=4 1769 B8R0.6 C=CC(=O)CSCCC Amb28041993 [0,1,0,0,0,0|1,0,1]=3 1770 B8R0.6 C=CC(=O)C\C=C/CC Amb27838780 [0,1,0,0,0,0|0,0,3]=4 1771 B8R0.6 C=CC(=O)C\C=C\CC Amb24574125 [0,1,0,0,0,0|0,0,3]=4 1772 B8R0.6 C=CC(=O)NCCCC Amb9480528 [0,1,0,0,0,0|1,0,1]=3 1773 B8R0.6 C=CC(=O)NCCCO Amb33531592 [0,1,0,0,0,0|2,0,1]=4 1774 B8R0.6 C=CC(=O)NCCOC Amb9480397 [0,1,0,0,0,0|2,0,1]=4 1775 B8R0.6 C=CC(=O)OCCCC Amb3940493 [0,1,0,0,0,0|1,0,1]=3 1776 B8R0.6 C=CC(=O)OCCCC Amb3940920 [0,1,0,0,0,0|1,0,1]=3 1777 B8R0.6 C=CC(=O)OCCCN Amb24120374 [0,1,0,0,0,0|2,0,1]=4 1778 B8R0.6 C=CC(=O)OCCCN Amb30585183 [0,1,0,0,0,0|2,0,1]=4 1779 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,1,0,0,0,0|2,0,1]=4 1780 B8R0.6 C=CC(=O)OCCOC Amb8515845 [0,1,0,0,0,0|2,0,1]=4 1781 B8R0.6 C=CC(=O)OCCSC Amb17940077 [0,1,0,0,0,0|2,0,1]=4 1782 B8R0.6 C=CC(=O)\C=C\CCC Amb33448444 [0,1,0,0,0,0|0,0,3]=4 1783 B8R0.6 C=CC(C)CCCCC Amb27963700 [0,1,0,0,0,0|1,0,1]=3 1784 B8R0.6 C=CC(C)OCCCC Amb27420990 [0,1,0,0,0,0|2,0,1]=4 1785 B8R0.6 C=CC(C)SCCCC Amb28190115 [0,1,0,0,0,0|2,0,1]=4 1786 B8R0.6 C=CC(O)CCCCC Amb3940384 [0,1,0,0,0,0|0,0,3]=4 1787 B8R0.6 C=CCCCC(=C)C=O Amb27802486 [0,1,0,0,0,0|0,0,3]=4 1788 B8R0.6 C=CCCCC(=O)CBr Amb27966828 [0,1,0,0,0,0|0,0,2]=3 1789 B8R0.6 C=CCCCC(=O)CC Amb27249620 [0,1,0,0,0,0|0,0,2]=3 1790 B8R0.6 C=CCCCC(=O)OC Amb22730759 [0,1,0,0,0,0|0,0,2]=3 1791 B8R0.6 C=CCCCC(C)C=O Amb27984474 [0,1,0,0,0,0|0,0,3]=4 1792 B8R0.6 C=CCCCN(C)C=O Amb25209472 [0,1,0,0,0,0|1,0,2]=4 1793 B8R0.6 C=CCCC[C@@H](C)C=O Amb27755054 [0,1,0,0,0,0|0,0,3]=4 1794 B8R0.6 C=CCCC[C@H](C)C=O Amb27876153 [0,1,0,0,0,0|0,0,3]=4 1795 B8R0.6 C=CCCNC(=O)NC Amb27883334 [0,1,0,0,0,0|1,0,2]=4 1796 B8R0.6 C=CCCOC(=O)CO Amb27487083 [0,1,0,0,0,0|1,0,2]=4 1797 B8R0.6 C=CCC\C=C(/C)C=O Amb8392692 [0,1,0,0,0,0|0,0,3]=4 1798 B8R0.6 C=CCC\C=C(\C)C=O Amb27854940 [0,1,0,0,0,0|0,0,3]=4 1799 B8R0.6 C=CCNCC(=O)OC Amb6706546 [0,1,0,0,0,0|1,0,2]=4 1800 B8R0.6 C=CCOCC(=O)CC Amb27181141 [0,1,0,0,0,0|1,0,2]=4 1801 B8R0.6 C=CCOCC(=O)CN Amb26046396 [0,1,0,0,0,0|1,0,2]=4 1802 B8R0.6 C=CCOCC(=O)CO Amb27256454 [0,1,0,0,0,0|1,0,2]=4 1803 B8R0.6 C=CCOCC(=O)OC Amb7793827 [0,1,0,0,0,0|1,0,2]=4 1804 B8R0.6 C=CCSCC(=O)CC Amb27856651 [0,1,0,0,0,0|1,0,2]=4 1805 B8R0.6 C=COCCC(=O)OC Amb27394977 [0,1,0,0,0,0|1,0,2]=4 1806 B8R0.6 C=C[C@@H](O)CCCCC Amb8513277 [0,1,0,0,0,0|0,0,3]=4 1807 B8R0.6 C=C[C@H](Cl)CCCCC Amb27863541 [0,1,0,0,0,0|1,0,2]=4 1808 B8R0.6 C=C[C@H](O)CCCCC Amb8515093 [0,1,0,0,0,0|0,0,3]=4 1809 B8R0.6 CC#CCNC(=O)CCl Amb27175110 [0,1,0,0,0,0|1,0,2]=4 1810 B8R0.6 CC#CCNC(=O)OC Amb27266040 [0,1,0,0,0,0|1,0,2]=4 1811 B8R0.6 CC(C=O)CCCC=O Amb18642651 [0,1,0,0,0,0|1,0,2]=4 1812 B8R0.6 CC(C=O)COCCO Amb28313015 [0,1,0,0,0,0|2,0,1]=4 1813 B8R0.6 CC(CCCCF)NN Amb27446377 [0,1,0,0,0,0|2,0,1]=4 1814 B8R0.6 CC(CCCCN)NO Amb27956523 [0,1,0,0,0,0|1,0,2]=4 1815 B8R0.6 CC(CO)CCCCO Amb27751851 [0,1,0,0,0,0|1,0,2]=4 1816 B8R0.6 CCC(=N)NCCOC Amb27837451 [0,1,0,0,0,0|3,0,0]=4 1817 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,1,0,0,0,0|1,0,0]=2 1818 B8R0.6 CCC(=O)CCN=[N+]=[N-] Amb27759356 [0,1,0,0,0,0|3,0,0]=4 1819 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,1,0,0,0,0|2,0,0]=3 1820 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,1,0,0,0,0|2,0,0]=3 1821 B8R0.6 CCC(=O)NCCC#N Amb17399812 [0,1,0,0,0,0|2,0,1]=4 1822 B8R0.6 CCC(=O)NCCC=O Amb17102166 [0,1,0,0,0,0|2,0,1]=4 1823 B8R0.6 CCC(=O)NCCCBr Amb9209422 [0,1,0,0,0,0|2,0,0]=3 1824 B8R0.6 CCC(=O)NCCCCl Amb3886595 [0,1,0,0,0,0|2,0,0]=3 1825 B8R0.6 CCC(=O)NCCCI Amb27222536 [0,1,0,0,0,0|2,0,0]=3 1826 B8R0.6 CCC(=O)NCCCN Amb6280448 [0,1,0,0,0,0|2,0,0]=3 1827 B8R0.6 CCC(=O)NCCCO Amb5797471 [0,1,0,0,0,0|2,0,0]=3 1828 B8R0.6 CCC(=O)NCCON Amb17138375 [0,1,0,0,0,0|3,0,0]=4 1829 B8R0.6 CCC(=O)NOCCO Amb27946298 [0,1,0,0,0,0|3,0,0]=4 1830 B8R0.6 CCC(=O)OCCCBr Amb27262082 [0,1,0,0,0,0|2,0,0]=3 1831 B8R0.6 CCC(=O)OCCCO Amb28138647 [0,1,0,0,0,0|2,0,0]=3 1832 B8R0.6 CCC(=O)OCCOC Amb27977811 [0,1,0,0,0,0|2,0,0]=3 1833 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|2,0,1]=4 1834 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|2,0,1]=4 1835 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|2,0,1]=4 1836 B8R0.6 CCC(N)CCCNC Amb27231954 [0,1,0,0,0,0|2,0,1]=4 1837 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,1,0,0,0,0|1,0,2]=4 1838 B8R0.6 CCC(O)CCCCO Amb27762946 [0,1,0,0,0,0|1,0,2]=4 1839 B8R0.6 CCC(O)CCCNC Amb27655789 [0,1,0,0,0,0|1,0,2]=4 1840 B8R0.6 CCC(O)CCCOC Amb28249167 [0,1,0,0,0,0|1,0,2]=4 1841 B8R0.6 CCC=C=CC(=O)CC Amb27838620 [0,1,0,0,0,0|0,0,3]=4 1842 B8R0.6 CCCBCC(C)CCl Amb27771247 [0,1,0,0,0,0|2,0,1]=4 1843 B8R0.6 CCCC#CC(=O)OC Amb8517413 [0,1,0,0,0,0|0,0,2]=3 1844 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,1,0,0,0,0|0,0,0]=1 1845 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,1,0,0,0,0|0,0,0]=1 1846 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,1,0,0,0,0|0,0,0]=1 1847 B8R0.6 CCCCCC(=O)NN Amb6540616 [0,1,0,0,0,0|1,0,0]=2 1848 B8R0.6 CCCCCC(=O)NO Amb2720996 [0,1,0,0,0,0|1,0,0]=2 1849 B8R0.6 CCCCCC(=O)OC Amb6608968 [0,1,0,0,0,0|0,0,0]=1 1850 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|1,0,1]=3 1851 B8R0.6 CCCCCC(C)C#N Amb18642348 [0,1,0,0,0,0|1,0,1]=3 1852 B8R0.6 CCCCCC(C)CBr Amb26013045 [0,1,0,0,0,0|1,0,1]=3 1853 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|1,0,1]=3 1854 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|1,0,1]=3 1855 B8R0.6 CCCCCC(C)CN Amb27624450 [0,1,0,0,0,0|1,0,1]=3 1856 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|0,0,2]=3 1857 B8R0.6 CCCCCC(C)NC Amb3939451 [0,1,0,0,0,0|1,0,1]=3 1858 B8R0.6 CCCCCC(C)[Zn]Br Amb22000405 [0,1,0,0,0,0|1,0,1]=3 1859 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,1,0,0,0,0|1,0,1]=3 1860 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|1,0,1]=3 1861 B8R0.6 CCCCCC(Cl)CN Amb28410342 [0,1,0,0,0,0|1,0,1]=3 1862 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|1,0,1]=3 1863 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|1,0,1]=3 1864 B8R0.6 CCCCCC(O)C#N Amb9295066 [0,1,0,0,0,0|0,0,3]=4 1865 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,1,0,0,0,0|1,0,1]=3 1866 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|0,0,2]=3 1867 B8R0.6 CCCCCC(O)CN Amb8630208 [0,1,0,0,0,0|0,0,2]=3 1868 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|0,0,2]=3 1869 B8R0.6 CCCCCC(O)CS Amb27404970 [0,1,0,0,0,0|0,0,2]=3 1870 B8R0.6 CCCCCC(S)CN Amb27469627 [0,1,0,0,0,0|0,1,1]=3 1871 B8R0.6 CCCCCN(C)CC Amb27809466 [0,1,0,0,0,0|2,0,0]=3 1872 B8R0.6 CCCCCN(C)N=O Amb10070585 [0,1,0,0,0,0|1,0,0]=2 1873 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [0,1,0,0,0,0|0,0,1]=2 1874 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,1,0,0,0,0|0,0,2]=3 1875 B8R0.6 CCCCC[C@@H](O)C#N Amb27593479 [0,1,0,0,0,0|0,0,3]=4 1876 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|0,0,2]=3 1877 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,1,0,0,0,0|0,0,2]=3 1878 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [0,1,0,0,0,0|1,0,1]=3 1879 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [0,1,0,0,0,0|1,0,1]=3 1880 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|0,0,2]=3 1881 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,1,0,0,0,0|0,0,2]=3 1882 B8R0.6 CCCCC\C(C)=C\Br Amb27831352 [0,1,0,0,0,0|1,0,0]=2 1883 B8R0.6 CCCCC\C(C)=N\N Amb28400606 [0,1,0,0,0,0|1,0,0]=2 1884 B8R0.6 CCCCC\C(C)=N\O Amb22338237 [0,1,0,0,0,0|0,0,1]=2 1885 B8R0.6 CCCCC\C(F)=C/Br Amb27983714 [0,1,0,0,0,0|1,0,1]=3 1886 B8R0.6 CCCCC\C(N)=N/N Amb2696449 [0,1,0,0,0,0|2,0,0]=3 1887 B8R0.6 CCCCNC(=N)C#N Amb27478758 [0,1,0,0,0,0|2,0,1]=4 1888 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,1,0,0,0,0|1,0,0]=2 1889 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,1,0,0,0,0|1,0,0]=2 1890 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,1,0,0,0,0|1,0,0]=2 1891 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,1,0,0,0,0|1,0,0]=2 1892 B8R0.6 CCCCNC(=O)CN Amb5783028 [0,1,0,0,0,0|1,0,0]=2 1893 B8R0.6 CCCCNC(=O)CO Amb5798171 [0,1,0,0,0,0|1,0,0]=2 1894 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,1,0,0,0,0|1,0,0]=2 1895 B8R0.6 CCCCNC(=O)NN Amb8853914 [0,1,0,0,0,0|2,0,0]=3 1896 B8R0.6 CCCCNC(=O)OC Amb3364701 [0,1,0,0,0,0|1,0,0]=2 1897 B8R0.6 CCCCNC(=S)C#N Amb27424696 [0,1,0,0,0,0|1,1,1]=4 1898 B8R0.6 CCCCNC(=S)CC Amb27975765 [0,1,0,0,0,0|1,1,0]=3 1899 B8R0.6 CCCCNC(=S)NN Amb1104554 [0,1,0,0,0,0|2,1,0]=4 1900 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,1,0,0,0,0|2,0,1]=4 1901 B8R0.6 CCCCNC(C)C#N Amb17044849 [0,1,0,0,0,0|2,0,1]=4 1902 B8R0.6 CCCCNC(C)CBr Amb27652350 [0,1,0,0,0,0|2,0,1]=4 1903 B8R0.6 CCCCNC(C)CC Amb6608873 [0,1,0,0,0,0|2,0,1]=4 1904 B8R0.6 CCCCN[C@@H](C)CN Amb27272617 [0,1,0,0,0,0|2,0,1]=4 1905 B8R0.6 CCCCN[C@H](C)CN Amb27236730 [0,1,0,0,0,0|2,0,1]=4 1906 B8R0.6 CCCCN\C(C)=N/O Amb27173635 [0,1,0,0,0,0|1,0,1]=3 1907 B8R0.6 CCCCN\C(N)=N\O Amb24735707 [0,1,0,0,0,0|2,0,1]=4 1908 B8R0.6 CCCCOC(=N)CBr Amb27758698 [0,1,0,0,0,0|2,0,0]=3 1909 B8R0.6 CCCCOC(=N)CCl Amb29847969 [0,1,0,0,0,0|2,0,0]=3 1910 B8R0.6 CCCCOC(=O)C=O Amb3941041 [0,1,0,0,0,0|1,0,1]=3 1911 B8R0.6 CCCCOC(=O)CCl Amb2724515 [0,1,0,0,0,0|1,0,0]=2 1912 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,1,0,0,0,0|1,0,0]=2 1913 B8R0.6 CCCCOC(=O)CN Amb3939626 [0,1,0,0,0,0|1,0,0]=2 1914 B8R0.6 CCCCOC(=O)CO Amb9277787 [0,1,0,0,0,0|1,0,0]=2 1915 B8R0.6 CCCCOC(=O)CS Amb4034596 [0,1,0,0,0,0|1,0,0]=2 1916 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,1,0,0,0,0|1,0,0]=2 1917 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,1,0,0,0,0|1,0,0]=2 1918 B8R0.6 CCCCOC(=O)OC Amb25921901 [0,1,0,0,0,0|1,0,0]=2 1919 B8R0.6 CCCCOC(=S)NC Amb28120184 [0,1,0,0,0,0|1,1,0]=3 1920 B8R0.6 CCCCOC(C)C#N Amb28049084 [0,1,0,0,0,0|2,0,1]=4 1921 B8R0.6 CCCCOC(C)CBr Amb27985886 [0,1,0,0,0,0|2,0,1]=4 1922 B8R0.6 CCCCOC(C)CCl Amb27777639 [0,1,0,0,0,0|2,0,1]=4 1923 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|1,0,2]=4 1924 B8R0.6 CCCCOC(O)CC Amb28429916 [0,1,0,0,0,0|1,0,2]=4 1925 B8R0.6 CCCCOS(=O)CCl Amb27863540 [0,1,0,0,0,0|2,0,0]=3 1926 B8R0.6 CCCCO[C@@H](C)CBr Amb28285274 [0,1,0,0,0,0|2,0,1]=4 1927 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,1,0,0,0,0|1,0,2]=4 1928 B8R0.6 CCCCO\C(Cl)=C/Cl Amb27792254 [0,1,0,0,0,0|2,0,1]=4 1929 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,1,0,0,0,0|1,0,0]=2 1930 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,1,0,0,0,0|1,0,0]=2 1931 B8R0.6 CCCCSC(=S)NC Amb28119899 [0,1,0,0,0,0|1,1,0]=3 1932 B8R0.6 CCCCSC(C)CC Amb4017931 [0,1,0,0,0,0|2,0,1]=4 1933 B8R0.6 CCCCS\C(N)=N\N Amb27461477 [0,1,0,0,0,0|3,0,0]=4 1934 B8R0.6 CCCC\C=C(/Br)C=O Amb28130465 [0,1,0,0,0,0|1,0,1]=3 1935 B8R0.6 CCCC\C=C(/C)CBr Amb27865492 [0,1,0,0,0,0|1,0,1]=3 1936 B8R0.6 CCCC\C=C(/Cl)C=O Amb27949654 [0,1,0,0,0,0|1,0,1]=3 1937 B8R0.6 CCCC\C=C(\Br)C=O Amb28196734 [0,1,0,0,0,0|1,0,1]=3 1938 B8R0.6 CCCC\C=C(\C)CBr Amb27444640 [0,1,0,0,0,0|1,0,1]=3 1939 B8R0.6 CCCC\C=C(\C)CCl Amb25317209 [0,1,0,0,0,0|1,0,1]=3 1940 B8R0.6 CCCC\C=C(\C)CI Amb27879768 [0,1,0,0,0,0|1,0,1]=3 1941 B8R0.6 CCCC\C=C(\C)CN Amb28288856 [0,1,0,0,0,0|1,0,1]=3 1942 B8R0.6 CCCC\C=C(\Cl)CO Amb28315452 [0,1,0,0,0,0|1,0,1]=3 1943 B8R0.6 CCCC\C=C(\F)CO Amb27835021 [0,1,0,0,0,0|1,0,1]=3 1944 B8R0.6 CCCNCC(=O)NC Amb6714452 [0,1,0,0,0,0|1,0,0]=2 1945 B8R0.6 CCCNCC(=O)NN Amb27495361 [0,1,0,0,0,0|2,0,0]=3 1946 B8R0.6 CCCNCC(=O)NO Amb27171730 [0,1,0,0,0,0|2,0,0]=3 1947 B8R0.6 CCCNCC(=O)OC Amb28934926 [0,1,0,0,0,0|1,0,0]=2 1948 B8R0.6 CCCNCC(=O)OC Amb6687123 [0,1,0,0,0,0|1,0,0]=2 1949 B8R0.6 CCCNCC(C)C#N Amb9024084 [0,1,0,0,0,0|2,0,1]=4 1950 B8R0.6 CCCNCC(C)CCl Amb27976521 [0,1,0,0,0,0|2,0,1]=4 1951 B8R0.6 CCCNCC(C)NC Amb27837459 [0,1,0,0,0,0|2,0,1]=4 1952 B8R0.6 CCCNCC(Cl)CC Amb27856521 [0,1,0,0,0,0|2,0,1]=4 1953 B8R0.6 CCCNCC(N)CC Amb25918794 [0,1,0,0,0,0|2,0,1]=4 1954 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,1,0,0,0,0|1,0,2]=4 1955 B8R0.6 CCCNCC(O)CF Amb28254417 [0,1,0,0,0,0|1,0,2]=4 1956 B8R0.6 CCCNCC(O)CO Amb8854777 [0,1,0,0,0,0|1,0,2]=4 1957 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,1,0,0,0,0|1,0,2]=4 1958 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,1,0,0,0,0|1,0,2]=4 1959 B8R0.6 CCCNC\C(C)=C\Cl Amb27842024 [0,1,0,0,0,0|2,0,0]=3 1960 B8R0.6 CCCNC\C(Cl)=C\Cl Amb27795480 [0,1,0,0,0,0|2,0,1]=4 1961 B8R0.6 CCCNC\C(N)=N\O Amb25147147 [0,1,0,0,0,0|2,0,1]=4 1962 B8R0.6 CCCNNC(=S)NC Amb25214594 [0,1,0,0,0,0|2,1,0]=4 1963 B8R0.6 CCCOCC(=O)CBr Amb28319117 [0,1,0,0,0,0|1,0,0]=2 1964 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,1,0,0,0,0|1,0,0]=2 1965 B8R0.6 CCCOCC(=O)CCl Amb27882673 [0,1,0,0,0,0|1,0,0]=2 1966 B8R0.6 CCCOCC(Br)CCl Amb28367013 [0,1,0,0,0,0|2,0,1]=4 1967 B8R0.6 CCCOCC(C)C=O Amb28241425 [0,1,0,0,0,0|1,0,1]=3 1968 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,1]=4 1969 B8R0.6 CCCOCC(C)CCl Amb26053445 [0,1,0,0,0,0|2,0,1]=4 1970 B8R0.6 CCCOCC(C)CS Amb27834985 [0,1,0,0,0,0|1,1,1]=4 1971 B8R0.6 CCCOCC(C)NN Amb27648579 [0,1,0,0,0,0|2,0,1]=4 1972 B8R0.6 CCCOCC(Cl)CBr Amb27391140 [0,1,0,0,0,0|2,0,1]=4 1973 B8R0.6 CCCOCC(Cl)CCl Amb27657524 [0,1,0,0,0,0|2,0,1]=4 1974 B8R0.6 CCCOCC(N)CC Amb17485992 [0,1,0,0,0,0|2,0,1]=4 1975 B8R0.6 CCCOCC(N)CN Amb28312993 [0,1,0,0,0,0|2,0,1]=4 1976 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,1,0,0,0,0|1,0,2]=4 1977 B8R0.6 CCCOCC(O)CO Amb10071476 [0,1,0,0,0,0|1,0,2]=4 1978 B8R0.6 CCCOC[C@@H](N)CC Amb27804406 [0,1,0,0,0,0|2,0,1]=4 1979 B8R0.6 CCCOC[C@H](N)CC Amb28139029 [0,1,0,0,0,0|2,0,1]=4 1980 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,1,0,0,0,0|1,0,2]=4 1981 B8R0.6 CCCOC\C(N)=N\O Amb8874862 [0,1,0,0,0,0|2,0,1]=4 1982 B8R0.6 CCCONC(=O)CCl Amb28399458 [0,1,0,0,0,0|2,0,0]=3 1983 B8R0.6 CCCO\C=C(/Br)C=O Amb27224779 [0,1,0,0,0,0|2,0,1]=4 1984 B8R0.6 CCCO\C=C(\C)C=O Amb27789567 [0,1,0,0,0,0|1,0,1]=3 1985 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,1,0,0,0,0|1,0,0]=2 1986 B8R0.6 CCCSCC(=O)NC Amb27162536 [0,1,0,0,0,0|1,0,0]=2 1987 B8R0.6 CCCSCC(=O)OC Amb7753194 [0,1,0,0,0,0|1,0,0]=2 1988 B8R0.6 CCCSCC(C)CBr Amb28122637 [0,1,0,0,0,0|2,0,1]=4 1989 B8R0.6 CCCSCC(C)CS Amb27981763 [0,1,0,0,0,0|1,1,1]=4 1990 B8R0.6 CCCSCC(F)CC Amb28190116 [0,1,0,0,0,0|2,0,1]=4 1991 B8R0.6 CCCSCC(N)CC Amb17485961 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.6 CCCSCC(N)CO Amb28364274 [0,1,0,0,0,0|2,0,1]=4 1993 B8R0.6 CCCSCC(O)CC Amb28049075 [0,1,0,0,0,0|1,0,2]=4 1994 B8R0.6 CCCSCC(O)CO Amb27858570 [0,1,0,0,0,0|1,0,2]=4 1995 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,1,0,0,0,0|1,0,2]=4 1996 B8R0.6 CCCSC\C(N)=N\N Amb27765151 [0,1,0,0,0,0|3,0,0]=4 1997 B8R0.6 CCCSC\C(N)=N\O Amb6680793 [0,1,0,0,0,0|2,0,1]=4 1998 B8R0.6 CCCS\C=C(\C)C=O Amb27467800 [0,1,0,0,0,0|1,0,1]=3 1999 B8R0.6 CCC\C=C/C(=O)OC Amb27423496 [0,1,0,0,0,0|0,0,2]=3 2000 B8R0.6 CCC\C=C\C(=O)CBr Amb27477837 [0,1,0,0,0,0|0,0,2]=3 2001 B8R0.6 CCC\C=C\C(=O)CC Amb26400662 [0,1,0,0,0,0|0,0,2]=3 2002 B8R0.6 CCC\C=C\C(=O)CCl Amb33220754 [0,1,0,0,0,0|0,0,2]=3 2003 B8R0.6 CCC\C=C\C(=O)CN Amb33327186 [0,1,0,0,0,0|0,0,2]=3 2004 B8R0.6 CCC\C=C\C(=O)NN Amb25852581 [0,1,0,0,0,0|1,0,2]=4 2005 B8R0.6 CCC\C=C\C(=O)OC Amb6366801 [0,1,0,0,0,0|0,0,2]=3 2006 B8R0.6 CCC\C=C\C(C)C=O Amb33424834 [0,1,0,0,0,0|0,0,3]=4 2007 B8R0.6 CCNCCC(=O)NC Amb28423128 [0,1,0,0,0,0|1,0,0]=2 2008 B8R0.6 CCNCCC(=O)NC Amb33528495 [0,1,0,0,0,0|1,0,0]=2 2009 B8R0.6 CCNCCC(=O)NN Amb8428177 [0,1,0,0,0,0|2,0,0]=3 2010 B8R0.6 CCNCCC(=O)OC Amb6739987 [0,1,0,0,0,0|1,0,0]=2 2011 B8R0.6 CCNCCC(O)CC Amb27483130 [0,1,0,0,0,0|1,0,2]=4 2012 B8R0.6 CCNCCN(C)CC Amb27837541 [0,1,0,0,0,0|3,0,0]=4 2013 B8R0.6 CCNCCN(C)OC Amb28207205 [0,1,0,0,0,0|2,0,1]=4 2014 B8R0.6 CCNCC\C(C)=C\Cl Amb27853590 [0,1,0,0,0,0|2,0,0]=3 2015 B8R0.6 CCNCC\C(N)=N/O Amb19981295 [0,1,0,0,0,0|2,0,1]=4 2016 B8R0.6 CCN\C=C\C(=O)OC Amb2386650 [0,1,0,0,0,0|1,0,2]=4 2017 B8R0.6 CCOCCC(=N)OC Amb27606548 [0,1,0,0,0,0|2,0,0]=3 2018 B8R0.6 CCOCCC(=N)OC Amb32653542 [0,1,0,0,0,0|2,0,0]=3 2019 B8R0.6 CCOCCC(=O)CC Amb27837472 [0,1,0,0,0,0|1,0,0]=2 2020 B8R0.6 CCOCCC(=O)CCl Amb27591059 [0,1,0,0,0,0|1,0,0]=2 2021 B8R0.6 CCOCCC(=O)CN Amb27253736 [0,1,0,0,0,0|1,0,0]=2 2022 B8R0.6 CCOCCC(=O)NN Amb6541358 [0,1,0,0,0,0|2,0,0]=3 2023 B8R0.6 CCOCCC(=O)OC Amb7773814 [0,1,0,0,0,0|1,0,0]=2 2024 B8R0.6 CCOCCC(Br)CCl Amb27440196 [0,1,0,0,0,0|2,0,1]=4 2025 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|2,0,1]=4 2026 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|2,0,1]=4 2027 B8R0.6 CCOCCC(C)NN Amb27882631 [0,1,0,0,0,0|2,0,1]=4 2028 B8R0.6 CCOCCC(Cl)CBr Amb27262848 [0,1,0,0,0,0|2,0,1]=4 2029 B8R0.6 CCOCCC(Cl)CCl Amb28458365 [0,1,0,0,0,0|2,0,1]=4 2030 B8R0.6 CCOCCC(Cl)CO Amb28118931 [0,1,0,0,0,0|2,0,1]=4 2031 B8R0.6 CCOCCN(C)C#N Amb27432785 [0,1,0,0,0,0|3,0,0]=4 2032 B8R0.6 CCOCCN(C)OC Amb27837601 [0,1,0,0,0,0|2,0,1]=4 2033 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [0,1,0,0,0,0|2,0,1]=4 2034 B8R0.6 CCOCC[C@H](N)CS Amb28247584 [0,1,0,0,0,0|2,0,1]=4 2035 B8R0.6 CCOCC\C(N)=N\O Amb6266452 [0,1,0,0,0,0|2,0,1]=4 2036 B8R0.6 CCOCNC(=O)CCl Amb28132401 [0,1,0,0,0,0|2,0,0]=3 2037 B8R0.6 CCOC\C=C(/Cl)CBr Amb28073624 [0,1,0,0,0,0|2,0,1]=4 2038 B8R0.6 CCOC\C=C(\C)CCl Amb27968870 [0,1,0,0,0,0|2,0,1]=4 2039 B8R0.6 CCOC\C=C(\Cl)CCl Amb27638368 [0,1,0,0,0,0|2,0,1]=4 2040 B8R0.6 CCO\C=C\C(=O)CC Amb22055193 [0,1,0,0,0,0|1,0,2]=4 2041 B8R0.6 CCO\C=C\C(=O)NC Amb27179836 [0,1,0,0,0,0|1,0,2]=4 2042 B8R0.6 CCO\C=C\C(=O)OC Amb33356217 [0,1,0,0,0,0|1,0,2]=4 2043 B8R0.6 CCO\C=N\C(=O)CCl Amb27422899 [0,1,0,0,0,0|2,0,1]=4 2044 B8R0.6 CCO\N=C\C(=O)CC Amb28055522 [0,1,0,0,0,0|2,0,1]=4 2045 B8R0.6 CCS(=O)NCCCO Amb27443514 [0,1,0,0,0,0|3,0,0]=4 2046 B8R0.6 CCSCCC(=O)NN Amb27837509 [0,1,0,0,0,0|2,0,0]=3 2047 B8R0.6 CCSCCC(=O)OC Amb4016403 [0,1,0,0,0,0|1,0,0]=2 2048 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|2,0,1]=4 2049 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|2,0,1]=4 2050 B8R0.6 CCSCCC(C)NC Amb19149279 [0,1,0,0,0,0|2,0,1]=4 2051 B8R0.6 CCSCCC(N)CN Amb27392673 [0,1,0,0,0,0|2,0,1]=4 2052 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|2,0,1]=4 2053 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|1,0,2]=4 2054 B8R0.6 CCSCCN(C)OC Amb27256037 [0,1,0,0,0,0|2,0,1]=4 2055 B8R0.6 CCSCC\C(N)=N\O Amb6680782 [0,1,0,0,0,0|2,0,1]=4 2056 B8R0.6 CCS\C=C\C(=O)CC Amb24424828 [0,1,0,0,0,0|1,0,2]=4 2057 B8R0.6 CCS\C=C\C(=O)OC Amb24387094 [0,1,0,0,0,0|1,0,2]=4 2058 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|2,0,1]=4 2059 B8R0.6 CC[C@@H](N)CCCOC Amb27180543 [0,1,0,0,0,0|2,0,1]=4 2060 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|2,0,1]=4 2061 B8R0.6 CC\C(C)=C\CCCCl Amb27626884 [0,1,0,0,0,0|2,0,1]=4 2062 B8R0.6 CC\C(C)=N/CCCN Amb28060249 [0,1,0,0,0,0|3,0,0]=4 2063 B8R0.6 CC\C(C)=N\CCCN Amb27849925 [0,1,0,0,0,0|3,0,0]=4 2064 B8R0.6 CC\C(C)=N\CCCO Amb28190308 [0,1,0,0,0,0|3,0,0]=4 2065 B8R0.6 CC\C=C\C=C(/C)C=O Amb27438517 [0,1,0,0,0,0|0,0,3]=4 2066 B8R0.6 CC\C=C\CC(=O)OC Amb8517644 [0,1,0,0,0,0|0,0,2]=3 2067 B8R0.6 CC\C=C\CC(C)C=O Amb27255568 [0,1,0,0,0,0|0,0,3]=4 2068 B8R0.6 CN(C=O)CCCCO Amb27434543 [0,1,0,0,0,0|2,0,0]=3 2069 B8R0.6 CN(CCCC=O)N=O Amb27966682 [0,1,0,0,0,0|2,0,1]=4 2070 B8R0.6 CN(CCCCO)N=O Amb25709435 [0,1,0,0,0,0|2,0,0]=3 2071 B8R0.6 CNC(=N)NCCCF Amb27242132 [0,1,0,0,0,0|3,0,0]=4 2072 B8R0.6 CNC(=N)NCCCN Amb27858102 [0,1,0,0,0,0|3,0,0]=4 2073 B8R0.6 CNC(=N)NCCOC Amb28049587 [0,1,0,0,0,0|3,0,0]=4 2074 B8R0.6 CNC(=N)SCCCO Amb27221089 [0,1,0,0,0,0|3,0,0]=4 2075 B8R0.6 CNC(=O)CCCCBr Amb17235862 [0,1,0,0,0,0|1,0,0]=2 2076 B8R0.6 CNC(=O)CCCCN Amb27220816 [0,1,0,0,0,0|1,0,0]=2 2077 B8R0.6 CNC(=O)CCCCO Amb17231874 [0,1,0,0,0,0|1,0,0]=2 2078 B8R0.6 CNC(=O)CCCON Amb27230783 [0,1,0,0,0,0|2,0,0]=3 2079 B8R0.6 CNC(=O)CCCSC Amb18411875 [0,1,0,0,0,0|1,0,0]=2 2080 B8R0.6 CNC(=O)CCN=C=S Amb27220955 [0,1,0,0,0,0|2,0,1]=4 2081 B8R0.6 CNC(=O)CCN=[N+]=[N-] Amb24418387 [0,1,0,0,0,0|3,0,0]=4 2082 B8R0.6 CNC(=O)CCNC#N Amb27837442 [0,1,0,0,0,0|2,0,1]=4 2083 B8R0.6 CNC(=O)CCSCCl Amb27430707 [0,1,0,0,0,0|2,0,0]=3 2084 B8R0.6 CNC(=O)COCCN Amb19016737 [0,1,0,0,0,0|2,0,0]=3 2085 B8R0.6 CNC(=O)COCCN Amb24271094 [0,1,0,0,0,0|2,0,0]=3 2086 B8R0.6 CNC(=O)COCCO Amb28285253 [0,1,0,0,0,0|2,0,0]=3 2087 B8R0.6 CNC(=O)CSCCN Amb6264722 [0,1,0,0,0,0|2,0,0]=3 2088 B8R0.6 CNC(=O)CSCOC Amb27757180 [0,1,0,0,0,0|2,0,0]=3 2089 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,1,0,0,0,0|2,0,0]=3 2090 B8R0.6 CNC(=O)NCCCF Amb27843538 [0,1,0,0,0,0|2,0,0]=3 2091 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,1,0,0,0,0|2,0,0]=3 2092 B8R0.6 CNC(=O)NCCCN Amb33743450 [0,1,0,0,0,0|2,0,0]=3 2093 B8R0.6 CNC(=O)NCCCO Amb27161587 [0,1,0,0,0,0|2,0,0]=3 2094 B8R0.6 CNC(=O)NCCSC Amb27452991 [0,1,0,0,0,0|2,0,0]=3 2095 B8R0.6 CNC(=O)OCCCN Amb27243133 [0,1,0,0,0,0|2,0,0]=3 2096 B8R0.6 CNC(=O)OCCCN Amb33803867 [0,1,0,0,0,0|2,0,0]=3 2097 B8R0.6 CNC(=O)OCCOC Amb24598834 [0,1,0,0,0,0|2,0,0]=3 2098 B8R0.6 CNC(=O)SCCCCl Amb27750203 [0,1,0,0,0,0|2,0,0]=3 2099 B8R0.6 CNC(=S)NCCCO Amb25777180 [0,1,0,0,0,0|2,1,0]=4 2100 B8R0.6 CNC(=S)NCCOC Amb4352304 [0,1,0,0,0,0|2,1,0]=4 2101 B8R0.6 CNC(C)CCCCBr Amb28072213 [0,1,0,0,0,0|2,0,1]=4 2102 B8R0.6 CNC(C)CCCCCl Amb28058471 [0,1,0,0,0,0|2,0,1]=4 2103 B8R0.6 CNC(C)CCCCO Amb17569927 [0,1,0,0,0,0|2,0,1]=4 2104 B8R0.6 CNC(C)CCCOC Amb17569939 [0,1,0,0,0,0|2,0,1]=4 2105 B8R0.6 CNC(C)CCCSC Amb28135937 [0,1,0,0,0,0|2,0,1]=4 2106 B8R0.6 CNCC#CC(=O)OC Amb33168795 [0,1,0,0,0,0|1,0,2]=4 2107 B8R0.6 CNCCCC(=O)NC Amb18303609 [0,1,0,0,0,0|1,0,0]=2 2108 B8R0.6 CNCCCC(=O)NC Amb22098814 [0,1,0,0,0,0|1,0,0]=2 2109 B8R0.6 CNCCCC(=O)NO Amb28041873 [0,1,0,0,0,0|2,0,0]=3 2110 B8R0.6 CNCCCC(=O)OC Amb7969745 [0,1,0,0,0,0|1,0,0]=2 2111 B8R0.6 CNCCCC(=O)OC Amb8841493 [0,1,0,0,0,0|1,0,0]=2 2112 B8R0.6 CNCCCC(C)OC Amb17569936 [0,1,0,0,0,0|1,0,2]=4 2113 B8R0.6 CNCCC\C(N)=N\O Amb27464123 [0,1,0,0,0,0|2,0,1]=4 2114 B8R0.6 CNCCSC(=N)NC Amb27424678 [0,1,0,0,0,0|3,0,0]=4 2115 B8R0.6 CNC\C=C\C(=O)OC Amb26535556 [0,1,0,0,0,0|1,0,2]=4 2116 B8R0.6 COC(=N)CCCCCl Amb32941935 [0,1,0,0,0,0|2,0,0]=3 2117 B8R0.6 COC(=N)COCCO Amb27857878 [0,1,0,0,0,0|3,0,0]=4 2118 B8R0.6 COC(=O)C#CCCN Amb32656224 [0,1,0,0,0,0|1,0,2]=4 2119 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,1,0,0,0,0|1,0,2]=4 2120 B8R0.6 COC(=O)CC#CCO Amb28321358 [0,1,0,0,0,0|1,0,2]=4 2121 B8R0.6 COC(=O)CCCC#N Amb8961157 [0,1,0,0,0,0|1,0,1]=3 2122 B8R0.6 COC(=O)CCCCBr Amb3940220 [0,1,0,0,0,0|1,0,0]=2 2123 B8R0.6 COC(=O)CCCCCl Amb3940767 [0,1,0,0,0,0|1,0,0]=2 2124 B8R0.6 COC(=O)CCCCI Amb4018545 [0,1,0,0,0,0|1,0,0]=2 2125 B8R0.6 COC(=O)CCCCN Amb13951283 [0,1,0,0,0,0|1,0,0]=2 2126 B8R0.6 COC(=O)CCCCN Amb18642844 [0,1,0,0,0,0|1,0,0]=2 2127 B8R0.6 COC(=O)CCCCO Amb22641583 [0,1,0,0,0,0|1,0,0]=2 2128 B8R0.6 COC(=O)CCCCS Amb27218229 [0,1,0,0,0,0|1,0,0]=2 2129 B8R0.6 COC(=O)CCCON Amb25266351 [0,1,0,0,0,0|2,0,0]=3 2130 B8R0.6 COC(=O)CCCON Amb32753844 [0,1,0,0,0,0|2,0,0]=3 2131 B8R0.6 COC(=O)CCN=C=O Amb3905408 [0,1,0,0,0,0|2,0,1]=4 2132 B8R0.6 COC(=O)CCN=C=S Amb520874 [0,1,0,0,0,0|2,0,1]=4 2133 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [0,1,0,0,0,0|3,0,0]=4 2134 B8R0.6 COC(=O)CCSC#N Amb27624712 [0,1,0,0,0,0|2,0,1]=4 2135 B8R0.6 COC(=O)CC\C=C\Br Amb26433263 [0,1,0,0,0,0|1,0,2]=4 2136 B8R0.6 COC(=O)CNCC#N Amb6707511 [0,1,0,0,0,0|2,0,1]=4 2137 B8R0.6 COC(=O)CNCCF Amb27175508 [0,1,0,0,0,0|2,0,0]=3 2138 B8R0.6 COC(=O)CNCCN Amb27755951 [0,1,0,0,0,0|2,0,0]=3 2139 B8R0.6 COC(=O)CNCCS Amb28285258 [0,1,0,0,0,0|2,0,0]=3 2140 B8R0.6 COC(=O)COCCBr Amb27657286 [0,1,0,0,0,0|2,0,0]=3 2141 B8R0.6 COC(=O)COCCCl Amb8389878 [0,1,0,0,0,0|2,0,0]=3 2142 B8R0.6 COC(=O)COCCN Amb24401799 [0,1,0,0,0,0|2,0,0]=3 2143 B8R0.6 COC(=O)COCCN Amb33495145 [0,1,0,0,0,0|2,0,0]=3 2144 B8R0.6 COC(=O)COCCO Amb24113538 [0,1,0,0,0,0|2,0,0]=3 2145 B8R0.6 COC(=O)CSCCN Amb19268671 [0,1,0,0,0,0|2,0,0]=3 2146 B8R0.6 COC(=O)CSCCN Amb6272538 [0,1,0,0,0,0|2,0,0]=3 2147 B8R0.6 COC(=O)CSCCO Amb9245011 [0,1,0,0,0,0|2,0,0]=3 2148 B8R0.6 COC(=O)C\C=C\CBr Amb27444630 [0,1,0,0,0,0|1,0,2]=4 2149 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [0,1,0,0,0,0|1,0,2]=4 2150 B8R0.6 COC(=O)NCCC#N Amb28049746 [0,1,0,0,0,0|2,0,1]=4 2151 B8R0.6 COC(=O)NCCCF Amb27968335 [0,1,0,0,0,0|2,0,0]=3 2152 B8R0.6 COC(=O)OCCCF Amb24088642 [0,1,0,0,0,0|2,0,0]=3 2153 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,1,0,0,0,0|1,0,2]=4 2154 B8R0.6 COC(=O)\C=C\CCN Amb27617644 [0,1,0,0,0,0|1,0,2]=4 2155 B8R0.6 COC(=O)\C=C\CCO Amb26347391 [0,1,0,0,0,0|1,0,2]=4 2156 B8R0.6 COC(=S)SCCCF Amb27837959 [0,1,0,0,0,0|2,1,0]=4 2157 B8R0.6 COC(C)CCCCCl Amb27881913 [0,1,0,0,0,0|1,0,2]=4 2158 B8R0.6 COCC#CC(=O)OC Amb27804438 [0,1,0,0,0,0|1,0,2]=4 2159 B8R0.6 COCCCC(=O)CCl Amb28255500 [0,1,0,0,0,0|1,0,0]=2 2160 B8R0.6 COCCCC(=O)CN Amb27632511 [0,1,0,0,0,0|1,0,0]=2 2161 B8R0.6 COCCCC(=O)NN Amb8455564 [0,1,0,0,0,0|2,0,0]=3 2162 B8R0.6 COCCCC(=O)OC Amb8952328 [0,1,0,0,0,0|1,0,0]=2 2163 B8R0.6 COCCCC(C)C=O Amb28118341 [0,1,0,0,0,0|1,0,1]=3 2164 B8R0.6 COCCCC(C)CBr Amb24692425 [0,1,0,0,0,0|2,0,1]=4 2165 B8R0.6 COCCCC(C)CCl Amb24340257 [0,1,0,0,0,0|2,0,1]=4 2166 B8R0.6 COCCCC(C)CN Amb17569944 [0,1,0,0,0,0|2,0,1]=4 2167 B8R0.6 COCCCC(Cl)C=O Amb28146758 [0,1,0,0,0,0|2,0,1]=4 2168 B8R0.6 COCCCC(N)CO Amb26550641 [0,1,0,0,0,0|2,0,1]=4 2169 B8R0.6 COCCCC(O)CN Amb26323215 [0,1,0,0,0,0|1,0,2]=4 2170 B8R0.6 COCCCC(O)CO Amb27588922 [0,1,0,0,0,0|1,0,2]=4 2171 B8R0.6 COCCCN(C)C#N Amb28366016 [0,1,0,0,0,0|3,0,0]=4 2172 B8R0.6 COCCCN(C)OC Amb27837704 [0,1,0,0,0,0|2,0,1]=4 2173 B8R0.6 COCCC\C(N)=N\O Amb9728042 [0,1,0,0,0,0|2,0,1]=4 2174 B8R0.6 COCCNC(=O)CBr Amb2090677 [0,1,0,0,0,0|2,0,0]=3 2175 B8R0.6 COCCNC(=O)CCl Amb1151070 [0,1,0,0,0,0|2,0,0]=3 2176 B8R0.6 COCCNC(=O)CI Amb28388548 [0,1,0,0,0,0|2,0,0]=3 2177 B8R0.6 COCCNC(=O)CN Amb1155607 [0,1,0,0,0,0|2,0,0]=3 2178 B8R0.6 COCCNC(=O)CN Amb19515050 [0,1,0,0,0,0|2,0,0]=3 2179 B8R0.6 COCCNC(=O)CO Amb9421655 [0,1,0,0,0,0|2,0,0]=3 2180 B8R0.6 COCCNC(=O)CS Amb27844158 [0,1,0,0,0,0|2,0,0]=3 2181 B8R0.6 COCCNC(=O)NN Amb9214804 [0,1,0,0,0,0|3,0,0]=4 2182 B8R0.6 COCCNC(=O)OC Amb3361553 [0,1,0,0,0,0|2,0,0]=3 2183 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,1,0,0,0,0|2,0,0]=3 2184 B8R0.6 COCCOC(=O)CN Amb28252338 [0,1,0,0,0,0|2,0,0]=3 2185 B8R0.6 COCCOC(=O)CS Amb26859402 [0,1,0,0,0,0|2,0,0]=3 2186 B8R0.6 COCCOC(=O)OC Amb26026830 [0,1,0,0,0,0|2,0,0]=3 2187 B8R0.6 COCOCC(C)C=O Amb27185793 [0,1,0,0,0,0|2,0,1]=4 2188 B8R0.6 COCSCC(=O)NN Amb27483053 [0,1,0,0,0,0|3,0,0]=4 2189 B8R0.6 COCSCC(=O)OC Amb27972043 [0,1,0,0,0,0|2,0,0]=3 2190 B8R0.6 COCSC\C(C)=C\Cl Amb28189230 [0,1,0,0,0,0|3,0,0]=4 2191 B8R0.6 COC\C=C\C(=O)OC Amb25887192 [0,1,0,0,0,0|1,0,2]=4 2192 B8R0.6 CON(C)CCCCF Amb27837672 [0,1,0,0,0,0|2,0,1]=4 2193 B8R0.6 CON(C)CCCCN Amb28206802 [0,1,0,0,0,0|2,0,1]=4 2194 B8R0.6 CON(C)CCCSC Amb27660591 [0,1,0,0,0,0|2,0,1]=4 2195 B8R0.6 CONCCC(=O)OC Amb26511384 [0,1,0,0,0,0|2,0,0]=3 2196 B8R0.6 CO[PH](=O)OCCCCl Amb27407755 [0,1,0,0,0,0|3,0,0]=4 2197 B8R0.6 CSC(=S)OCCCO Amb27593920 [0,1,0,0,0,0|2,1,0]=4 2198 B8R0.6 CSCCCC(C)C=O Amb27973193 [0,1,0,0,0,0|1,0,1]=3 2199 B8R0.6 CSCCCC(C)CBr Amb25936940 [0,1,0,0,0,0|2,0,1]=4 2200 B8R0.6 CSCCCC(C)CCl Amb25333579 [0,1,0,0,0,0|2,0,1]=4 2201 B8R0.6 CSCCCC(C)CN Amb27863048 [0,1,0,0,0,0|2,0,1]=4 2202 B8R0.6 CSCCCC(N)CO Amb25888586 [0,1,0,0,0,0|2,0,1]=4 2203 B8R0.6 CSCCCC(O)CN Amb25809175 [0,1,0,0,0,0|1,0,2]=4 2204 B8R0.6 CSCCC\C(N)=N\O Amb25324485 [0,1,0,0,0,0|2,0,1]=4 2205 B8R0.6 CSCCNC(=O)CBr Amb17324267 [0,1,0,0,0,0|2,0,0]=3 2206 B8R0.6 CSCCNC(=O)CCl Amb9387316 [0,1,0,0,0,0|2,0,0]=3 2207 B8R0.6 CSCCNC(=O)CS Amb27851001 [0,1,0,0,0,0|2,0,0]=3 2208 B8R0.6 CSCCNC(=O)NN Amb27869243 [0,1,0,0,0,0|3,0,0]=4 2209 B8R0.6 CSCCOC(=O)C=O Amb27645544 [0,1,0,0,0,0|2,0,1]=4 2210 B8R0.6 CSCCOC(=O)CO Amb28193244 [0,1,0,0,0,0|2,0,0]=3 2211 B8R0.6 C[C@H](C=O)CCCC=O Amb28388637 [0,1,0,0,0,0|1,0,2]=4 2212 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [0,1,0,0,0,0|1,0,2]=4 2213 B8R0.6 C\C(=C/CCCBr)CO Amb28348616 [0,1,0,0,0,0|1,0,2]=4 2214 B8R0.6 C\C(=C/CCCN)CO Amb28077171 [0,1,0,0,0,0|1,0,2]=4 2215 B8R0.6 C\C(=C/Cl)CNCCBr Amb27806155 [0,1,0,0,0,0|3,0,0]=4 2216 B8R0.6 C\C(=C/Cl)CNCCF Amb27768688 [0,1,0,0,0,0|3,0,0]=4 2217 B8R0.6 C\C(=C/Cl)COCCN Amb28049233 [0,1,0,0,0,0|3,0,0]=4 2218 B8R0.6 C\C(=C/Cl)CSCCCl Amb28207767 [0,1,0,0,0,0|3,0,0]=4 2219 B8R0.6 C\C(=C/Cl)CSCCO Amb28049232 [0,1,0,0,0,0|3,0,0]=4 2220 B8R0.6 C\C(C=O)=C/CCC#N Amb27234264 [0,1,0,0,0,0|1,0,2]=4 2221 B8R0.6 C\C=C(/C)CCCCO Amb28385373 [0,1,0,0,0,0|2,0,0]=3 2222 B8R0.6 C\C=C(\C)CCCCBr Amb26877158 [0,1,0,0,0,0|2,0,0]=3 2223 B8R0.6 C\C=C/CCC(C)C=O Amb27798224 [0,1,0,0,0,0|0,0,3]=4 2224 B8R0.6 C\C=C\CCC(=O)NC Amb25339401 [0,1,0,0,0,0|0,0,2]=3 2225 B8R0.6 C\C=C\CCC(=S)NC Amb24744454 [0,1,0,0,0,0|0,1,2]=4 2226 B8R0.6 C\C=C\CNC(=O)CS Amb27212291 [0,1,0,0,0,0|1,0,2]=4 2227 B8R0.6 C\C=C\COC(=O)CC Amb22347674 [0,1,0,0,0,0|1,0,2]=4 2228 B8R0.6 C\C=C\COC(=O)CCl Amb27590279 [0,1,0,0,0,0|1,0,2]=4 2229 B8R0.6 N#CCCCC(=O)C#N Amb27835198 [0,1,0,0,0,0|1,0,2]=4 2230 B8R0.6 N#CCCCC(=O)CBr Amb27791840 [0,1,0,0,0,0|1,0,1]=3 2231 B8R0.6 N#CCCNC(=O)CCl Amb435794 [0,1,0,0,0,0|2,0,1]=4 2232 B8R0.6 N#CCCNC(=O)CI Amb28399461 [0,1,0,0,0,0|2,0,1]=4 2233 B8R0.6 NCC(=O)NCCCCl Amb33483904 [0,1,0,0,0,0|2,0,0]=3 2234 B8R0.6 NCC(=O)NCCCCl Amb33483921 [0,1,0,0,0,0|2,0,0]=3 2235 B8R0.6 NCC(=O)OCCCO Amb27430485 [0,1,0,0,0,0|2,0,0]=3 2236 B8R0.6 NCC(O)CCCCBr Amb27956026 [0,1,0,0,0,0|1,0,2]=4 2237 B8R0.6 NCCCCC(=O)NN Amb18061874 [0,1,0,0,0,0|2,0,0]=3 2238 B8R0.6 NCCCCC(N)CN Amb27602480 [0,1,0,0,0,0|2,0,1]=4 2239 B8R0.6 NCCCCC(N)CO Amb27403112 [0,1,0,0,0,0|2,0,1]=4 2240 B8R0.6 NCCCCC(N)CS Amb27409203 [0,1,0,0,0,0|2,0,1]=4 2241 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [0,1,0,0,0,0|2,0,1]=4 2242 B8R0.6 NCCCC[C@H](N)CN Amb27173098 [0,1,0,0,0,0|2,0,1]=4 2243 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,1,0,0,0,0|2,0,1]=4 2244 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,1,0,0,0,0|2,0,1]=4 2245 B8R0.6 NCCCC\C(N)=N\O Amb26494974 [0,1,0,0,0,0|2,0,1]=4 2246 B8R0.6 NCCCNC(=O)CBr Amb27837527 [0,1,0,0,0,0|2,0,0]=3 2247 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,1,0,0,0,0|2,0,0]=3 2248 B8R0.6 NCCCNC(=O)CO Amb28346767 [0,1,0,0,0,0|2,0,0]=3 2249 B8R0.6 NCCCNC(=O)CS Amb27391980 [0,1,0,0,0,0|2,0,0]=3 2250 B8R0.6 NCCSCC(=O)NO Amb28455962 [0,1,0,0,0,0|3,0,0]=4 2251 B8R0.6 NC[C@H](O)CCCCBr Amb27165807 [0,1,0,0,0,0|1,0,2]=4 2252 B8R0.6 NNC(=O)CCCCS Amb27766833 [0,1,0,0,0,0|2,0,0]=3 2253 B8R0.6 NNC(=O)CSCCO Amb27432331 [0,1,0,0,0,0|3,0,0]=4 2254 B8R0.6 NNC(=O)NCCCF Amb27812049 [0,1,0,0,0,0|3,0,0]=4 2255 B8R0.6 NNC(=O)SCCCS Amb27768062 [0,1,0,0,0,0|3,0,0]=4 2256 B8R0.6 N\C(CCCCBr)=N\O Amb2695919 [0,1,0,0,0,0|2,0,1]=4 2257 B8R0.6 N\C(CCCCCl)=N\O Amb2696032 [0,1,0,0,0,0|2,0,1]=4 2258 B8R0.6 N\C(CCCCF)=N/O Amb27793943 [0,1,0,0,0,0|2,0,1]=4 2259 B8R0.6 N\N=C(/N)CCCCCl Amb2696496 [0,1,0,0,0,0|3,0,0]=4 2260 B8R0.6 O=C(CBr)NCCCF Amb28289230 [0,1,0,0,0,0|2,0,0]=3 2261 B8R0.6 O=C(CBr)NCCCO Amb17329705 [0,1,0,0,0,0|2,0,0]=3 2262 B8R0.6 O=C(CCCCBr)NO Amb27494446 [0,1,0,0,0,0|2,0,0]=3 2263 B8R0.6 O=C(CCCCCl)NO Amb28326259 [0,1,0,0,0,0|2,0,0]=3 2264 B8R0.6 O=C(CCl)NCCCCl Amb2125567 [0,1,0,0,0,0|2,0,0]=3 2265 B8R0.6 O=C(CCl)NCCCF Amb27198384 [0,1,0,0,0,0|2,0,0]=3 2266 B8R0.6 O=C(CCl)NCCCO Amb4477240 [0,1,0,0,0,0|2,0,0]=3 2267 B8R0.6 O=C(CCl)OCCCO Amb27198162 [0,1,0,0,0,0|2,0,0]=3 2268 B8R0.6 O=C(CO)NCCCO Amb5798092 [0,1,0,0,0,0|2,0,0]=3 2269 B8R0.6 O=C(CO)OCCCCl Amb27457140 [0,1,0,0,0,0|2,0,0]=3 2270 B8R0.6 O=C(CO)OCCCF Amb27765133 [0,1,0,0,0,0|2,0,0]=3 2271 B8R0.6 O=C(CS)NCCCF Amb27628663 [0,1,0,0,0,0|2,0,0]=3 2272 B8R0.6 O=C\C(F)=C\CCCCl Amb28429849 [0,1,0,0,0,0|2,0,1]=4 2273 B8R0.6 OC(CCl)CCCCCl Amb27490964 [0,1,0,0,0,0|1,0,2]=4 2274 B8R0.6 OC(CS)CCCCS Amb27487018 [0,1,0,0,0,0|1,0,2]=4 2275 B8R0.6 OCC(O)CCCCBr Amb27444663 [0,1,0,0,0,0|1,0,2]=4 2276 B8R0.6 OCCCCC(O)CBr Amb27219046 [0,1,0,0,0,0|1,0,2]=4 2277 B8R0.6 OCCCCC(O)CO Amb8513368 [0,1,0,0,0,0|1,0,2]=4 2278 B8R0.6 OC\C(F)=C\CCCCl Amb27623942 [0,1,0,0,0,0|2,0,1]=4 2279 B8R0.6 [C-]#[N+]CCCC(=O)OC Amb2688933 [0,1,0,0,0,0|1,0,1]=3 2280 B8R0.6 [C-]#[N+]CCNC(=O)CC Amb27879557 [0,1,0,0,0,0|2,0,1]=4 2281 B8R0.7 C#CCCCC=C(C)C Amb30023881 [0,1,0,0,0,0|1,0,2]=4 2282 B8R0.7 C#CCCCCC(=O)Cl Amb28312904 [0,1,0,0,0,0|1,0,1]=3 2283 B8R0.7 C#CCCCCC(=O)O Amb2721485 [0,1,0,0,0,0|1,0,1]=3 2284 B8R0.7 C#CCCCCC(C)C Amb24628581 [0,1,0,0,0,0|1,0,2]=4 2285 B8R0.7 C#CCCCCN(C)C Amb18116187 [0,1,0,0,0,0|2,0,1]=4 2286 B8R0.7 C#CCCCC[C@@H](C)O Amb27207329 [0,1,0,0,0,0|0,0,3]=4 2287 B8R0.7 C#CCCCC[C@H](C)O Amb28315512 [0,1,0,0,0,0|0,0,3]=4 2288 B8R0.7 C#CCCCNS(C)=O Amb27250486 [0,1,0,0,0,0|1,0,2]=4 2289 B8R0.7 C#CCCNCC(=C)C Amb27272690 [0,1,0,0,0,0|1,0,2]=4 2290 B8R0.7 C#CCCOCC(=O)O Amb28118359 [0,1,0,0,0,0|1,0,2]=4 2291 B8R0.7 C#CCCONC(C)=O Amb27457577 [0,1,0,0,0,0|1,0,2]=4 2292 B8R0.7 C#CCCSCC(=C)C Amb27778345 [0,1,0,0,0,0|1,0,2]=4 2293 B8R0.7 C#CCCSCC(C)=O Amb27218867 [0,1,0,0,0,0|0,0,2]=3 2294 B8R0.7 C#CCOCCC(=O)O Amb9208654 [0,1,0,0,0,0|1,0,2]=4 2295 B8R0.7 C#CCOCCC(N)=O Amb27837665 [0,1,0,0,0,0|1,0,2]=4 2296 B8R0.7 C#CCSCCC(C)=O Amb27946691 [0,1,0,0,0,0|0,0,2]=3 2297 B8R0.7 C#CCSCCC(N)=O Amb27856148 [0,1,0,0,0,0|1,0,2]=4 2298 B8R0.7 C#C\C=C\CCC(C)=O Amb24633380 [0,1,0,0,0,0|0,0,3]=4 2299 B8R0.7 C=C(Br)CCCCC=O Amb28200066 [0,1,0,0,0,0|1,0,2]=4 2300 B8R0.7 C=C(Br)CCNCCO Amb27616621 [0,1,0,0,0,0|2,0,1]=4 2301 B8R0.7 C=C(Br)CNCCCF Amb27169577 [0,1,0,0,0,0|2,0,1]=4 2302 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,1,0,0,0,0|2,0,1]=4 2303 B8R0.7 C=C(Br)CNOCCC Amb27824492 [0,1,0,0,0,0|2,0,1]=4 2304 B8R0.7 C=C(Br)COCCCC Amb27956559 [0,1,0,0,0,0|1,0,1]=3 2305 B8R0.7 C=C(Br)COCCNC Amb18324681 [0,1,0,0,0,0|2,0,1]=4 2306 B8R0.7 C=C(Br)CSCCCF Amb27827023 [0,1,0,0,0,0|2,0,1]=4 2307 B8R0.7 C=C(C)C#CCCCC Amb27602312 [0,1,0,0,0,0|1,0,1]=3 2308 B8R0.7 C=C(C)C#CCCCO Amb27874899 [0,1,0,0,0,0|1,0,2]=4 2309 B8R0.7 C=C(C)CCCCC#N Amb6298906 [0,1,0,0,0,0|1,0,1]=3 2310 B8R0.7 C=C(C)CCCCC=O Amb27750320 [0,1,0,0,0,0|1,0,1]=3 2311 B8R0.7 C=C(C)CCCCCBr Amb28436917 [0,1,0,0,0,0|1,0,0]=2 2312 B8R0.7 C=C(C)CCCCCC Amb6298939 [0,1,0,0,0,0|1,0,0]=2 2313 B8R0.7 C=C(C)CCCCCO Amb27641867 [0,1,0,0,0,0|1,0,0]=2 2314 B8R0.7 C=C(C)CCNCCC Amb27813957 [0,1,0,0,0,0|1,0,0]=2 2315 B8R0.7 C=C(C)CCOCCBr Amb27242287 [0,1,0,0,0,0|2,0,0]=3 2316 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,1,0,0,0,0|2,0,0]=3 2317 B8R0.7 C=C(C)CNCCCC Amb17308646 [0,1,0,0,0,0|1,0,0]=2 2318 B8R0.7 C=C(C)CNCCCF Amb27494348 [0,1,0,0,0,0|2,0,0]=3 2319 B8R0.7 C=C(C)CNCCCN Amb28044366 [0,1,0,0,0,0|2,0,0]=3 2320 B8R0.7 C=C(C)CNCCCO Amb28285230 [0,1,0,0,0,0|2,0,0]=3 2321 B8R0.7 C=C(C)CNCCNC Amb28457188 [0,1,0,0,0,0|2,0,0]=3 2322 B8R0.7 C=C(C)CNC\C=C\C Amb25338570 [0,1,0,0,0,0|1,0,2]=4 2323 B8R0.7 C=C(C)COCCCC Amb22641495 [0,1,0,0,0,0|1,0,0]=2 2324 B8R0.7 C=C(C)COCCCN Amb28123400 [0,1,0,0,0,0|2,0,0]=3 2325 B8R0.7 C=C(C)COCCNC Amb27217708 [0,1,0,0,0,0|2,0,0]=3 2326 B8R0.7 C=C(C)CONCCC Amb28074460 [0,1,0,0,0,0|2,0,0]=3 2327 B8R0.7 C=C(C)CONCCO Amb28197415 [0,1,0,0,0,0|3,0,0]=4 2328 B8R0.7 C=C(C)CSCCCC Amb9787751 [0,1,0,0,0,0|1,0,0]=2 2329 B8R0.7 C=C(C)CSCCNC Amb28250295 [0,1,0,0,0,0|2,0,0]=3 2330 B8R0.7 C=C(C)CSSCCO Amb28049272 [0,1,0,0,0,0|3,0,0]=4 2331 B8R0.7 C=C(C)C\C=C\CCCl Amb27838469 [0,1,0,0,0,0|1,0,2]=4 2332 B8R0.7 C=C(C)C\C=C\CCN Amb27985774 [0,1,0,0,0,0|1,0,2]=4 2333 B8R0.7 C=C(C)\C=C\CCCBr Amb25264506 [0,1,0,0,0,0|1,0,2]=4 2334 B8R0.7 C=C(C)\C=C\CCCCl Amb27494353 [0,1,0,0,0,0|1,0,2]=4 2335 B8R0.7 C=C(C)\C=C\CCNC Amb25883809 [0,1,0,0,0,0|1,0,2]=4 2336 B8R0.7 C=C(Cl)CCCCC#N Amb6298896 [0,1,0,0,0,0|1,0,2]=4 2337 B8R0.7 C=C(Cl)CCCCCCl Amb6298881 [0,1,0,0,0,0|1,0,1]=3 2338 B8R0.7 C=C(Cl)CNCCCF Amb27835297 [0,1,0,0,0,0|2,0,1]=4 2339 B8R0.7 C=C(Cl)CNCCSC Amb27783779 [0,1,0,0,0,0|2,0,1]=4 2340 B8R0.7 C=C(Cl)COCCCN Amb28197915 [0,1,0,0,0,0|2,0,1]=4 2341 B8R0.7 C=C(Cl)CSCCCF Amb27783661 [0,1,0,0,0,0|2,0,1]=4 2342 B8R0.7 C=C(Cl)CSCCCS Amb27401749 [0,1,0,0,0,0|2,0,1]=4 2343 B8R0.7 C=C(Cl)CSCCNC Amb27421610 [0,1,0,0,0,0|2,0,1]=4 2344 B8R0.7 C=C(Cl)CSCCOC Amb28281528 [0,1,0,0,0,0|2,0,1]=4 2345 B8R0.7 C=C(F)CNCCOC Amb27632960 [0,1,0,0,0,0|2,0,1]=4 2346 B8R0.7 C=CCCCCC(=O)O Amb6299578 [0,1,0,0,0,0|1,0,1]=3 2347 B8R0.7 C=CCCCCC(C)=O Amb24546961 [0,1,0,0,0,0|0,0,1]=2 2348 B8R0.7 C=CCCCCC(C)C Amb27180770 [0,1,0,0,0,0|1,0,2]=4 2349 B8R0.7 C=CCCCCC(C)N Amb22059559 [0,1,0,0,0,0|1,0,2]=4 2350 B8R0.7 C=CCCCCC(N)=O Amb27236725 [0,1,0,0,0,0|1,0,1]=3 2351 B8R0.7 C=CCCCCC(N)=S Amb27950014 [0,1,0,0,0,0|1,1,1]=4 2352 B8R0.7 C=CCCCCN(C)O Amb27626977 [0,1,0,0,0,0|1,0,2]=4 2353 B8R0.7 C=CCCCC[N+](=O)[O-] Amb9825999 [0,1,0,0,0,0|2,0,1]=4 2354 B8R0.7 C=CCCCOC(C)=O Amb6366589 [0,1,0,0,0,0|0,0,2]=3 2355 B8R0.7 C=CCCNCC(=C)C Amb27602001 [0,1,0,0,0,0|1,0,2]=4 2356 B8R0.7 C=CCCNCC(N)=O Amb33545653 [0,1,0,0,0,0|1,0,2]=4 2357 B8R0.7 C=CCCOCC(=O)O Amb7793843 [0,1,0,0,0,0|1,0,2]=4 2358 B8R0.7 C=CCCOCC(C)=O Amb27465238 [0,1,0,0,0,0|0,0,2]=3 2359 B8R0.7 C=CCCSCC(=O)O Amb27810806 [0,1,0,0,0,0|1,0,2]=4 2360 B8R0.7 C=CCNCCC(=O)O Amb33527032 [0,1,0,0,0,0|1,0,2]=4 2361 B8R0.7 C=CCNCCC(=O)O Amb7755724 [0,1,0,0,0,0|1,0,2]=4 2362 B8R0.7 C=CCNCCC(N)=O Amb8841114 [0,1,0,0,0,0|1,0,2]=4 2363 B8R0.7 C=CCOCCC(N)=O Amb27844989 [0,1,0,0,0,0|1,0,2]=4 2364 B8R0.7 C=CCSCCC(=C)C Amb27208748 [0,1,0,0,0,0|1,0,2]=4 2365 B8R0.7 C=COCCSC(C)=O Amb35788457 [0,1,0,0,0,0|1,0,2]=4 2366 B8R0.7 C=NCCCNC(C)=O Amb27950176 [0,1,0,0,0,0|1,0,1]=3 2367 B8R0.7 CC#CCCC=C(C)C Amb30023882 [0,1,0,0,0,0|1,0,2]=4 2368 B8R0.7 CC#CCCCC(=O)O Amb28046337 [0,1,0,0,0,0|1,0,1]=3 2369 B8R0.7 CC#CCCCC(N)=O Amb27853693 [0,1,0,0,0,0|1,0,1]=3 2370 B8R0.7 CC#CCCC[C@H](C)N Amb27596063 [0,1,0,0,0,0|1,0,2]=4 2371 B8R0.7 CC#CCNCC(=O)O Amb28410306 [0,1,0,0,0,0|1,0,2]=4 2372 B8R0.7 CC#CCOCC(C)=O Amb25112537 [0,1,0,0,0,0|0,0,2]=3 2373 B8R0.7 CC#CCONC(C)=O Amb27594298 [0,1,0,0,0,0|1,0,2]=4 2374 B8R0.7 CC#CCSCC(C)=O Amb27411694 [0,1,0,0,0,0|0,0,2]=3 2375 B8R0.7 CC(=O)CCC#CCCl Amb28203937 [0,1,0,0,0,0|0,0,2]=3 2376 B8R0.7 CC(=O)CCC#CCO Amb27867270 [0,1,0,0,0,0|0,0,2]=3 2377 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,1,0,0,0,0|0,0,1]=2 2378 B8R0.7 CC(=O)CCCCCBr Amb27401578 [0,1,0,0,0,0|0,0,0]=1 2379 B8R0.7 CC(=O)CCCCCCl Amb26591097 [0,1,0,0,0,0|0,0,0]=1 2380 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,1,0,0,0,0|0,0,0]=1 2381 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,1,0,0,0,0|0,0,0]=1 2382 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,1,0,0,0,0|0,0,0]=1 2383 B8R0.7 CC(=O)CCCN=[N+]=[N-] Amb28457742 [0,1,0,0,0,0|2,0,0]=3 2384 B8R0.7 CC(=O)CCCOC=O Amb1033032 [0,1,0,0,0,0|1,0,1]=3 2385 B8R0.7 CC(=O)CCCSC#N Amb26984900 [0,1,0,0,0,0|1,0,1]=3 2386 B8R0.7 CC(=O)CCC\C=C\Cl Amb26336040 [0,1,0,0,0,0|0,0,2]=3 2387 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,1,0,0,0,0|1,0,0]=2 2388 B8R0.7 CC(=O)CCOCCBr Amb32651831 [0,1,0,0,0,0|1,0,0]=2 2389 B8R0.7 CC(=O)CCOCCCl Amb27982282 [0,1,0,0,0,0|1,0,0]=2 2390 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,1,0,0,0,0|1,0,0]=2 2391 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,1,0,0,0,0|1,0,1]=3 2392 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,1,0,0,0,0|0,0,2]=3 2393 B8R0.7 CC(=O)CC\C=C\C#N Amb18642112 [0,1,0,0,0,0|0,0,3]=4 2394 B8R0.7 CC(=O)CC\C=C\C=O Amb26875051 [0,1,0,0,0,0|0,0,3]=4 2395 B8R0.7 CC(=O)COCCCN Amb18630475 [0,1,0,0,0,0|1,0,0]=2 2396 B8R0.7 CC(=O)CSCCCF Amb28065634 [0,1,0,0,0,0|1,0,0]=2 2397 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,1,0,0,0,0|0,0,2]=3 2398 B8R0.7 CC(=O)NCC#CCCl Amb27393236 [0,1,0,0,0,0|1,0,2]=4 2399 B8R0.7 CC(=O)NCCCC#N Amb28049789 [0,1,0,0,0,0|1,0,1]=3 2400 B8R0.7 CC(=O)NCCCCCl Amb25883586 [0,1,0,0,0,0|1,0,0]=2 2401 B8R0.7 CC(=O)NCCCCF Amb27180576 [0,1,0,0,0,0|1,0,0]=2 2402 B8R0.7 CC(=O)NCCCCI Amb27768800 [0,1,0,0,0,0|1,0,0]=2 2403 B8R0.7 CC(=O)NCCCCN Amb17053700 [0,1,0,0,0,0|1,0,0]=2 2404 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,1,0,0,0,0|1,0,0]=2 2405 B8R0.7 CC(=O)NCCCON Amb17138378 [0,1,0,0,0,0|2,0,0]=3 2406 B8R0.7 CC(=O)NCCCON Amb6308549 [0,1,0,0,0,0|2,0,0]=3 2407 B8R0.7 CC(=O)NCCSN=O Amb27423715 [0,1,0,0,0,0|3,0,0]=4 2408 B8R0.7 CC(=O)NNCCC#N Amb28141884 [0,1,0,0,0,0|2,0,1]=4 2409 B8R0.7 CC(=O)NOCCCF Amb28436015 [0,1,0,0,0,0|2,0,0]=3 2410 B8R0.7 CC(=O)NOCCCO Amb28205723 [0,1,0,0,0,0|2,0,0]=3 2411 B8R0.7 CC(=O)OCC#CCBr Amb28342239 [0,1,0,0,0,0|1,0,2]=4 2412 B8R0.7 CC(=O)OCC#CCCl Amb25778311 [0,1,0,0,0,0|1,0,2]=4 2413 B8R0.7 CC(=O)OCC#CCN Amb27424695 [0,1,0,0,0,0|1,0,2]=4 2414 B8R0.7 CC(=O)OCCCCBr Amb2725321 [0,1,0,0,0,0|1,0,0]=2 2415 B8R0.7 CC(=O)OCCCCCl Amb3940275 [0,1,0,0,0,0|1,0,0]=2 2416 B8R0.7 CC(=O)OCCCCI Amb2725257 [0,1,0,0,0,0|1,0,0]=2 2417 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,1,0,0,0,0|1,0,0]=2 2418 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|1,0,0]=2 2419 B8R0.7 CC(=O)OCCN=C=O Amb25779227 [0,1,0,0,0,0|2,0,1]=4 2420 B8R0.7 CC(=O)OCCN=[N+]=[N-] Amb28325742 [0,1,0,0,0,0|3,0,0]=4 2421 B8R0.7 CC(=O)OCCNC=O Amb27212825 [0,1,0,0,0,0|2,0,1]=4 2422 B8R0.7 CC(=O)OCCOCBr Amb8395197 [0,1,0,0,0,0|2,0,0]=3 2423 B8R0.7 CC(=O)OCCSCCl Amb28122692 [0,1,0,0,0,0|2,0,0]=3 2424 B8R0.7 CC(=O)OCOCCBr Amb28458426 [0,1,0,0,0,0|2,0,0]=3 2425 B8R0.7 CC(=O)O\C=C/CCCl Amb27806183 [0,1,0,0,0,0|1,0,2]=4 2426 B8R0.7 CC(=O)O\C=C\CCBr Amb27482630 [0,1,0,0,0,0|1,0,2]=4 2427 B8R0.7 CC(=O)SCCCC#N Amb17607671 [0,1,0,0,0,0|1,0,1]=3 2428 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,1,0,0,0,0|1,0,1]=3 2429 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,1,0,0,0,0|1,0,0]=2 2430 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,1,0,0,0,0|1,0,0]=2 2431 B8R0.7 CC(=O)SCCCCN Amb27429858 [0,1,0,0,0,0|1,0,0]=2 2432 B8R0.7 CC(=O)S\C=C\CCCl Amb25887422 [0,1,0,0,0,0|1,0,2]=4 2433 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [0,1,0,0,0,0|0,0,3]=4 2434 B8R0.7 CC(=O)\C=C\NCCCl Amb27439668 [0,1,0,0,0,0|1,0,2]=4 2435 B8R0.7 CC(Br)CCCCC#N Amb27831403 [0,1,0,0,0,0|1,0,2]=4 2436 B8R0.7 CC(C)=C=CCCCCl Amb27173200 [0,1,0,0,0,0|1,0,2]=4 2437 B8R0.7 CC(C)=CCCCCBr Amb25933172 [0,1,0,0,0,0|1,0,1]=3 2438 B8R0.7 CC(C)=CCCCCCl Amb32688153 [0,1,0,0,0,0|1,0,1]=3 2439 B8R0.7 CC(C)=CCCCCN Amb28345726 [0,1,0,0,0,0|1,0,1]=3 2440 B8R0.7 CC(C)=CCCCCO Amb28315431 [0,1,0,0,0,0|1,0,1]=3 2441 B8R0.7 CC(C)=CCNCCF Amb28049212 [0,1,0,0,0,0|2,0,1]=4 2442 B8R0.7 CC(C)=CCNCCI Amb27771636 [0,1,0,0,0,0|2,0,1]=4 2443 B8R0.7 CC(C)=CCOCCN Amb19020763 [0,1,0,0,0,0|2,0,1]=4 2444 B8R0.7 CC(C)CCCCC#N Amb25079358 [0,1,0,0,0,0|1,0,2]=4 2445 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,1,0,0,0,0|1,0,2]=4 2446 B8R0.7 CC(C)CCCCCBr Amb16231055 [0,1,0,0,0,0|1,0,1]=3 2447 B8R0.7 CC(C)CCCCCCl Amb27592473 [0,1,0,0,0,0|1,0,1]=3 2448 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|1,0,1]=3 2449 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|1,0,1]=3 2450 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|2,0,1]=4 2451 B8R0.7 CC(C)CCNCCBr Amb32653537 [0,1,0,0,0,0|2,0,1]=4 2452 B8R0.7 CC(C)CCNCCI Amb28188514 [0,1,0,0,0,0|2,0,1]=4 2453 B8R0.7 CC(C)CCNCCO Amb4034535 [0,1,0,0,0,0|2,0,1]=4 2454 B8R0.7 CC(C)CCOCCBr Amb6255121 [0,1,0,0,0,0|2,0,1]=4 2455 B8R0.7 CC(C)CCOCCCl Amb9209784 [0,1,0,0,0,0|2,0,1]=4 2456 B8R0.7 CC(C)CCOCCI Amb27446465 [0,1,0,0,0,0|2,0,1]=4 2457 B8R0.7 CC(C)CCOCCN Amb6245091 [0,1,0,0,0,0|2,0,1]=4 2458 B8R0.7 CC(C)CCOCCO Amb10609610 [0,1,0,0,0,0|2,0,1]=4 2459 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|2,0,1]=4 2460 B8R0.7 CC(C)CCSCCN Amb6260831 [0,1,0,0,0,0|2,0,1]=4 2461 B8R0.7 CC(C)CNCCCBr Amb27401785 [0,1,0,0,0,0|2,0,1]=4 2462 B8R0.7 CC(C)CNCCCN Amb17315266 [0,1,0,0,0,0|2,0,1]=4 2463 B8R0.7 CC(C)CNCCCO Amb534463 [0,1,0,0,0,0|2,0,1]=4 2464 B8R0.7 CC(C)COCCCBr Amb8828212 [0,1,0,0,0,0|2,0,1]=4 2465 B8R0.7 CC(C)COCCCCl Amb6255740 [0,1,0,0,0,0|2,0,1]=4 2466 B8R0.7 CC(C)COCCCN Amb1154609 [0,1,0,0,0,0|2,0,1]=4 2467 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|2,0,1]=4 2468 B8R0.7 CC(C)COCCCS Amb27842108 [0,1,0,0,0,0|2,0,1]=4 2469 B8R0.7 CC(C)CSCCCCl Amb9304955 [0,1,0,0,0,0|2,0,1]=4 2470 B8R0.7 CC(C)CSCCCN Amb9203029 [0,1,0,0,0,0|2,0,1]=4 2471 B8R0.7 CC(C)CSCCCO Amb9273779 [0,1,0,0,0,0|2,0,1]=4 2472 B8R0.7 CC(C)NCCCCCl Amb27759406 [0,1,0,0,0,0|2,0,1]=4 2473 B8R0.7 CC(C)NCCCCF Amb27852540 [0,1,0,0,0,0|2,0,1]=4 2474 B8R0.7 CC(C)NCCCCN Amb17334116 [0,1,0,0,0,0|2,0,1]=4 2475 B8R0.7 CC(C)NCCCCO Amb17334129 [0,1,0,0,0,0|2,0,1]=4 2476 B8R0.7 CC(C)OCCCCBr Amb8855453 [0,1,0,0,0,0|2,0,1]=4 2477 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|2,0,1]=4 2478 B8R0.7 CC(C)OCCCCN Amb6243226 [0,1,0,0,0,0|2,0,1]=4 2479 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|2,0,1]=4 2480 B8R0.7 CC(C)OCCCCS Amb27220452 [0,1,0,0,0,0|2,0,1]=4 2481 B8R0.7 CC(C)SCCCCBr Amb26443109 [0,1,0,0,0,0|2,0,1]=4 2482 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|2,0,1]=4 2483 B8R0.7 CC(C)SCCCCN Amb17500947 [0,1,0,0,0,0|2,0,1]=4 2484 B8R0.7 CC(C)SCCCCO Amb28049080 [0,1,0,0,0,0|2,0,1]=4 2485 B8R0.7 CC(C)SCCCCS Amb27833171 [0,1,0,0,0,0|2,0,1]=4 2486 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,1,0,0,0,0|1,0,2]=4 2487 B8R0.7 CC(Cl)CCCCCO Amb27656999 [0,1,0,0,0,0|1,0,1]=3 2488 B8R0.7 CC(Cl)CCOCCCl Amb27606700 [0,1,0,0,0,0|2,0,1]=4 2489 B8R0.7 CC(Cl)CNCCCCl Amb27637862 [0,1,0,0,0,0|2,0,1]=4 2490 B8R0.7 CC(Cl)OCCCCCl Amb28383422 [0,1,0,0,0,0|2,0,1]=4 2491 B8R0.7 CC(F)CCCCCBr Amb27781575 [0,1,0,0,0,0|1,0,1]=3 2492 B8R0.7 CC(F)CCSCCN Amb27848652 [0,1,0,0,0,0|2,0,1]=4 2493 B8R0.7 CC(F)CSCCCN Amb27209900 [0,1,0,0,0,0|2,0,1]=4 2494 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|1,0,1]=3 2495 B8R0.7 CC(N)CNCCCF Amb27162848 [0,1,0,0,0,0|2,0,1]=4 2496 B8R0.7 CC(N)COCCCO Amb27635056 [0,1,0,0,0,0|2,0,1]=4 2497 B8R0.7 CC(N)CSCCCF Amb27223251 [0,1,0,0,0,0|2,0,1]=4 2498 B8R0.7 CC(O)CCCCCF Amb27660009 [0,1,0,0,0,0|0,0,2]=3 2499 B8R0.7 CC(O)CCCCCO Amb27464322 [0,1,0,0,0,0|0,0,2]=3 2500 B8R0.7 CC(O)CCNCCN Amb27768810 [0,1,0,0,0,0|1,0,2]=4 2501 B8R0.7 CC(O)CNCCCF Amb27273615 [0,1,0,0,0,0|1,0,2]=4 2502 B8R0.7 CC(O)CNCCCO Amb17308669 [0,1,0,0,0,0|1,0,2]=4 2503 B8R0.7 CC(O)COCCCN Amb28318924 [0,1,0,0,0,0|1,0,2]=4 2504 B8R0.7 CC(O)CSCCCS Amb27956596 [0,1,0,0,0,0|1,0,2]=4 2505 B8R0.7 CC=C=CCCC(C)=O Amb27180942 [0,1,0,0,0,0|0,0,2]=3 2506 B8R0.7 CCC#CCCC(=O)O Amb28046178 [0,1,0,0,0,0|1,0,1]=3 2507 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,1,0,0,0,0|1,0,1]=3 2508 B8R0.7 CCCC#CCC(C)C Amb26876551 [0,1,0,0,0,0|1,0,2]=4 2509 B8R0.7 CCCC#CC[C@@H](C)O Amb27652867 [0,1,0,0,0,0|0,0,3]=4 2510 B8R0.7 CCCCC#CC(=O)O Amb2721486 [0,1,0,0,0,0|1,0,1]=3 2511 B8R0.7 CCCCC#CC(C)=O Amb17593278 [0,1,0,0,0,0|0,0,1]=2 2512 B8R0.7 CCCCC#CC(C)Br Amb27645420 [0,1,0,0,0,0|1,0,2]=4 2513 B8R0.7 CCCCC#CC(C)C Amb28291437 [0,1,0,0,0,0|1,0,2]=4 2514 B8R0.7 CCCCC#CC(C)O Amb27231182 [0,1,0,0,0,0|0,0,3]=4 2515 B8R0.7 CCCCC#CC(N)=O Amb27782976 [0,1,0,0,0,0|1,0,1]=3 2516 B8R0.7 CCCCC#C[C@@H](C)O Amb27835165 [0,1,0,0,0,0|0,0,3]=4 2517 B8R0.7 CCCCCC=C(F)F Amb10840486 [0,1,0,0,0,0|2,0,0]=3 2518 B8R0.7 CCCCCCB(O)O Amb2722519 [0,1,0,0,0,0|2,0,1]=4 2519 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [0,1,0,0,0,0|1,0,0]=2 2520 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,1,0,0,0,0|1,0,0]=2 2521 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,1,0,0,0,0|1,0,0]=2 2522 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [0,1,0,0,0,0|1,0,0]=2 2523 B8R0.7 CCCCCCC(Br)Br Amb33299433 [0,1,0,0,0,0|2,0,1]=4 2524 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,1,0,0,0,0|0,0,0]=1 2525 B8R0.7 CCCCCCC(C)Br Amb8387237 [0,1,0,0,0,0|1,0,1]=3 2526 B8R0.7 CCCCCCC(C)C Amb6366318 [0,1,0,0,0,0|1,0,1]=3 2527 B8R0.7 CCCCCCC(C)Cl Amb7795644 [0,1,0,0,0,0|1,0,1]=3 2528 B8R0.7 CCCCCCC(C)I Amb3940584 [0,1,0,0,0,0|1,0,1]=3 2529 B8R0.7 CCCCCCC(C)N Amb3940458 [0,1,0,0,0,0|1,0,1]=3 2530 B8R0.7 CCCCCCC(C)O Amb3940385 [0,1,0,0,0,0|0,0,2]=3 2531 B8R0.7 CCCCCCC(C)S Amb7795225 [0,1,0,0,0,0|0,1,1]=3 2532 B8R0.7 CCCCCCC(N)=O Amb8858816 [0,1,0,0,0,0|1,0,0]=2 2533 B8R0.7 CCCCCCC(O)O Amb27451028 [0,1,0,0,0,0|1,0,2]=4 2534 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [0,1,0,0,0,0|1,0,1]=3 2535 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [0,1,0,0,0,0|1,0,1]=3 2536 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,1,0,0,0,0|0,0,2]=3 2537 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [0,1,0,0,0,0|1,0,1]=3 2538 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [0,1,0,0,0,0|1,0,1]=3 2539 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,1,0,0,0,0|2,0,0]=3 2540 B8R0.7 CCCCCC[SiH](Cl)Cl Amb22733063 [0,1,0,0,0,0|2,1,0]=4 2541 B8R0.7 CCCCCNC(=N)N Amb28049568 [0,1,0,0,0,0|2,0,0]=3 2542 B8R0.7 CCCCCNC(C)=N Amb28127671 [0,1,0,0,0,0|1,0,0]=2 2543 B8R0.7 CCCCCNC(C)C Amb6250709 [0,1,0,0,0,0|1,0,1]=3 2544 B8R0.7 CCCCCNC(N)=O Amb6246936 [0,1,0,0,0,0|1,0,0]=2 2545 B8R0.7 CCCCCNC(N)=S Amb9212112 [0,1,0,0,0,0|1,1,0]=3 2546 B8R0.7 CCCCCOB(O)O Amb24716868 [0,1,0,0,0,0|2,0,1]=4 2547 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,1,0,0,0,0|1,0,0]=2 2548 B8R0.7 CCCCCOC(N)=O Amb27655610 [0,1,0,0,0,0|1,0,0]=2 2549 B8R0.7 CCCCCO[SiH](C)C Amb33512928 [0,1,0,0,0,0|1,1,0]=3 2550 B8R0.7 CCCCCSC(=N)N Amb20675976 [0,1,0,0,0,0|2,0,0]=3 2551 B8R0.7 CCCCCSC(=N)N Amb23590643 [0,1,0,0,0,0|2,0,0]=3 2552 B8R0.7 CCCCCSC(C)C Amb27197323 [0,1,0,0,0,0|1,0,1]=3 2553 B8R0.7 CCCCCSC(C)Cl Amb27477698 [0,1,0,0,0,0|1,0,1]=3 2554 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [0,1,0,0,0,0|1,0,0]=2 2555 B8R0.7 CCCCNCC(=O)O Amb7766471 [0,1,0,0,0,0|1,0,0]=2 2556 B8R0.7 CCCCNCC(C)C Amb6690984 [0,1,0,0,0,0|1,0,1]=3 2557 B8R0.7 CCCCNCC(C)O Amb9246458 [0,1,0,0,0,0|0,0,2]=3 2558 B8R0.7 CCCCNCC(N)=O Amb1126543 [0,1,0,0,0,0|1,0,0]=2 2559 B8R0.7 CCCCNCC(N)=O Amb7969721 [0,1,0,0,0,0|1,0,0]=2 2560 B8R0.7 CCCCNN=C(C)C Amb28049741 [0,1,0,0,0,0|2,0,0]=3 2561 B8R0.7 CCCCNNC(N)=S Amb23590674 [0,1,0,0,0,0|2,1,0]=4 2562 B8R0.7 CCCCOCC(=O)O Amb8514871 [0,1,0,0,0,0|1,0,0]=2 2563 B8R0.7 CCCCOCC(C)Br Amb27390173 [0,1,0,0,0,0|1,0,1]=3 2564 B8R0.7 CCCCOCC(C)C Amb26035939 [0,1,0,0,0,0|1,0,1]=3 2565 B8R0.7 CCCCOCC(C)O Amb4019960 [0,1,0,0,0,0|0,0,2]=3 2566 B8R0.7 CCCCOCC(N)=O Amb27855875 [0,1,0,0,0,0|1,0,0]=2 2567 B8R0.7 CCCCOC[C@@H](C)N Amb27838727 [0,1,0,0,0,0|1,0,1]=3 2568 B8R0.7 CCCCOC[C@H](C)N Amb28326216 [0,1,0,0,0,0|1,0,1]=3 2569 B8R0.7 CCCCONC(N)=O Amb2899789 [0,1,0,0,0,0|2,0,0]=3 2570 B8R0.7 CCCCSCC(=N)N Amb9479963 [0,1,0,0,0,0|2,0,0]=3 2571 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|1,0,0]=2 2572 B8R0.7 CCCCSCC(C)C Amb4017929 [0,1,0,0,0,0|1,0,1]=3 2573 B8R0.7 CCCCSCC(C)N Amb27772074 [0,1,0,0,0,0|1,0,1]=3 2574 B8R0.7 CCCCSCC(C)O Amb27768766 [0,1,0,0,0,0|0,0,2]=3 2575 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [0,1,0,0,0,0|0,0,1]=2 2576 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [0,1,0,0,0,0|1,0,1]=3 2577 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,1,0,0,0,0|1,0,1]=3 2578 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [0,1,0,0,0,0|1,0,1]=3 2579 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [0,1,0,0,0,0|0,0,3]=4 2580 B8R0.7 CCCC\N=C\[C@H](C)Cl Amb27401792 [0,1,0,0,0,0|1,0,2]=4 2581 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,1,0,0,0,0|1,0,0]=2 2582 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|1,0,0]=2 2583 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|0,0,0]=1 2584 B8R0.7 CCCNCCC(C)C Amb6279764 [0,1,0,0,0,0|1,0,1]=3 2585 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|2,0,1]=4 2586 B8R0.7 CCCNCCC(F)F Amb26012789 [0,1,0,0,0,0|2,0,1]=4 2587 B8R0.7 CCCNCCC(N)=S Amb17232015 [0,1,0,0,0,0|1,1,0]=3 2588 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|2,0,0]=3 2589 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|2,0,0]=3 2590 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,1,0,0,0,0|0,0,2]=3 2591 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,1,0,0,0,0|2,0,0]=3 2592 B8R0.7 CCCNCNC(C)C Amb28367897 [0,1,0,0,0,0|2,0,1]=4 2593 B8R0.7 CCCN\C=C\C(C)=S Amb27168202 [0,1,0,0,0,0|0,1,2]=4 2594 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,1,0,0,0,0|1,0,0]=2 2595 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,1,0,0,0,0|0,0,0]=1 2596 B8R0.7 CCCOCCC(C)Cl Amb27768653 [0,1,0,0,0,0|1,0,1]=3 2597 B8R0.7 CCCOCCC(C)O Amb27438490 [0,1,0,0,0,0|0,0,2]=3 2598 B8R0.7 CCCONCC(=O)O Amb27401902 [0,1,0,0,0,0|2,0,0]=3 2599 B8R0.7 CCCONCC(C)C Amb28326057 [0,1,0,0,0,0|2,0,1]=4 2600 B8R0.7 CCCO\C=C\C(N)=O Amb28198536 [0,1,0,0,0,0|1,0,2]=4 2601 B8R0.7 CCCSCCC(C)C Amb28400564 [0,1,0,0,0,0|1,0,1]=3 2602 B8R0.7 CCCSCCC(N)=S Amb17503250 [0,1,0,0,0,0|1,1,0]=3 2603 B8R0.7 CCCSCCN(C)C Amb27660717 [0,1,0,0,0,0|2,0,0]=3 2604 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [0,1,0,0,0,0|1,0,2]=4 2605 B8R0.7 CCCS\C=C/C(=O)[O-] Amb19816096 [0,1,0,0,0,0|1,0,2]=4 2606 B8R0.7 CCCS\C=C/C(=O)[O-] Amb6600550 [0,1,0,0,0,0|1,0,2]=4 2607 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [0,1,0,0,0,0|0,0,1]=2 2608 B8R0.7 CCC\C=C\CC(=N)N Amb33373714 [0,1,0,0,0,0|2,0,1]=4 2609 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,1,0,0,0,0|1,0,1]=3 2610 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [0,1,0,0,0,0|0,0,1]=2 2611 B8R0.7 CCC\C=C\CC(C)Br Amb26397126 [0,1,0,0,0,0|1,0,2]=4 2612 B8R0.7 CCC\C=C\CC(C)Cl Amb26636688 [0,1,0,0,0,0|1,0,2]=4 2613 B8R0.7 CCC\C=C\CC(C)O Amb27766099 [0,1,0,0,0,0|0,0,3]=4 2614 B8R0.7 CCC\C=C\CC(N)=S Amb33373713 [0,1,0,0,0,0|1,1,1]=4 2615 B8R0.7 CCC\C=C\CN(C)O Amb33224461 [0,1,0,0,0,0|1,0,2]=4 2616 B8R0.7 CCC\C=C\C[C@@H](C)N Amb33424842 [0,1,0,0,0,0|1,0,2]=4 2617 B8R0.7 CCC\C=C\C[C@@H](C)O Amb33424840 [0,1,0,0,0,0|0,0,3]=4 2618 B8R0.7 CCC\C=C\C[C@H](C)N Amb33424841 [0,1,0,0,0,0|1,0,2]=4 2619 B8R0.7 CCC\C=C\C[C@H](C)O Amb33358968 [0,1,0,0,0,0|0,0,3]=4 2620 B8R0.7 CCC\C=N\NC(C)=O Amb27613902 [0,1,0,0,0,0|1,0,1]=3 2621 B8R0.7 CCC\C=N\NC(N)=O Amb25690939 [0,1,0,0,0,0|2,0,1]=4 2622 B8R0.7 CCNCC#CC(=O)O Amb33168956 [0,1,0,0,0,0|1,0,2]=4 2623 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,1,0,0,0,0|1,0,0]=2 2624 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,1,0,0,0,0|1,0,0]=2 2625 B8R0.7 CCNCCCC(C)Cl Amb27768830 [0,1,0,0,0,0|1,0,1]=3 2626 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,1,0,0,0,0|1,0,0]=2 2627 B8R0.7 CCNCCCN(C)C Amb6699376 [0,1,0,0,0,0|2,0,0]=3 2628 B8R0.7 CCNCCCS(C)=O Amb27223315 [0,1,0,0,0,0|1,0,0]=2 2629 B8R0.7 CCNCCNC(C)=O Amb6732650 [0,1,0,0,0,0|1,0,0]=2 2630 B8R0.7 CCNCCSC(C)=O Amb27187142 [0,1,0,0,0,0|1,0,0]=2 2631 B8R0.7 CCOCC#CC(N)=O Amb33495806 [0,1,0,0,0,0|1,0,2]=4 2632 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,1,0,0,0,0|1,0,0]=2 2633 B8R0.7 CCOCCCN(C)C Amb27642283 [0,1,0,0,0,0|2,0,0]=3 2634 B8R0.7 CCOCCCN(C)N Amb27433584 [0,1,0,0,0,0|2,0,0]=3 2635 B8R0.7 CCOCCNC(=N)N Amb28049323 [0,1,0,0,0,0|3,0,0]=4 2636 B8R0.7 CCOCCNC(C)=N Amb27789482 [0,1,0,0,0,0|2,0,0]=3 2637 B8R0.7 CCOCCNC(N)=O Amb9454688 [0,1,0,0,0,0|2,0,0]=3 2638 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,1,0,0,0,0|2,0,0]=3 2639 B8R0.7 CCOCCOC(C)=O Amb8383625 [0,1,0,0,0,0|1,0,0]=2 2640 B8R0.7 CCOCCOC(N)=O Amb27760038 [0,1,0,0,0,0|2,0,0]=3 2641 B8R0.7 CCOCCSC(=N)N Amb20675990 [0,1,0,0,0,0|3,0,0]=4 2642 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [0,1,0,0,0,0|1,0,2]=4 2643 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [0,1,0,0,0,0|1,0,2]=4 2644 B8R0.7 CCONCCC(C)F Amb27617250 [0,1,0,0,0,0|2,0,1]=4 2645 B8R0.7 CCONCCS(C)=O Amb27247491 [0,1,0,0,0,0|2,0,0]=3 2646 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [0,1,0,0,0,0|2,0,1]=4 2647 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|2,0,1]=4 2648 B8R0.7 CCSCCCC(=N)N Amb28934927 [0,1,0,0,0,0|2,0,0]=3 2649 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,1,0,0,0,0|1,0,0]=2 2650 B8R0.7 CCSCCCC(C)=O Amb9660283 [0,1,0,0,0,0|0,0,0]=1 2651 B8R0.7 CCSCCCC(C)C Amb27588655 [0,1,0,0,0,0|1,0,1]=3 2652 B8R0.7 CCSCCCC(C)N Amb26049335 [0,1,0,0,0,0|1,0,1]=3 2653 B8R0.7 CCSCCCC(C)O Amb26319707 [0,1,0,0,0,0|0,0,2]=3 2654 B8R0.7 CCSCCCC(N)=S Amb28285187 [0,1,0,0,0,0|1,1,0]=3 2655 B8R0.7 CCSCCC[C@@H](C)N Amb33323737 [0,1,0,0,0,0|1,0,1]=3 2656 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,1,0,0,0,0|0,0,2]=3 2657 B8R0.7 CCSCCC[C@H](C)N Amb33323735 [0,1,0,0,0,0|1,0,1]=3 2658 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,1,0,0,0,0|0,0,2]=3 2659 B8R0.7 CCSCCC[N+](=O)[O-] Amb33323726 [0,1,0,0,0,0|2,0,0]=3 2660 B8R0.7 CCSCCNC(=N)N Amb28183780 [0,1,0,0,0,0|3,0,0]=4 2661 B8R0.7 CCSCCNC(C)=O Amb27848944 [0,1,0,0,0,0|1,0,0]=2 2662 B8R0.7 CCSCCNC(N)=O Amb27639100 [0,1,0,0,0,0|2,0,0]=3 2663 B8R0.7 CCSCCNN(C)C Amb27219309 [0,1,0,0,0,0|3,0,0]=4 2664 B8R0.7 CCSCCOC(C)C Amb27753411 [0,1,0,0,0,0|2,0,1]=4 2665 B8R0.7 CCSCCSC(=N)N Amb583113 [0,1,0,0,0,0|3,0,0]=4 2666 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [0,1,0,0,0,0|1,0,2]=4 2667 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [0,1,0,0,0,0|0,0,2]=3 2668 B8R0.7 CCSSCCC(=O)O Amb27837279 [0,1,0,0,0,0|2,0,0]=3 2669 B8R0.7 CC\C=C/C=C/C(C)=O Amb27164670 [0,1,0,0,0,0|0,0,3]=4 2670 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [0,1,0,0,0,0|1,0,1]=3 2671 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,0,0,0,0|0,0,2]=3 2672 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [0,1,0,0,0,0|0,0,3]=4 2673 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [0,1,0,0,0,0|1,0,1]=3 2674 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,1,0,0,0,0|0,0,1]=2 2675 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|1,0,2]=4 2676 B8R0.7 CC\C=C\CCC(C)N Amb27875423 [0,1,0,0,0,0|1,0,2]=4 2677 B8R0.7 CC\C=C\CCC(C)O Amb33079835 [0,1,0,0,0,0|0,0,3]=4 2678 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [0,1,0,0,0,0|1,0,1]=3 2679 B8R0.7 CC\C=C\CC[C@@H](C)N Amb33267990 [0,1,0,0,0,0|1,0,2]=4 2680 B8R0.7 CC\C=C\CC[C@@H](C)O Amb33267991 [0,1,0,0,0,0|0,0,3]=4 2681 B8R0.7 CC\C=C\CC[C@H](C)N Amb33267989 [0,1,0,0,0,0|1,0,2]=4 2682 B8R0.7 CC\C=C\CC[C@H](C)O Amb33267992 [0,1,0,0,0,0|0,0,3]=4 2683 B8R0.7 CC\C=C\CC[N+](=O)[O-] Amb33267977 [0,1,0,0,0,0|2,0,1]=4 2684 B8R0.7 CC\C=C\CNC(C)=O Amb27828159 [0,1,0,0,0,0|0,0,2]=3 2685 B8R0.7 CC\C=C\COC(C)=O Amb27487199 [0,1,0,0,0,0|0,0,2]=3 2686 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,1,0,0,0,0|0,0,2]=3 2687 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,1,0,0,0,0|0,0,2]=3 2688 B8R0.7 CN(C)CCCCC#N Amb1089735 [0,1,0,0,0,0|2,0,1]=4 2689 B8R0.7 CN(C)CCCCC#N Amb2099818 [0,1,0,0,0,0|2,0,1]=4 2690 B8R0.7 CN(C)CCCCC=O Amb25276429 [0,1,0,0,0,0|2,0,1]=4 2691 B8R0.7 CN(C)CCCCCBr Amb26490317 [0,1,0,0,0,0|2,0,0]=3 2692 B8R0.7 CN(C)CCCCCN Amb2721306 [0,1,0,0,0,0|2,0,0]=3 2693 B8R0.7 CN(C)CCCCCN Amb31291017 [0,1,0,0,0,0|2,0,0]=3 2694 B8R0.7 CN(C)CCCCCN Amb33800157 [0,1,0,0,0,0|2,0,0]=3 2695 B8R0.7 CN(C)CCCCCO Amb17334131 [0,1,0,0,0,0|2,0,0]=3 2696 B8R0.7 CN(C)CCCCCS Amb25730651 [0,1,0,0,0,0|2,0,0]=3 2697 B8R0.7 CN(C)CCCCON Amb27862613 [0,1,0,0,0,0|3,0,0]=4 2698 B8R0.7 CN(C)CCNCCBr Amb534833 [0,1,0,0,0,0|3,0,0]=4 2699 B8R0.7 CN(C)CCNCCO Amb1017223 [0,1,0,0,0,0|3,0,0]=4 2700 B8R0.7 CN(C)CCOCCCl Amb20668192 [0,1,0,0,0,0|3,0,0]=4 2701 B8R0.7 CN(C)CCOCCN Amb33528887 [0,1,0,0,0,0|3,0,0]=4 2702 B8R0.7 CN(C)CCOCCN Amb34913197 [0,1,0,0,0,0|3,0,0]=4 2703 B8R0.7 CN(C)CCOCCO Amb8393255 [0,1,0,0,0,0|3,0,0]=4 2704 B8R0.7 CN(C)CCSCCN Amb6281250 [0,1,0,0,0,0|3,0,0]=4 2705 B8R0.7 CN(C)CCSCCO Amb9247586 [0,1,0,0,0,0|3,0,0]=4 2706 B8R0.7 CN(C)CSCCCCl Amb28061090 [0,1,0,0,0,0|3,0,0]=4 2707 B8R0.7 CN(C)NCCCCO Amb27635131 [0,1,0,0,0,0|3,0,0]=4 2708 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,1,0,0,0,0|1,0,0]=2 2709 B8R0.7 CNCCCCC(=O)O Amb24340485 [0,1,0,0,0,0|1,0,0]=2 2710 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|1,0,1]=3 2711 B8R0.7 CNCCCCC(C)O Amb17569923 [0,1,0,0,0,0|0,0,2]=3 2712 B8R0.7 CNCCCCC(N)=O Amb27780478 [0,1,0,0,0,0|1,0,0]=2 2713 B8R0.7 CNCCCCN(C)C Amb19515495 [0,1,0,0,0,0|2,0,0]=3 2714 B8R0.7 CNCCCCN(C)C Amb32675733 [0,1,0,0,0,0|2,0,0]=3 2715 B8R0.7 CNCCCNC(=S)S Amb26390720 [0,1,0,0,0,0|2,1,0]=4 2716 B8R0.7 CNCCCNC(C)=O Amb33547919 [0,1,0,0,0,0|1,0,0]=2 2717 B8R0.7 CNCCCNC(C)=O Amb34913785 [0,1,0,0,0,0|1,0,0]=2 2718 B8R0.7 CNCCCNC(C)=O Amb9464418 [0,1,0,0,0,0|1,0,0]=2 2719 B8R0.7 CNCCCNS(C)=O Amb27186838 [0,1,0,0,0,0|2,0,0]=3 2720 B8R0.7 CNCCCOC(C)C Amb19374841 [0,1,0,0,0,0|2,0,1]=4 2721 B8R0.7 CNCCCOC(C)C Amb32661845 [0,1,0,0,0,0|2,0,1]=4 2722 B8R0.7 CNCCOCC(=O)O Amb18630741 [0,1,0,0,0,0|2,0,0]=3 2723 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,1,0,0,0,0|1,0,0]=2 2724 B8R0.7 CNCCOCC(C)C Amb28283736 [0,1,0,0,0,0|2,0,1]=4 2725 B8R0.7 CNCCOCC(N)=O Amb27447982 [0,1,0,0,0,0|2,0,0]=3 2726 B8R0.7 CNCCSCC(C)N Amb27248798 [0,1,0,0,0,0|2,0,1]=4 2727 B8R0.7 CNNCCCN(C)C Amb28060986 [0,1,0,0,0,0|3,0,0]=4 2728 B8R0.7 COCC#CCC(=O)O Amb27663198 [0,1,0,0,0,0|1,0,2]=4 2729 B8R0.7 COCCC#CC(=O)O Amb27392974 [0,1,0,0,0,0|1,0,2]=4 2730 B8R0.7 COCCCCB(O)O Amb27230891 [0,1,0,0,0,0|2,0,1]=4 2731 B8R0.7 COCCCCC(=O)O Amb9207785 [0,1,0,0,0,0|1,0,0]=2 2732 B8R0.7 COCCCCC(C)=O Amb9659801 [0,1,0,0,0,0|0,0,0]=1 2733 B8R0.7 COCCCCC(C)N Amb17569945 [0,1,0,0,0,0|1,0,1]=3 2734 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|0,0,2]=3 2735 B8R0.7 COCCCCN(C)N Amb27265160 [0,1,0,0,0,0|2,0,0]=3 2736 B8R0.7 COCCCCS(=O)Cl Amb32720517 [0,1,0,0,0,0|2,0,0]=3 2737 B8R0.7 COCCCCS(=O)[O-] Amb32754745 [0,1,0,0,0,0|2,0,0]=3 2738 B8R0.7 COCCCCS(N)=O Amb32720518 [0,1,0,0,0,0|2,0,0]=3 2739 B8R0.7 COCCCC[C@@H](C)N Amb33377489 [0,1,0,0,0,0|1,0,1]=3 2740 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,1,0,0,0,0|0,0,2]=3 2741 B8R0.7 COCCCC[C@H](C)N Amb33377488 [0,1,0,0,0,0|1,0,1]=3 2742 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,1,0,0,0,0|0,0,2]=3 2743 B8R0.7 COCCCC[N+](=O)[O-] Amb33377457 [0,1,0,0,0,0|2,0,0]=3 2744 B8R0.7 COCCCNC(=N)N Amb22058724 [0,1,0,0,0,0|3,0,0]=4 2745 B8R0.7 COCCCNC(=N)N Amb33547912 [0,1,0,0,0,0|3,0,0]=4 2746 B8R0.7 COCCCNC(=O)Cl Amb27791959 [0,1,0,0,0,0|2,0,0]=3 2747 B8R0.7 COCCCNC(C)=N Amb28049783 [0,1,0,0,0,0|2,0,0]=3 2748 B8R0.7 COCCCNC(C)=O Amb3358083 [0,1,0,0,0,0|1,0,0]=2 2749 B8R0.7 COCCCNC(C)C Amb6730254 [0,1,0,0,0,0|2,0,1]=4 2750 B8R0.7 COCCCNC(N)=O Amb1105274 [0,1,0,0,0,0|2,0,0]=3 2751 B8R0.7 COCCCNC(N)=S Amb2777917 [0,1,0,0,0,0|2,1,0]=4 2752 B8R0.7 COCCCNN(C)C Amb27754323 [0,1,0,0,0,0|3,0,0]=4 2753 B8R0.7 COCCCOC(C)=O Amb22732978 [0,1,0,0,0,0|1,0,0]=2 2754 B8R0.7 COCCNCC(=O)O Amb19514667 [0,1,0,0,0,0|2,0,0]=3 2755 B8R0.7 COCCNCC(=O)O Amb7766415 [0,1,0,0,0,0|2,0,0]=3 2756 B8R0.7 COCCNCC(C)C Amb6685598 [0,1,0,0,0,0|2,0,1]=4 2757 B8R0.7 COCCNCC(N)=O Amb13951972 [0,1,0,0,0,0|2,0,0]=3 2758 B8R0.7 COCCNCC(N)=O Amb6707121 [0,1,0,0,0,0|2,0,0]=3 2759 B8R0.7 COCCNN=C(C)C Amb28248995 [0,1,0,0,0,0|3,0,0]=4 2760 B8R0.7 COCCOCC(=O)O Amb2721259 [0,1,0,0,0,0|2,0,0]=3 2761 B8R0.7 COCCOCC(C)=O Amb9665444 [0,1,0,0,0,0|1,0,0]=2 2762 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|2,0,1]=4 2763 B8R0.7 COCCOCC(C)N Amb6661949 [0,1,0,0,0,0|2,0,1]=4 2764 B8R0.7 COCCOCC(C)O Amb25939469 [0,1,0,0,0,0|1,0,2]=4 2765 B8R0.7 COCCOC[C@@H](C)N Amb27862644 [0,1,0,0,0,0|2,0,1]=4 2766 B8R0.7 COCCSCC(=O)O Amb6245777 [0,1,0,0,0,0|2,0,0]=3 2767 B8R0.7 COCCSCC(C)C Amb27837668 [0,1,0,0,0,0|2,0,1]=4 2768 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|1,0,2]=4 2769 B8R0.7 COCCSC[C@H](C)O Amb27977734 [0,1,0,0,0,0|1,0,2]=4 2770 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [0,1,0,0,0,0|1,0,2]=4 2771 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [0,1,0,0,0,0|0,0,2]=3 2772 B8R0.7 COCOCCC(=O)O Amb27784860 [0,1,0,0,0,0|2,0,0]=3 2773 B8R0.7 COCSCCC(=O)O Amb27263382 [0,1,0,0,0,0|2,0,0]=3 2774 B8R0.7 COCSCCN(C)C Amb27772042 [0,1,0,0,0,0|3,0,0]=4 2775 B8R0.7 CS(=O)CCCCC#N Amb25711714 [0,1,0,0,0,0|1,0,1]=3 2776 B8R0.7 CS(=O)CCCCC=O Amb27856287 [0,1,0,0,0,0|1,0,1]=3 2777 B8R0.7 CS(=O)CCCCCCl Amb27173793 [0,1,0,0,0,0|1,0,0]=2 2778 B8R0.7 CS(=O)CCCN=C=O Amb27475732 [0,1,0,0,0,0|2,0,1]=4 2779 B8R0.7 CS(=O)CCCN=C=S Amb6298060 [0,1,0,0,0,0|2,0,1]=4 2780 B8R0.7 CS(=O)CCCNC#N Amb27983375 [0,1,0,0,0,0|2,0,1]=4 2781 B8R0.7 CS(=O)CCNCCCl Amb27222833 [0,1,0,0,0,0|2,0,0]=3 2782 B8R0.7 CS(=O)CCNCCF Amb28138817 [0,1,0,0,0,0|2,0,0]=3 2783 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,1,0,0,0,0|1,0,0]=2 2784 B8R0.7 CSCCCCC(C)=O Amb27815140 [0,1,0,0,0,0|0,0,0]=1 2785 B8R0.7 CSCCCCC(C)N Amb27475432 [0,1,0,0,0,0|1,0,1]=3 2786 B8R0.7 CSCCCCC(C)O Amb27863049 [0,1,0,0,0,0|0,0,2]=3 2787 B8R0.7 CSCCCCC(N)=O Amb27662727 [0,1,0,0,0,0|1,0,0]=2 2788 B8R0.7 CSCCCC[C@@H](C)N Amb33198290 [0,1,0,0,0,0|1,0,1]=3 2789 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,1,0,0,0,0|0,0,2]=3 2790 B8R0.7 CSCCCC[C@H](C)N Amb33198289 [0,1,0,0,0,0|1,0,1]=3 2791 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,1,0,0,0,0|0,0,2]=3 2792 B8R0.7 CSCCCC[N+](=O)[O-] Amb33198277 [0,1,0,0,0,0|2,0,0]=3 2793 B8R0.7 CSCCCOC(C)=O Amb8392861 [0,1,0,0,0,0|1,0,0]=2 2794 B8R0.7 CSCCNCC(=O)O Amb24401934 [0,1,0,0,0,0|2,0,0]=3 2795 B8R0.7 CSCCNCC(=O)O Amb28934977 [0,1,0,0,0,0|2,0,0]=3 2796 B8R0.7 CSCCNCC(C)C Amb27452217 [0,1,0,0,0,0|2,0,1]=4 2797 B8R0.7 CSCCNCC(N)=O Amb27850987 [0,1,0,0,0,0|2,0,0]=3 2798 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [0,1,0,0,0,0|1,0,2]=4 2799 B8R0.7 CSCCOCC(=O)O Amb27392229 [0,1,0,0,0,0|2,0,0]=3 2800 B8R0.7 CSCCONC(C)=O Amb27247630 [0,1,0,0,0,0|2,0,0]=3 2801 B8R0.7 CSCCSCC(=O)O Amb27964765 [0,1,0,0,0,0|2,0,0]=3 2802 B8R0.7 CSCCSCC(C)C Amb28454546 [0,1,0,0,0,0|2,0,1]=4 2803 B8R0.7 CSCCSC[C@@H](C)N Amb27861407 [0,1,0,0,0,0|2,0,1]=4 2804 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [0,1,0,0,0,0|1,0,2]=4 2805 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [0,1,0,0,0,0|0,0,2]=3 2806 B8R0.7 CSCSCC=C(C)C Amb27867549 [0,1,0,0,0,0|2,0,1]=4 2807 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [0,1,0,0,0,0|1,0,2]=4 2808 B8R0.7 CSSCCCC(=O)O Amb25269470 [0,1,0,0,0,0|2,0,0]=3 2809 B8R0.7 CSSCCNC(C)=N Amb27960449 [0,1,0,0,0,0|3,0,0]=4 2810 B8R0.7 CSSCCNC(C)=O Amb27805193 [0,1,0,0,0,0|2,0,0]=3 2811 B8R0.7 C[C@@H](N)CNCCCF Amb27956501 [0,1,0,0,0,0|2,0,1]=4 2812 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,1,0,0,0,0|0,0,2]=3 2813 B8R0.7 C[C@H](O)CCCCC=O Amb27793108 [0,1,0,0,0,0|0,0,3]=4 2814 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,1,0,0,0,0|1,0,2]=4 2815 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,1,0,0,0,0|0,0,2]=3 2816 B8R0.7 C\C(Cl)=C\CCCC=O Amb27252215 [0,1,0,0,0,0|1,0,2]=4 2817 B8R0.7 C\C(N)=N\CCCCO Amb28457978 [0,1,0,0,0,0|2,0,0]=3 2818 B8R0.7 C\C=C\C=C\CC(C)=O Amb27248237 [0,1,0,0,0,0|0,0,3]=4 2819 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [0,1,0,0,0,0|1,0,1]=3 2820 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,1,0,0,0,0|0,0,1]=2 2821 B8R0.7 C\C=C\CCCC(C)Br Amb27845432 [0,1,0,0,0,0|1,0,2]=4 2822 B8R0.7 C\C=C\CCNC(N)=O Amb27845871 [0,1,0,0,0,0|1,0,2]=4 2823 B8R0.7 C\C=C\CC\N=C(\C)N Amb27163776 [0,1,0,0,0,0|1,0,2]=4 2824 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [0,1,0,0,0,0|1,0,2]=4 2825 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [0,1,0,0,0,0|0,0,2]=3 2826 B8R0.7 FC(F)=CCCCCBr Amb27863490 [0,1,0,0,0,0|2,0,1]=4 2827 B8R0.7 FC(F)CCCCCBr Amb24459890 [0,1,0,0,0,0|2,0,1]=4 2828 B8R0.7 FC(F)CCCCCCl Amb32688145 [0,1,0,0,0,0|2,0,1]=4 2829 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,1,0,0,0,0|1,0,1]=3 2830 B8R0.7 N#CCCCCC(N)=O Amb24108037 [0,1,0,0,0,0|1,0,1]=3 2831 B8R0.7 N#CCCCCS(=O)Cl Amb32720347 [0,1,0,0,0,0|2,0,1]=4 2832 B8R0.7 N#CCCCCS(=O)[O-] Amb32754250 [0,1,0,0,0,0|2,0,1]=4 2833 B8R0.7 N#CCCCCS(N)=O Amb32720348 [0,1,0,0,0,0|2,0,1]=4 2834 B8R0.7 N#CCCCNC(N)=O Amb27644105 [0,1,0,0,0,0|2,0,1]=4 2835 B8R0.7 N#CCCNCC(=O)O Amb2720474 [0,1,0,0,0,0|2,0,1]=4 2836 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,1,0,0,0,0|2,0,1]=4 2837 B8R0.7 N#CCSCCC(=O)O Amb6277440 [0,1,0,0,0,0|2,0,1]=4 2838 B8R0.7 N#CCSCCC(N)=O Amb27430604 [0,1,0,0,0,0|2,0,1]=4 2839 B8R0.7 N=C(N)CCCCCO Amb27447678 [0,1,0,0,0,0|2,0,0]=3 2840 B8R0.7 N=C(N)CCOCCO Amb6681748 [0,1,0,0,0,0|3,0,0]=4 2841 B8R0.7 N=C(N)NCCCCN Amb19929571 [0,1,0,0,0,0|3,0,0]=4 2842 B8R0.7 N=C(N)NCCCCN Amb2781574 [0,1,0,0,0,0|3,0,0]=4 2843 B8R0.7 N=C(N)NCCCCN Amb3941521 [0,1,0,0,0,0|3,0,0]=4 2844 B8R0.7 N=C(N)SCCCCF Amb28457766 [0,1,0,0,0,0|3,0,0]=4 2845 B8R0.7 NC(=O)C#CCCCCl Amb28133803 [0,1,0,0,0,0|1,0,2]=4 2846 B8R0.7 NC(=O)CCCCCBr Amb2685265 [0,1,0,0,0,0|1,0,0]=2 2847 B8R0.7 NC(=O)CCCCCCl Amb27392074 [0,1,0,0,0,0|1,0,0]=2 2848 B8R0.7 NC(=O)CCCCCF Amb27837777 [0,1,0,0,0,0|1,0,0]=2 2849 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,1,0,0,0,0|1,0,0]=2 2850 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,1,0,0,0,0|2,0,1]=4 2851 B8R0.7 NC(=O)CCNCCO Amb4303499 [0,1,0,0,0,0|2,0,0]=3 2852 B8R0.7 NC(=O)CCOCCO Amb28289325 [0,1,0,0,0,0|2,0,0]=3 2853 B8R0.7 NC(=O)CCSCCBr Amb28367265 [0,1,0,0,0,0|2,0,0]=3 2854 B8R0.7 NC(=O)CCSCCCl Amb27620677 [0,1,0,0,0,0|2,0,0]=3 2855 B8R0.7 NC(=O)CNCCCO Amb9246617 [0,1,0,0,0,0|2,0,0]=3 2856 B8R0.7 NC(=O)CSCCCCl Amb28397637 [0,1,0,0,0,0|2,0,0]=3 2857 B8R0.7 NC(=O)CSCCCO Amb27408312 [0,1,0,0,0,0|2,0,0]=3 2858 B8R0.7 NC(=O)CSCCCS Amb27965314 [0,1,0,0,0,0|2,0,0]=3 2859 B8R0.7 NC(=O)NCCCCBr Amb27614497 [0,1,0,0,0,0|2,0,0]=3 2860 B8R0.7 NC(=O)NCCCCF Amb27663218 [0,1,0,0,0,0|2,0,0]=3 2861 B8R0.7 NC(=O)NOCCCO Amb28189929 [0,1,0,0,0,0|3,0,0]=4 2862 B8R0.7 NC(=S)CCCCCF Amb27956470 [0,1,0,0,0,0|1,1,0]=3 2863 B8R0.7 NC(=S)CCOCCO Amb6681260 [0,1,0,0,0,0|2,1,0]=4 2864 B8R0.7 NC(=S)NCCCCF Amb27783801 [0,1,0,0,0,0|2,1,0]=4 2865 B8R0.7 NCCCC#CC(=O)O Amb33168806 [0,1,0,0,0,0|1,0,2]=4 2866 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,1,0,0,0,0|1,0,0]=2 2867 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,1,0,0,0,0|1,0,0]=2 2868 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,1,0,0,0,0|1,0,0]=2 2869 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [0,1,0,0,0,0|1,0,0]=2 2870 B8R0.7 NCCCCNC(=S)S Amb26625184 [0,1,0,0,0,0|2,1,0]=4 2871 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,1,0,0,0,0|2,0,0]=3 2872 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,1,0,0,0,0|2,0,0]=3 2873 B8R0.7 NCCCCNC(N)=S Amb28041776 [0,1,0,0,0,0|2,1,0]=4 2874 B8R0.7 NCCCOCC(=O)O Amb18111435 [0,1,0,0,0,0|2,0,0]=3 2875 B8R0.7 NCCCOCC(=O)O Amb31217489 [0,1,0,0,0,0|2,0,0]=3 2876 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,1,0,0,0,0|2,0,0]=3 2877 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [0,1,0,0,0,0|1,0,2]=4 2878 B8R0.7 NCCNCCC(=O)O Amb20668304 [0,1,0,0,0,0|2,0,0]=3 2879 B8R0.7 NCCNCCC(=O)O Amb22058790 [0,1,0,0,0,0|2,0,0]=3 2880 B8R0.7 NCCNCCC(N)=O Amb27436823 [0,1,0,0,0,0|2,0,0]=3 2881 B8R0.7 NCCNCC[SH](=O)=O Amb27816609 [0,1,0,0,0,0|3,0,0]=4 2882 B8R0.7 NCCOCCC(=O)O Amb18630461 [0,1,0,0,0,0|2,0,0]=3 2883 B8R0.7 NCCOCCC(=O)O Amb33330744 [0,1,0,0,0,0|2,0,0]=3 2884 B8R0.7 NCCOCCC(N)=O Amb27751130 [0,1,0,0,0,0|2,0,0]=3 2885 B8R0.7 NCCSCCC(=O)O Amb21988844 [0,1,0,0,0,0|2,0,0]=3 2886 B8R0.7 NCCSSCC(=O)O Amb27658690 [0,1,0,0,0,0|3,0,0]=4 2887 B8R0.7 NOCCCCC(=O)O Amb27596055 [0,1,0,0,0,0|2,0,0]=3 2888 B8R0.7 NS(=O)CCCCCBr Amb32720462 [0,1,0,0,0,0|2,0,0]=3 2889 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [0,1,0,0,0,0|1,0,0]=2 2890 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [0,1,0,0,0,0|1,0,0]=2 2891 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [0,1,0,0,0,0|1,0,0]=2 2892 B8R0.7 O=C(Cl)CCNCCCl Amb28121157 [0,1,0,0,0,0|2,0,0]=3 2893 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [0,1,0,0,0,0|2,0,0]=3 2894 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [0,1,0,0,0,0|2,0,0]=3 2895 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [0,1,0,0,0,0|1,0,2]=4 2896 B8R0.7 O=C(F)CCCCCCl Amb27173031 [0,1,0,0,0,0|1,0,0]=2 2897 B8R0.7 O=C(O)CCC#CCO Amb27949900 [0,1,0,0,0,0|1,0,2]=4 2898 B8R0.7 O=C(O)CCCCCBr Amb2081955 [0,1,0,0,0,0|1,0,0]=2 2899 B8R0.7 O=C(O)CCCCCCl Amb18796646 [0,1,0,0,0,0|1,0,0]=2 2900 B8R0.7 O=C(O)CCCCCF Amb26063796 [0,1,0,0,0,0|1,0,0]=2 2901 B8R0.7 O=C(O)CCCCCI Amb22736492 [0,1,0,0,0,0|1,0,0]=2 2902 B8R0.7 O=C(O)CCCCCO Amb8515991 [0,1,0,0,0,0|1,0,0]=2 2903 B8R0.7 O=C(O)CCCCNO Amb28410171 [0,1,0,0,0,0|2,0,0]=3 2904 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [0,1,0,0,0,0|2,0,1]=4 2905 B8R0.7 O=C(O)CCNCCF Amb27954272 [0,1,0,0,0,0|2,0,0]=3 2906 B8R0.7 O=C(O)CCNCCO Amb1110010 [0,1,0,0,0,0|2,0,0]=3 2907 B8R0.7 O=C(O)CCNCCS Amb28285239 [0,1,0,0,0,0|2,0,0]=3 2908 B8R0.7 O=C(O)CCOCCBr Amb24057757 [0,1,0,0,0,0|2,0,0]=3 2909 B8R0.7 O=C(O)CCOCCF Amb27807548 [0,1,0,0,0,0|2,0,0]=3 2910 B8R0.7 O=C(O)CCOCCO Amb6680916 [0,1,0,0,0,0|2,0,0]=3 2911 B8R0.7 O=C(O)CCOCCS Amb27226892 [0,1,0,0,0,0|2,0,0]=3 2912 B8R0.7 O=C(O)CCSCCBr Amb27468126 [0,1,0,0,0,0|2,0,0]=3 2913 B8R0.7 O=C(O)CCSCCF Amb27172860 [0,1,0,0,0,0|2,0,0]=3 2914 B8R0.7 O=C(O)CCSCCS Amb18126456 [0,1,0,0,0,0|2,0,0]=3 2915 B8R0.7 O=C(O)CNCCCCl Amb28055692 [0,1,0,0,0,0|2,0,0]=3 2916 B8R0.7 O=C(O)CNCCCF Amb27649256 [0,1,0,0,0,0|2,0,0]=3 2917 B8R0.7 O=C(O)CNCCCO Amb9325805 [0,1,0,0,0,0|2,0,0]=3 2918 B8R0.7 O=C(O)COCCCO Amb28288633 [0,1,0,0,0,0|2,0,0]=3 2919 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [0,1,0,0,0,0|1,0,2]=4 2920 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [0,1,0,0,0,0|1,0,2]=4 2921 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [0,1,0,0,0,0|1,0,2]=4 2922 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [0,1,0,0,0,0|1,0,2]=4 2923 B8R0.7 O=C([O-])CCCCCO Amb22491268 [0,1,0,0,0,0|1,0,0]=2 2924 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [0,1,0,0,0,0|2,0,1]=4 2925 B8R0.7 O=CCCCCC(=O)O Amb18642763 [0,1,0,0,0,0|1,0,1]=3 2926 B8R0.7 O=CNCCCC(=O)O Amb18305404 [0,1,0,0,0,0|2,0,1]=4 2927 B8R0.7 O=COCCCC(=O)O Amb27217713 [0,1,0,0,0,0|2,0,1]=4 2928 B8R0.7 O=S(Cl)CCCCCBr Amb32720461 [0,1,0,0,0,0|2,0,0]=3 2929 B8R0.7 O=S([O-])CCCCCBr Amb32755703 [0,1,0,0,0,0|2,0,0]=3 2930 B8R0.7 O=S([O-])CCCCCO Amb27394866 [0,1,0,0,0,0|2,0,0]=3 2931 B8R0.7 O=[N+]([O-])CCCCCO Amb25911225 [0,1,0,0,0,0|2,0,0]=3 2932 B8R0.7 O=[N+]([O-])CCSCCO Amb28045665 [0,1,0,0,0,0|3,0,0]=4 2933 B8R0.7 O=[N+]([O-])OCCCCBr Amb25951247 [0,1,0,0,0,0|3,0,0]=4 2934 B8R0.7 O=[N+]([O-])OCCCCO Amb21929397 [0,1,0,0,0,0|3,0,0]=4 2935 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,1,0,0,0,0|2,0,1]=4 2936 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,1,0,0,0,0|2,0,1]=4 2937 B8R0.7 OCCCCC=C(F)F Amb27225930 [0,1,0,0,0,0|2,0,1]=4 2938 B8R0.7 OCCCCCB(O)O Amb27614305 [0,1,0,0,0,0|2,0,1]=4 2939 B8R0.7 OCCCCSC(=S)S Amb28315412 [0,1,0,0,0,0|2,1,0]=4 2940 B8R0.7 [C-]#[N+]CCCCC(C)C Amb27963247 [0,1,0,0,0,0|1,0,2]=4 2941 B8R0.7 [C-]#[N+]CCCCN(C)C Amb33272274 [0,1,0,0,0,0|2,0,1]=4 2942 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,1,0,0,0,0|3,0,0]=4 2943 B8R0.8 C#CCCC(=C)C(C)=O Amb27433489 [0,1,0,0,0,0|0,0,3]=4 2944 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,1,0,0,0,0|1,0,2]=4 2945 B8R0.8 C#CCCC(C)C(N)=O Amb28341068 [0,1,0,0,0,0|1,0,2]=4 2946 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [0,1,0,0,0,0|1,0,2]=4 2947 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,1,0,0,0,0|1,0,2]=4 2948 B8R0.8 C#CCCC(O)C(N)=O Amb28057741 [0,1,0,0,0,0|1,0,2]=4 2949 B8R0.8 C#CCCN(C)C(C)=O Amb35601310 [0,1,0,0,0,0|1,0,2]=4 2950 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [0,1,0,0,0,0|1,0,2]=4 2951 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [0,1,0,0,0,0|1,0,2]=4 2952 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [0,1,0,0,0,0|1,0,2]=4 2953 B8R0.8 C=C(Br)C(O)CCCC Amb27978217 [0,1,0,0,0,0|1,0,1]=3 2954 B8R0.8 C=C(C)C(=O)CCCC Amb27968800 [0,1,0,0,0,0|1,0,1]=3 2955 B8R0.8 C=C(C)C(=O)CSCC Amb27950016 [0,1,0,0,0,0|2,0,1]=4 2956 B8R0.8 C=C(C)C(=O)NCCC Amb27204510 [0,1,0,0,0,0|2,0,1]=4 2957 B8R0.8 C=C(C)C(=O)OCCC Amb17933169 [0,1,0,0,0,0|2,0,1]=4 2958 B8R0.8 C=C(C)C(C)CCCO Amb28069648 [0,1,0,0,0,0|2,0,0]=3 2959 B8R0.8 C=C(C)C(Cl)CCCBr Amb27619001 [0,1,0,0,0,0|2,0,0]=3 2960 B8R0.8 C=C(C)C(Cl)CCCC Amb27433963 [0,1,0,0,0,0|1,0,0]=2 2961 B8R0.8 C=C(C)C(N)CSCC Amb27252910 [0,1,0,0,0,0|2,0,0]=3 2962 B8R0.8 C=C(C)C(O)C#CCC Amb27660888 [0,1,0,0,0,0|1,0,2]=4 2963 B8R0.8 C=C(C)C(O)CCCC Amb4037317 [0,1,0,0,0,0|1,0,0]=2 2964 B8R0.8 C=C(C)C(O)CCOC Amb27844656 [0,1,0,0,0,0|2,0,0]=3 2965 B8R0.8 C=C(C)C(O)CNCC Amb27814109 [0,1,0,0,0,0|2,0,0]=3 2966 B8R0.8 C=C(C)C(O)\C=C\CC Amb27651717 [0,1,0,0,0,0|1,0,2]=4 2967 B8R0.8 C=C(C)[C@H](O)CCCC Amb28205959 [0,1,0,0,0,0|1,0,0]=2 2968 B8R0.8 C=C(CCC#N)C(C)=O Amb27396468 [0,1,0,0,0,0|1,0,2]=4 2969 B8R0.8 C=C(CCC=O)C(C)=O Amb26006569 [0,1,0,0,0,0|1,0,2]=4 2970 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [0,1,0,0,0,0|1,0,1]=3 2971 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [0,1,0,0,0,0|0,0,1]=2 2972 B8R0.8 C=C(CCCC)C(C)O Amb27946944 [0,1,0,0,0,0|0,0,3]=4 2973 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,1,0,0,0,0|2,0,1]=4 2974 B8R0.8 C=C(CCCO)C(N)=O Amb27423225 [0,1,0,0,0,0|2,0,1]=4 2975 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,1,0,0,0,0|2,0,1]=4 2976 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [0,1,0,0,0,0|2,0,1]=4 2977 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,1,0,0,0,0|2,0,1]=4 2978 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [0,1,0,0,0,0|2,0,1]=4 2979 B8R0.8 C=C(Cl)C(O)CNCC Amb28342104 [0,1,0,0,0,0|2,0,1]=4 2980 B8R0.8 C=C(\C=C\CC)C(C)=O Amb25074493 [0,1,0,0,0,0|0,0,3]=4 2981 B8R0.8 C=CCCC(=C)C(C)=O Amb27834459 [0,1,0,0,0,0|0,0,3]=4 2982 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [0,1,0,0,0,0|1,0,2]=4 2983 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,1,0,0,0,0|1,0,2]=4 2984 B8R0.8 C=CCCC(C)C(C)=O Amb27470888 [0,1,0,0,0,0|0,0,2]=3 2985 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [0,1,0,0,0,0|1,0,2]=4 2986 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [0,1,0,0,0,0|1,0,2]=4 2987 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,1,0,0,0,0|1,0,2]=4 2988 B8R0.8 C=CCCC(O)C(=C)C Amb17593327 [0,1,0,0,0,0|1,0,2]=4 2989 B8R0.8 C=CCCN(C)C(C)=O Amb28370172 [0,1,0,0,0,0|1,0,2]=4 2990 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [0,1,0,0,0,0|1,0,2]=4 2991 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [0,1,0,0,0,0|1,0,2]=4 2992 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [0,1,0,0,0,0|1,0,2]=4 2993 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [0,1,0,0,0,0|1,0,2]=4 2994 B8R0.8 C=CCOC(C)C(C)=O Amb27837483 [0,1,0,0,0,0|1,0,2]=4 2995 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,1,0,0,0,0|1,0,2]=4 2996 B8R0.8 CC#CCC(C)C(C)=O Amb28049063 [0,1,0,0,0,0|0,0,2]=3 2997 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [0,1,0,0,0,0|1,0,2]=4 2998 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [0,1,0,0,0,0|1,0,2]=4 2999 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,1,0,0,0,0|1,0,2]=4 3000 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [0,1,0,0,0,0|1,0,2]=4 3001 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [0,1,0,0,0,0|1,0,2]=4 3002 B8R0.8 CC(=O)C(=O)CCC#N Amb27861249 [0,1,0,0,0,0|1,0,2]=4 3003 B8R0.8 CC(=O)C(=O)CCCBr Amb27955170 [0,1,0,0,0,0|1,0,1]=3 3004 B8R0.8 CC(=O)C(=O)CCCN Amb27666363 [0,1,0,0,0,0|1,0,1]=3 3005 B8R0.8 CC(=O)C(=O)NCCS Amb27391433 [0,1,0,0,0,0|2,0,1]=4 3006 B8R0.8 CC(=O)C(=O)OCCBr Amb27816166 [0,1,0,0,0,0|2,0,1]=4 3007 B8R0.8 CC(=O)C(C)CCC#N Amb8394545 [0,1,0,0,0,0|1,0,1]=3 3008 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [0,1,0,0,0,0|1,0,0]=2 3009 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,1,0,0,0,0|1,0,0]=2 3010 B8R0.8 CC(=O)C(C)CN=C=S Amb27836774 [0,1,0,0,0,0|2,0,1]=4 3011 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [0,1,0,0,0,0|2,0,0]=3 3012 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,1,0,0,0,0|1,0,0]=2 3013 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [0,1,0,0,0,0|1,0,1]=3 3014 B8R0.8 CC(=O)N(C)CCC#N Amb1035868 [0,1,0,0,0,0|2,0,1]=4 3015 B8R0.8 CC(=O)N(C)CCC=O Amb27985872 [0,1,0,0,0,0|2,0,1]=4 3016 B8R0.8 CC(=O)N(C)CCCBr Amb28189301 [0,1,0,0,0,0|2,0,0]=3 3017 B8R0.8 CC(=O)N(C)CCCN Amb32666496 [0,1,0,0,0,0|2,0,0]=3 3018 B8R0.8 CC(=O)N(C)CCCN Amb33533003 [0,1,0,0,0,0|2,0,0]=3 3019 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [0,1,0,0,0,0|2,0,0]=3 3020 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,1,0,0,0,0|1,0,0]=2 3021 B8R0.8 CC(=O)[C@H](C)CN=[N+]=[N-] Amb27832175 [0,1,0,0,0,0|3,0,0]=4 3022 B8R0.8 CC(Br)C(O)CCCO Amb27658525 [0,1,0,0,0,0|2,0,1]=4 3023 B8R0.8 CC(C)=C(C)CCCO Amb27456694 [0,1,0,0,0,0|2,0,1]=4 3024 B8R0.8 CC(C)C(C)CCCN Amb17569922 [0,1,0,0,0,0|2,0,1]=4 3025 B8R0.8 CC(C)C(O)CCCCl Amb27242357 [0,1,0,0,0,0|2,0,1]=4 3026 B8R0.8 CC(C)C(O)CCCN Amb18203175 [0,1,0,0,0,0|2,0,1]=4 3027 B8R0.8 CC(C)C(O)CCCO Amb27652039 [0,1,0,0,0,0|2,0,1]=4 3028 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,1,0,0,0,0|2,0,1]=4 3029 B8R0.8 CC(CCC#N)S(C)=O Amb29852641 [0,1,0,0,0,0|2,0,1]=4 3030 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,1,0,0,0,0|2,0,0]=3 3031 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,1,0,0,0,0|2,0,0]=3 3032 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,1,0,0,0,0|2,0,0]=3 3033 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,1,0,0,0,0|2,0,0]=3 3034 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [0,1,0,0,0,0|2,0,0]=3 3035 B8R0.8 CC(CCCN)N(C)C Amb17078915 [0,1,0,0,0,0|3,0,0]=4 3036 B8R0.8 CC(CCCO)N(C)C Amb27474182 [0,1,0,0,0,0|3,0,0]=4 3037 B8R0.8 CC(NCCF)C(N)=O Amb27453201 [0,1,0,0,0,0|3,0,0]=4 3038 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,1,0,0,0,0|3,0,0]=4 3039 B8R0.8 CC(NCCS)C(N)=O Amb27168964 [0,1,0,0,0,0|3,0,0]=4 3040 B8R0.8 CC(O)C(C)CCCF Amb28348330 [0,1,0,0,0,0|1,0,2]=4 3041 B8R0.8 CC(O)C(C)CCCO Amb28457820 [0,1,0,0,0,0|1,0,2]=4 3042 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,1,0,0,0,0|3,0,0]=4 3043 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,1,0,0,0,0|3,0,0]=4 3044 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,1,0,0,0,0|3,0,0]=4 3045 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,1,0,0,0,0|3,0,0]=4 3046 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,1,0,0,0,0|3,0,0]=4 3047 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,1,0,0,0,0|3,0,0]=4 3048 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [0,1,0,0,0,0|1,0,1]=3 3049 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [0,1,0,0,0,0|1,0,1]=3 3050 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [0,1,0,0,0,0|0,0,1]=2 3051 B8R0.8 CCCCC(=O)C(C)C Amb9024769 [0,1,0,0,0,0|1,0,2]=4 3052 B8R0.8 CCCCC(=O)C(C)Cl Amb17593705 [0,1,0,0,0,0|1,0,2]=4 3053 B8R0.8 CCCCC(=O)C(C)N Amb26583107 [0,1,0,0,0,0|1,0,2]=4 3054 B8R0.8 CCCCC(=O)[C@@H](C)O Amb25829551 [0,1,0,0,0,0|0,0,3]=4 3055 B8R0.8 CCCCC(=O)[C@H](C)O Amb25097116 [0,1,0,0,0,0|0,0,3]=4 3056 B8R0.8 CCCCC(=O)[C@H](C)[NH3+] Amb22503703 [0,1,0,0,0,0|1,0,2]=4 3057 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,1,0,0,0,0|1,0,0]=2 3058 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [0,1,0,0,0,0|1,0,0]=2 3059 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,1,0,0,0,0|1,0,0]=2 3060 B8R0.8 CCCCC(Br)C(C)O Amb27400344 [0,1,0,0,0,0|0,0,2]=3 3061 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,1,0,0,0,0|1,0,0]=2 3062 B8R0.8 CCCCC(Br)C(N)=S Amb27239240 [0,1,0,0,0,0|1,1,0]=3 3063 B8R0.8 CCCCC(C)=C(C)C Amb22228294 [0,1,0,0,0,0|1,0,1]=3 3064 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,1,0,0,0,0|1,0,0]=2 3065 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [0,1,0,0,0,0|0,0,0]=1 3066 B8R0.8 CCCCC(C)C(C)C Amb22228295 [0,1,0,0,0,0|1,0,1]=3 3067 B8R0.8 CCCCC(C)C(C)Cl Amb27164788 [0,1,0,0,0,0|1,0,1]=3 3068 B8R0.8 CCCCC(C)C(C)O Amb4017613 [0,1,0,0,0,0|0,0,2]=3 3069 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [0,1,0,0,0,0|1,0,0]=2 3070 B8R0.8 CCCCC(C)N(C)C Amb27837632 [0,1,0,0,0,0|2,0,0]=3 3071 B8R0.8 CCCCC(C)S(=O)Cl Amb32720495 [0,1,0,0,0,0|2,0,0]=3 3072 B8R0.8 CCCCC(C)S(=O)[O-] Amb32754844 [0,1,0,0,0,0|2,0,0]=3 3073 B8R0.8 CCCCC(C)S(N)=O Amb32720496 [0,1,0,0,0,0|2,0,0]=3 3074 B8R0.8 CCCCC(C)[N+](=O)[O-] Amb27229455 [0,1,0,0,0,0|2,0,0]=3 3075 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,1,0,0,0,0|1,0,0]=2 3076 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [0,1,0,0,0,0|1,0,0]=2 3077 B8R0.8 CCCCC(Cl)N(C)C Amb27867830 [0,1,0,0,0,0|2,0,0]=3 3078 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,1,0,0,0,0|1,0,0]=2 3079 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [0,1,0,0,0,0|0,0,0]=1 3080 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [0,1,0,0,0,0|1,0,0]=2 3081 B8R0.8 CCCCC(N)B(O)O Amb26622066 [0,1,0,0,0,0|2,0,1]=4 3082 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,1,0,0,0,0|1,0,0]=2 3083 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [0,1,0,0,0,0|0,0,0]=1 3084 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,1,0,0,0,0|0,0,0]=1 3085 B8R0.8 CCCCC(N)C(C)O Amb24351619 [0,1,0,0,0,0|0,0,2]=3 3086 B8R0.8 CCCCC(N)C(C)O Amb28935013 [0,1,0,0,0,0|0,0,2]=3 3087 B8R0.8 CCCCC(N)C(F)F Amb27852425 [0,1,0,0,0,0|2,0,1]=4 3088 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,1,0,0,0,0|1,0,0]=2 3089 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [0,1,0,0,0,0|2,0,0]=3 3090 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,1,0,0,0,0|1,0,0]=2 3091 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [0,1,0,0,0,0|0,0,0]=1 3092 B8R0.8 CCCCC(O)C(C)C Amb4017685 [0,1,0,0,0,0|1,0,1]=3 3093 B8R0.8 CCCCC(O)C(F)F Amb27780124 [0,1,0,0,0,0|2,0,1]=4 3094 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,1,0,0,0,0|1,0,0]=2 3095 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [0,1,0,0,0,0|2,0,0]=3 3096 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,1,0,0,0,0|1,0,0]=2 3097 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [0,1,0,0,0,0|2,0,0]=3 3098 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [0,1,0,0,0,0|2,0,0]=3 3099 B8R0.8 CCCCN(C)C(N)=S Amb6247550 [0,1,0,0,0,0|2,1,0]=4 3100 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [0,1,0,0,0,0|1,0,0]=2 3101 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,1,0,0,0,0|1,0,0]=2 3102 B8R0.8 CCCC[C@@H](C)[C@H](C)O Amb27763643 [0,1,0,0,0,0|0,0,2]=3 3103 B8R0.8 CCCC[C@@H](Cl)B(O)O Amb27657838 [0,1,0,0,0,0|2,0,1]=4 3104 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,1,0,0,0,0|1,0,0]=2 3105 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,1,0,0,0,0|1,0,0]=2 3106 B8R0.8 CCCC[C@@H](O)C(C)C Amb27474121 [0,1,0,0,0,0|1,0,1]=3 3107 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,1,0,0,0,0|1,0,0]=2 3108 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,1,0,0,0,0|1,0,0]=2 3109 B8R0.8 CCCC[C@H](C)[C@@H](C)N Amb27851649 [0,1,0,0,0,0|1,0,1]=3 3110 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [0,1,0,0,0,0|1,0,0]=2 3111 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,1,0,0,0,0|1,0,0]=2 3112 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,1,0,0,0,0|1,0,0]=2 3113 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [0,1,0,0,0,0|1,0,0]=2 3114 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,1,0,0,0,0|1,0,0]=2 3115 B8R0.8 CCCC[C@H](O)[C@@H](C)O Amb28139279 [0,1,0,0,0,0|0,0,2]=3 3116 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,1,0,0,0,0|2,0,1]=4 3117 B8R0.8 CCCNC(=O)C(C)=O Amb17399819 [0,1,0,0,0,0|1,0,1]=3 3118 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,1,0,0,0,0|2,0,0]=3 3119 B8R0.8 CCCNC(C)C(C)C Amb21959690 [0,1,0,0,0,0|2,0,1]=4 3120 B8R0.8 CCCNC(C)C(C)C Amb9724088 [0,1,0,0,0,0|2,0,1]=4 3121 B8R0.8 CCCNC(C)C(C)N Amb27834964 [0,1,0,0,0,0|2,0,1]=4 3122 B8R0.8 CCCNC(C)C(C)S Amb18644349 [0,1,0,0,0,0|1,1,1]=4 3123 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,1,0,0,0,0|2,0,0]=3 3124 B8R0.8 CCCOC(=O)C(=O)Cl Amb27164480 [0,1,0,0,0,0|2,0,1]=4 3125 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [0,1,0,0,0,0|2,0,1]=4 3126 B8R0.8 CCCOC(=O)C(C)=O Amb25838665 [0,1,0,0,0,0|1,0,1]=3 3127 B8R0.8 CCCOC(C)C(=N)N Amb28049083 [0,1,0,0,0,0|3,0,0]=4 3128 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,1,0,0,0,0|2,0,0]=3 3129 B8R0.8 CCCOC(C)C(C)N Amb18306548 [0,1,0,0,0,0|2,0,1]=4 3130 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [0,1,0,0,0,0|2,0,0]=3 3131 B8R0.8 CCCOC(C)[C@@H](C)N Amb27828248 [0,1,0,0,0,0|2,0,1]=4 3132 B8R0.8 CCCOC(C)[C@@H](C)O Amb27869773 [0,1,0,0,0,0|1,0,2]=4 3133 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [0,1,0,0,0,0|2,0,1]=4 3134 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,1,0,0,0,0|2,0,0]=3 3135 B8R0.8 CCCSC(C)C(C)C Amb28429774 [0,1,0,0,0,0|2,0,1]=4 3136 B8R0.8 CCCSC(C)C(C)O Amb27482489 [0,1,0,0,0,0|1,0,2]=4 3137 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [0,1,0,0,0,0|2,0,0]=3 3138 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,1,0,0,0,0|2,0,0]=3 3139 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,1,0,0,0,0|2,0,0]=3 3140 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,1,0,0,0,0|2,0,0]=3 3141 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [0,1,0,0,0,0|1,0,2]=4 3142 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,1,0,0,0,0|1,0,2]=4 3143 B8R0.8 CCC\C=C(/C)C(C)=O Amb17593317 [0,1,0,0,0,0|0,0,2]=3 3144 B8R0.8 CCC\C=C(/F)C(C)=O Amb27227052 [0,1,0,0,0,0|0,0,2]=3 3145 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [0,1,0,0,0,0|1,0,2]=4 3146 B8R0.8 CCC\N=C(\C)C(C)=O Amb28255004 [0,1,0,0,0,0|1,0,1]=3 3147 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,1,0,0,0,0|2,0,0]=3 3148 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,1,0,0,0,0|2,0,0]=3 3149 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [0,1,0,0,0,0|2,0,0]=3 3150 B8R0.8 CCNCC(Cl)C(C)C Amb27602000 [0,1,0,0,0,0|2,0,1]=4 3151 B8R0.8 CCNCC(N)C(C)C Amb19009736 [0,1,0,0,0,0|2,0,1]=4 3152 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [0,1,0,0,0,0|2,0,0]=3 3153 B8R0.8 CCNC[C@@H](N)C(C)C Amb27262001 [0,1,0,0,0,0|2,0,1]=4 3154 B8R0.8 CCNC[C@H](N)C(C)C Amb27956498 [0,1,0,0,0,0|2,0,1]=4 3155 B8R0.8 CCN\C=C(\C)C(C)=O Amb27469636 [0,1,0,0,0,0|1,0,2]=4 3156 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [0,1,0,0,0,0|2,0,0]=3 3157 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,1,0,0,0,0|2,0,0]=3 3158 B8R0.8 CCOCC(C)C(C)Cl Amb27777113 [0,1,0,0,0,0|2,0,1]=4 3159 B8R0.8 CCOCC(C)C(C)O Amb24529048 [0,1,0,0,0,0|1,0,2]=4 3160 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [0,1,0,0,0,0|2,0,0]=3 3161 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [0,1,0,0,0,0|2,0,0]=3 3162 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [0,1,0,0,0,0|2,0,0]=3 3163 B8R0.8 CCOCC(N)C(C)C Amb21954013 [0,1,0,0,0,0|2,0,1]=4 3164 B8R0.8 CCOCC(N)C(C)C Amb27196237 [0,1,0,0,0,0|2,0,1]=4 3165 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [0,1,0,0,0,0|2,0,0]=3 3166 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,1,0,0,0,0|2,0,0]=3 3167 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [0,1,0,0,0,0|2,0,0]=3 3168 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [0,1,0,0,0,0|2,0,0]=3 3169 B8R0.8 CCOC[C@@H](N)C(C)C Amb17061643 [0,1,0,0,0,0|2,0,1]=4 3170 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [0,1,0,0,0,0|2,0,0]=3 3171 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,1,0,0,0,0|2,0,0]=3 3172 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [0,1,0,0,0,0|2,0,0]=3 3173 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [0,1,0,0,0,0|2,0,0]=3 3174 B8R0.8 CCONC(C)C(N)=O Amb27228322 [0,1,0,0,0,0|3,0,0]=4 3175 B8R0.8 CCO\C=C(/Br)C(C)=O Amb8393391 [0,1,0,0,0,0|1,0,2]=4 3176 B8R0.8 CCO\C=C(/C)C(C)=O Amb26853746 [0,1,0,0,0,0|1,0,2]=4 3177 B8R0.8 CCO\C=C(\O)C(C)=O Amb27486167 [0,1,0,0,0,0|1,0,2]=4 3178 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,1,0,0,0,0|2,0,0]=3 3179 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [0,1,0,0,0,0|1,0,0]=2 3180 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [0,1,0,0,0,0|2,0,0]=3 3181 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [0,1,0,0,0,0|2,0,0]=3 3182 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [0,1,0,0,0,0|2,0,0]=3 3183 B8R0.8 CC\C=C/C(O)C(C)=O Amb28122622 [0,1,0,0,0,0|0,0,2]=3 3184 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,1,0,0,0,0|1,0,2]=4 3185 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,1,0,0,0,0|0,0,2]=3 3186 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,1,0,0,0,0|1,0,2]=4 3187 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,1,0,0,0,0|1,0,2]=4 3188 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,1,0,0,0,0|1,0,2]=4 3189 B8R0.8 CN(CCCBr)C(=O)Cl Amb33296940 [0,1,0,0,0,0|3,0,0]=4 3190 B8R0.8 CN(CCCCl)C(=O)Cl Amb32668823 [0,1,0,0,0,0|3,0,0]=4 3191 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [0,1,0,0,0,0|2,0,0]=3 3192 B8R0.8 CNCCC(N)C(C)C Amb27952651 [0,1,0,0,0,0|2,0,1]=4 3193 B8R0.8 CNCCN(C)C(=O)S Amb27473520 [0,1,0,0,0,0|3,0,0]=4 3194 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,1,0,0,0,0|2,0,0]=3 3195 B8R0.8 CNCCN(C)C(N)=O Amb27765294 [0,1,0,0,0,0|3,0,0]=4 3196 B8R0.8 CNCCN(C)C(N)=O Amb32674843 [0,1,0,0,0,0|3,0,0]=4 3197 B8R0.8 CNCCN(C)S(C)=O Amb27186394 [0,1,0,0,0,0|3,0,0]=4 3198 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,1,0,0,0,0|2,0,1]=4 3199 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [0,1,0,0,0,0|2,0,0]=3 3200 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,1,0,0,0,0|2,0,0]=3 3201 B8R0.8 COCCC(C)S(=O)Cl Amb32720499 [0,1,0,0,0,0|3,0,0]=4 3202 B8R0.8 COCCC(C)S(=O)[O-] Amb32754663 [0,1,0,0,0,0|3,0,0]=4 3203 B8R0.8 COCCC(C)S(N)=O Amb32720500 [0,1,0,0,0,0|3,0,0]=4 3204 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [0,1,0,0,0,0|2,0,0]=3 3205 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [0,1,0,0,0,0|2,0,0]=3 3206 B8R0.8 COCCC(N)C(=O)O Amb32675454 [0,1,0,0,0,0|2,0,0]=3 3207 B8R0.8 COCCC(N)C(=O)O Amb6281324 [0,1,0,0,0,0|2,0,0]=3 3208 B8R0.8 COCCC(N)C(C)C Amb18523844 [0,1,0,0,0,0|2,0,1]=4 3209 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,1,0,0,0,0|2,0,0]=3 3210 B8R0.8 COCCC(N)C(N)=O Amb32712112 [0,1,0,0,0,0|2,0,0]=3 3211 B8R0.8 COCCC(O)C(=O)O Amb27647966 [0,1,0,0,0,0|2,0,0]=3 3212 B8R0.8 COCCC(O)C(C)C Amb20622333 [0,1,0,0,0,0|2,0,1]=4 3213 B8R0.8 COCCN(C)C(=O)Cl Amb27595784 [0,1,0,0,0,0|3,0,0]=4 3214 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,1,0,0,0,0|3,0,0]=4 3215 B8R0.8 COCCN(C)C(N)=O Amb27475656 [0,1,0,0,0,0|3,0,0]=4 3216 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [0,1,0,0,0,0|2,0,0]=3 3217 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [0,1,0,0,0,0|2,0,0]=3 3218 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [0,1,0,0,0,0|2,0,0]=3 3219 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,1,0,0,0,0|3,0,0]=4 3220 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,1,0,0,0,0|2,0,0]=3 3221 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,1,0,0,0,0|3,0,0]=4 3222 B8R0.8 COCSC(C)C(C)=O Amb28189229 [0,1,0,0,0,0|2,0,0]=3 3223 B8R0.8 COC\C=C(/C)C(C)=O Amb27838769 [0,1,0,0,0,0|1,0,2]=4 3224 B8R0.8 CONCC(N)C(N)=O Amb27216151 [0,1,0,0,0,0|3,0,0]=4 3225 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [0,1,0,0,0,0|3,0,0]=4 3226 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [0,1,0,0,0,0|2,0,1]=4 3227 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [0,1,0,0,0,0|2,0,1]=4 3228 B8R0.8 CSCCC(=O)C(N)=O Amb28042492 [0,1,0,0,0,0|2,0,1]=4 3229 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,1,0,0,0,0|2,0,0]=3 3230 B8R0.8 CSCCC(C)C(C)Br Amb28141386 [0,1,0,0,0,0|2,0,1]=4 3231 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [0,1,0,0,0,0|2,0,0]=3 3232 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,1,0,0,0,0|2,0,0]=3 3233 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [0,1,0,0,0,0|2,0,0]=3 3234 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [0,1,0,0,0,0|1,0,0]=2 3235 B8R0.8 CSCCC(N)C(C)C Amb27763912 [0,1,0,0,0,0|2,0,1]=4 3236 B8R0.8 CSCCC(N)C(C)O Amb27655583 [0,1,0,0,0,0|1,0,2]=4 3237 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [0,1,0,0,0,0|2,0,0]=3 3238 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [0,1,0,0,0,0|2,0,0]=3 3239 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [0,1,0,0,0,0|2,0,0]=3 3240 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [0,1,0,0,0,0|2,0,0]=3 3241 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,1,0,0,0,0|2,0,0]=3 3242 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [0,1,0,0,0,0|2,0,0]=3 3243 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [0,1,0,0,0,0|2,0,0]=3 3244 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,1,0,0,0,0|2,0,0]=3 3245 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,1,0,0,0,0|2,0,0]=3 3246 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [0,1,0,0,0,0|2,0,0]=3 3247 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [0,1,0,0,0,0|2,0,0]=3 3248 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [0,1,0,0,0,0|2,0,0]=3 3249 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [0,1,0,0,0,0|1,0,0]=2 3250 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [0,1,0,0,0,0|2,0,0]=3 3251 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [0,1,0,0,0,0|2,0,0]=3 3252 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [0,1,0,0,0,0|2,0,0]=3 3253 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [0,1,0,0,0,0|3,0,0]=4 3254 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [0,1,0,0,0,0|3,0,0]=4 3255 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [0,1,0,0,0,0|3,0,0]=4 3256 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,1,0,0,0,0|3,0,0]=4 3257 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [0,1,0,0,0,0|3,0,0]=4 3258 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [0,1,0,0,0,0|3,0,0]=4 3259 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,1,0,0,0,0|2,0,1]=4 3260 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,1,0,0,0,0|2,0,0]=3 3261 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,1,0,0,0,0|3,0,0]=4 3262 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,1,0,0,0,0|3,0,0]=4 3263 B8R0.8 C[C@@H](O)[C@H](O)CCCO Amb27982574 [0,1,0,0,0,0|1,0,2]=4 3264 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,1,0,0,0,0|3,0,0]=4 3265 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,1,0,0,0,0|3,0,0]=4 3266 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,1,0,0,0,0|3,0,0]=4 3267 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,1,0,0,0,0|3,0,0]=4 3268 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,1,0,0,0,0|3,0,0]=4 3269 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,1,0,0,0,0|3,0,0]=4 3270 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [0,1,0,0,0,0|2,0,0]=3 3271 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [0,1,0,0,0,0|2,0,0]=3 3272 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [0,1,0,0,0,0|2,0,0]=3 3273 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,1,0,0,0,0|1,0,2]=4 3274 B8R0.8 C\C=C\CC(C)C(C)=O Amb27799374 [0,1,0,0,0,0|0,0,2]=3 3275 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,1,0,0,0,0|1,0,2]=4 3276 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,1,0,0,0,0|1,0,2]=4 3277 B8R0.8 C\C=C\CC(N)C(N)=O Amb26904386 [0,1,0,0,0,0|1,0,2]=4 3278 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [0,1,0,0,0,0|0,0,2]=3 3279 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,1,0,0,0,0|1,0,2]=4 3280 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,1,0,0,0,0|1,0,2]=4 3281 B8R0.8 C\C=C\C[C@H](C)C(C)=O Amb26891739 [0,1,0,0,0,0|0,0,2]=3 3282 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,1,0,0,0,0|1,0,2]=4 3283 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [0,1,0,0,0,0|2,0,1]=4 3284 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [0,1,0,0,0,0|2,0,1]=4 3285 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [0,1,0,0,0,0|2,0,1]=4 3286 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [0,1,0,0,0,0|2,0,1]=4 3287 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [0,1,0,0,0,0|2,0,1]=4 3288 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [0,1,0,0,0,0|2,0,1]=4 3289 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [0,1,0,0,0,0|2,0,1]=4 3290 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [0,1,0,0,0,0|2,0,1]=4 3291 B8R0.8 NC(=O)C(=O)CCCCl Amb27450674 [0,1,0,0,0,0|2,0,1]=4 3292 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [0,1,0,0,0,0|2,0,0]=3 3293 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,1,0,0,0,0|2,0,0]=3 3294 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,1,0,0,0,0|2,0,0]=3 3295 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,1,0,0,0,0|2,0,0]=3 3296 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,1,0,0,0,0|2,0,0]=3 3297 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,1,0,0,0,0|2,0,0]=3 3298 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,1,0,0,0,0|2,0,0]=3 3299 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,1,0,0,0,0|3,0,0]=4 3300 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,1,0,0,0,0|2,0,0]=3 3301 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,1,0,0,0,0|2,0,0]=3 3302 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,1,0,0,0,0|2,0,0]=3 3303 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,1,0,0,0,0|2,0,0]=3 3304 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,1,0,0,0,0|2,0,0]=3 3305 B8R0.8 NCCCC(N)C(=S)S Amb27657930 [0,1,0,0,0,0|2,1,0]=4 3306 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,1,0,0,0,0|2,0,0]=3 3307 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [0,1,0,0,0,0|3,0,0]=4 3308 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,1,0,0,0,0|2,0,0]=3 3309 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,1,0,0,0,0|2,0,0]=3 3310 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,1,0,0,0,0|2,0,0]=3 3311 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,1,0,0,0,0|2,0,0]=3 3312 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,1,0,0,0,0|2,0,0]=3 3313 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,1,0,0,0,0|2,0,0]=3 3314 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,1,0,0,0,0|2,0,0]=3 3315 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,1,0,0,0,0|2,0,0]=3 3316 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [0,1,0,0,0,0|3,0,0]=4 3317 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [0,1,0,0,0,0|3,0,0]=4 3318 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [0,1,0,0,0,0|3,0,0]=4 3319 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [0,1,0,0,0,0|3,0,0]=4 3320 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [0,1,0,0,0,0|3,0,0]=4 3321 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [0,1,0,0,0,0|3,0,0]=4 3322 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,1,0,0,0,0|2,0,0]=3 3323 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,1,0,0,0,0|2,0,0]=3 3324 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,1,0,0,0,0|2,0,0]=3 3325 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,1,0,0,0,0|3,0,0]=4 3326 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,1,0,0,0,0|3,0,0]=4 3327 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,1,0,0,0,0|2,0,0]=3 3328 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,1,0,0,0,0|2,0,0]=3 3329 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,1,0,0,0,0|2,0,0]=3 3330 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,1,0,0,0,0|2,0,0]=3 3331 B8R0.8 O=C(Cl)C(=O)CCCBr Amb28313649 [0,1,0,0,0,0|2,0,1]=4 3332 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [0,1,0,0,0,0|2,0,1]=4 3333 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,1,0,0,0,0|2,0,1]=4 3334 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,1,0,0,0,0|2,0,1]=4 3335 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,1,0,0,0,0|2,0,0]=3 3336 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,1,0,0,0,0|2,0,0]=3 3337 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,1,0,0,0,0|2,0,0]=3 3338 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,1,0,0,0,0|2,0,0]=3 3339 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,1,0,0,0,0|2,0,0]=3 3340 B8R0.9 C#CC(=C)CCC(C)=O Amb27179805 [0,1,0,0,0,0|0,0,3]=4 3341 B8R0.9 C#CC(Br)COC(C)=O Amb27776759 [0,1,0,0,0,0|1,0,2]=4 3342 B8R0.9 C#CC(C)CCC(N)=O Amb27602261 [0,1,0,0,0,0|1,0,2]=4 3343 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,1,0,0,0,0|1,0,2]=4 3344 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,1,0,0,0,0|1,0,2]=4 3345 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,1,0,0,0,0|2,0,1]=4 3346 B8R0.9 C=C(C)CCC(C)CBr Amb27794197 [0,1,0,0,0,0|2,0,0]=3 3347 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,1,0,0,0,0|2,0,0]=3 3348 B8R0.9 C=C(C)CCC(C)NC Amb27452757 [0,1,0,0,0,0|2,0,0]=3 3349 B8R0.9 C=C(C)CCC(N)CC Amb27395082 [0,1,0,0,0,0|1,0,0]=2 3350 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,1,0,0,0,0|2,0,0]=3 3351 B8R0.9 C=C(C)CCC(O)CO Amb28315440 [0,1,0,0,0,0|2,0,0]=3 3352 B8R0.9 C=C(C)CNC(C)CC Amb17308623 [0,1,0,0,0,0|2,0,0]=3 3353 B8R0.9 C=C(C)CNC(C)CN Amb27166201 [0,1,0,0,0,0|3,0,0]=4 3354 B8R0.9 C=C(C)COC(=O)CC Amb25345772 [0,1,0,0,0,0|2,0,1]=4 3355 B8R0.9 C=C(C)COC(C)CN Amb18630505 [0,1,0,0,0,0|3,0,0]=4 3356 B8R0.9 C=C(C)CSC(C)CC Amb27615012 [0,1,0,0,0,0|2,0,0]=3 3357 B8R0.9 C=C(C)CSC(C)CO Amb28046498 [0,1,0,0,0,0|3,0,0]=4 3358 B8R0.9 C=C(C)OCC(O)CO Amb28315423 [0,1,0,0,0,0|3,0,0]=4 3359 B8R0.9 C=C(C)\C=C\C(O)CC Amb28318574 [0,1,0,0,0,0|1,0,2]=4 3360 B8R0.9 C=C(CC)CNC(C)=O Amb27985317 [0,1,0,0,0,0|1,0,1]=3 3361 B8R0.9 C=C(CC)CNC(N)=O Amb28342560 [0,1,0,0,0,0|2,0,1]=4 3362 B8R0.9 C=C(CC)OCC(C)=O Amb27227543 [0,1,0,0,0,0|1,0,1]=3 3363 B8R0.9 C=C(CS)SCC(C)=O Amb27844241 [0,1,0,0,0,0|2,0,1]=4 3364 B8R0.9 C=C(Cl)CSC(C)CC Amb28062133 [0,1,0,0,0,0|2,0,1]=4 3365 B8R0.9 C=C(\C=C\C(C)=O)CC Amb26492679 [0,1,0,0,0,0|0,0,3]=4 3366 B8R0.9 C=CC(C)CCC(C)=O Amb26390728 [0,1,0,0,0,0|0,0,2]=3 3367 B8R0.9 C=CC(C)SCC(C)=O Amb27837610 [0,1,0,0,0,0|1,0,2]=4 3368 B8R0.9 C=CC(Cl)COC(C)=O Amb27860523 [0,1,0,0,0,0|1,0,2]=4 3369 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,1,0,0,0,0|1,0,2]=4 3370 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,1,0,0,0,0|1,0,2]=4 3371 B8R0.9 C=CC(O)CCC(=C)C Amb27163616 [0,1,0,0,0,0|1,0,2]=4 3372 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,1,0,0,0,0|1,0,2]=4 3373 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,1,0,0,0,0|1,0,2]=4 3374 B8R0.9 C=C[C@@H](O)CCC(=C)C Amb27589736 [0,1,0,0,0,0|1,0,2]=4 3375 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,1,0,0,0,0|1,0,2]=4 3376 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,1,0,0,0,0|1,0,2]=4 3377 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,1]=4 3378 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,1,0,0,0,0|2,0,1]=4 3379 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [0,1,0,0,0,0|1,0,1]=3 3380 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,1,0,0,0,0|1,0,0]=2 3381 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,1,0,0,0,0|1,0,0]=2 3382 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,1,0,0,0,0|1,0,0]=2 3383 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,0|1,0,0]=2 3384 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,1,0,0,0,0|1,0,0]=2 3385 B8R0.9 CC(=O)CCN(C)C=O Amb27802453 [0,1,0,0,0,0|2,0,1]=4 3386 B8R0.9 CC(=O)CCN(C)N=O Amb28364300 [0,1,0,0,0,0|3,0,0]=4 3387 B8R0.9 CC(=O)CNC(=O)CCl Amb27880921 [0,1,0,0,0,0|2,0,1]=4 3388 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,0|2,0,1]=4 3389 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,1,0,0,0,0|2,0,0]=3 3390 B8R0.9 CC(=O)COC(=O)CN Amb27168864 [0,1,0,0,0,0|2,0,1]=4 3391 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,1,0,0,0,0|2,0,0]=3 3392 B8R0.9 CC(=O)NCC(=O)CN Amb35789045 [0,1,0,0,0,0|2,0,1]=4 3393 B8R0.9 CC(=O)NCC(=O)CN Amb35789904 [0,1,0,0,0,0|2,0,1]=4 3394 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,1,0,0,0,0|2,0,1]=4 3395 B8R0.9 CC(=O)NCC(C)C=O Amb27485699 [0,1,0,0,0,0|2,0,1]=4 3396 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,1,0,0,0,0|2,0,0]=3 3397 B8R0.9 CC(=O)NCC(C)ON Amb17138377 [0,1,0,0,0,0|3,0,0]=4 3398 B8R0.9 CC(=O)NCC(N)NO Amb27413098 [0,1,0,0,0,0|3,0,0]=4 3399 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,1,0,0,0,0|2,0,0]=3 3400 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,0|2,0,0]=3 3401 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,1,0,0,0,0|2,0,1]=4 3402 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,1,0,0,0,0|2,0,1]=4 3403 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,1,0,0,0,0|2,0,1]=4 3404 B8R0.9 CC(=O)OCC(C)CBr Amb22386917 [0,1,0,0,0,0|2,0,0]=3 3405 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,1,0,0,0,0|2,0,0]=3 3406 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,1,0,0,0,0|2,0,0]=3 3407 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,1,0,0,0,0|2,0,0]=3 3408 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,0|2,0,0]=3 3409 B8R0.9 CC(=O)OCC(S)CCl Amb28056223 [0,1,0,0,0,0|2,0,0]=3 3410 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,1,0,0,0,0|2,0,0]=3 3411 B8R0.9 CC(=O)OC[C@H](C)C=O Amb27230590 [0,1,0,0,0,0|2,0,1]=4 3412 B8R0.9 CC(=O)OC[C@H](C)CBr Amb28385279 [0,1,0,0,0,0|2,0,0]=3 3413 B8R0.9 CC(=O)SCC(C)C=O Amb27827463 [0,1,0,0,0,0|2,0,1]=4 3414 B8R0.9 CC(=O)SCC(C)CCl Amb4605870 [0,1,0,0,0,0|2,0,0]=3 3415 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,1,0,0,0,0|2,0,0]=3 3416 B8R0.9 CC(C)=CC[C@@H](C)CO Amb27619671 [0,1,0,0,0,0|2,0,1]=4 3417 B8R0.9 CC(C)CCC(C)CBr Amb26565964 [0,1,0,0,0,0|2,0,1]=4 3418 B8R0.9 CC(C)CCC(C)CCl Amb25774761 [0,1,0,0,0,0|2,0,1]=4 3419 B8R0.9 CC(C)CCC(C)CN Amb8950152 [0,1,0,0,0,0|2,0,1]=4 3420 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,1,0,0,0,0|2,0,1]=4 3421 B8R0.9 CC(C)CCC(F)CO Amb28315415 [0,1,0,0,0,0|2,0,1]=4 3422 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,1,0,0,0,0|2,0,1]=4 3423 B8R0.9 CC(C)CCC(N)CO Amb28960290 [0,1,0,0,0,0|2,0,1]=4 3424 B8R0.9 CC(C)CCC(O)CCl Amb27473402 [0,1,0,0,0,0|2,0,1]=4 3425 B8R0.9 CC(C)CCC(O)CN Amb28282095 [0,1,0,0,0,0|2,0,1]=4 3426 B8R0.9 CC(C)CC[C@@H](C)CN Amb33747730 [0,1,0,0,0,0|2,0,1]=4 3427 B8R0.9 CC(C)CC[C@@H](C)CO Amb27156839 [0,1,0,0,0,0|2,0,1]=4 3428 B8R0.9 CC(C)CC[C@H](C)CN Amb33747151 [0,1,0,0,0,0|2,0,1]=4 3429 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,1,0,0,0,0|2,0,1]=4 3430 B8R0.9 CC(C)CC[C@H](O)CO Amb28315482 [0,1,0,0,0,0|2,0,1]=4 3431 B8R0.9 CC(CBr)CCN(C)C Amb33007680 [0,1,0,0,0,0|3,0,0]=4 3432 B8R0.9 CC(CBr)CCS(C)=O Amb26630308 [0,1,0,0,0,0|2,0,0]=3 3433 B8R0.9 CC(CBr)COC(N)=O Amb27879004 [0,1,0,0,0,0|3,0,0]=4 3434 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,1,0,0,0,0|3,0,0]=4 3435 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,1,0,0,0,0|2,0,0]=3 3436 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,1,0,0,0,0|2,0,0]=3 3437 B8R0.9 CC(CCl)CCS(C)=O Amb26541793 [0,1,0,0,0,0|2,0,0]=3 3438 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,1,0,0,0,0|2,0,0]=3 3439 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,1,0,0,0,0|2,0,0]=3 3440 B8R0.9 CC(CN)CCN(C)C Amb17334118 [0,1,0,0,0,0|3,0,0]=4 3441 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,1,0,0,0,0|2,0,0]=3 3442 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,1,0,0,0,0|3,0,0]=4 3443 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,1,0,0,0,0|3,0,0]=4 3444 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,1,0,0,0,0|3,0,0]=4 3445 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,1,0,0,0,0|3,0,0]=4 3446 B8R0.9 CC(CO)CCS(C)=O Amb27815628 [0,1,0,0,0,0|2,0,0]=3 3447 B8R0.9 CC(CO)CC[C@H](C)O Amb28207320 [0,1,0,0,0,0|1,0,2]=4 3448 B8R0.9 CC(CO)CC[N+](=O)[O-] Amb27481503 [0,1,0,0,0,0|3,0,0]=4 3449 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|3,0,0]=4 3450 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,1,0,0,0,0|3,0,0]=4 3451 B8R0.9 CC(O)CCC(C)CO Amb27218004 [0,1,0,0,0,0|1,0,2]=4 3452 B8R0.9 CCC(=N)NCC(N)=O Amb28049684 [0,1,0,0,0,0|2,0,1]=4 3453 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,1,0,0,0,0|2,0,1]=4 3454 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,1]=3 3455 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,1,0,0,0,0|0,0,1]=2 3456 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,1,0,0,0,0|1,0,2]=4 3457 B8R0.9 CCC(=O)CCC(C)N Amb27866596 [0,1,0,0,0,0|1,0,2]=4 3458 B8R0.9 CCC(=O)COC(C)=O Amb3940673 [0,1,0,0,0,0|1,0,1]=3 3459 B8R0.9 CCC(=O)CSC(C)=O Amb27180933 [0,1,0,0,0,0|1,0,1]=3 3460 B8R0.9 CCC(=O)C\C=C(/C)Cl Amb27838754 [0,1,0,0,0,0|1,0,2]=4 3461 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|2,0,1]=4 3462 B8R0.9 CCC(=O)NCC(N)=O Amb17231864 [0,1,0,0,0,0|2,0,1]=4 3463 B8R0.9 CCC(=O)OCC(C)=O Amb27662511 [0,1,0,0,0,0|1,0,1]=3 3464 B8R0.9 CCC(=O)OCC(N)=O Amb26505774 [0,1,0,0,0,0|2,0,1]=4 3465 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,1,0,0,0,0|1,0,0]=2 3466 B8R0.9 CCC(Br)COC(C)=O Amb26916647 [0,1,0,0,0,0|1,0,0]=2 3467 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,1,0,0,0,0|1,0,2]=4 3468 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,1,0,0,0,0|2,0,1]=4 3469 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,1,0,0,0,0|1,0,0]=2 3470 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|0,0,0]=1 3471 B8R0.9 CCC(C)CCC(C)Br Amb19078823 [0,1,0,0,0,0|1,0,1]=3 3472 B8R0.9 CCC(C)CCC(C)C Amb22228305 [0,1,0,0,0,0|1,0,1]=3 3473 B8R0.9 CCC(C)CCC(C)N Amb26637268 [0,1,0,0,0,0|1,0,1]=3 3474 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,1,0,0,0,0|0,0,2]=3 3475 B8R0.9 CCC(C)CCN(C)C Amb27233760 [0,1,0,0,0,0|2,0,0]=3 3476 B8R0.9 CCC(C)CC[C@@H](C)N Amb33318484 [0,1,0,0,0,0|1,0,1]=3 3477 B8R0.9 CCC(C)CC[C@@H](C)O Amb26485746 [0,1,0,0,0,0|0,0,2]=3 3478 B8R0.9 CCC(C)CC[C@H](C)N Amb33318483 [0,1,0,0,0,0|1,0,1]=3 3479 B8R0.9 CCC(C)CC[C@H](C)O Amb33318485 [0,1,0,0,0,0|0,0,2]=3 3480 B8R0.9 CCC(C)CC[N+](=O)[O-] Amb33226911 [0,1,0,0,0,0|2,0,0]=3 3481 B8R0.9 CCC(C)CNC(=O)Cl Amb29881345 [0,1,0,0,0,0|2,0,0]=3 3482 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,1,0,0,0,0|1,0,0]=2 3483 B8R0.9 CCC(C)CNC(N)=O Amb27258807 [0,1,0,0,0,0|2,0,0]=3 3484 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,0|2,0,0]=3 3485 B8R0.9 CCC(C)COC(C)Cl Amb32715990 [0,1,0,0,0,0|2,0,1]=4 3486 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,1,0,0,0,0|2,0,0]=3 3487 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,1,0,0,0,0|2,0,0]=3 3488 B8R0.9 CCC(C)NCC(C)C Amb6685798 [0,1,0,0,0,0|2,0,1]=4 3489 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,1,0,0,0,0|2,0,0]=3 3490 B8R0.9 CCC(C)NC[C@@H](C)O Amb27184367 [0,1,0,0,0,0|1,0,2]=4 3491 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,1,0,0,0,0|2,0,0]=3 3492 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,1,0,0,0,0|1,0,0]=2 3493 B8R0.9 CCC(C)OCC(C)O Amb28207569 [0,1,0,0,0,0|1,0,2]=4 3494 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,1,0,0,0,0|2,0,0]=3 3495 B8R0.9 CCC(C)OC[C@H](C)O Amb27869786 [0,1,0,0,0,0|1,0,2]=4 3496 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,1,0,0,0,0|2,0,0]=3 3497 B8R0.9 CCC(C)SCC(C)N Amb27167068 [0,1,0,0,0,0|2,0,1]=4 3498 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,1,0,0,0,0|2,0,0]=3 3499 B8R0.9 CCC(C)SC[C@@H](C)N Amb27607392 [0,1,0,0,0,0|2,0,1]=4 3500 B8R0.9 CCC(C)SC[C@H](C)O Amb28248745 [0,1,0,0,0,0|1,0,2]=4 3501 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,1,0,0,0,0|1,0,2]=4 3502 B8R0.9 CCC(C)\C=C\C(C)=O Amb24062970 [0,1,0,0,0,0|0,0,2]=3 3503 B8R0.9 CCC(C)\C=C\C(N)=O Amb27439352 [0,1,0,0,0,0|1,0,2]=4 3504 B8R0.9 CCC(C)\C=N\S(C)=O Amb35685181 [0,1,0,0,0,0|2,0,1]=4 3505 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,1,0,0,0,0|1,0,0]=2 3506 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,1,0,0,0,0|1,0,0]=2 3507 B8R0.9 CCC(Cl)CCN(C)C Amb27955871 [0,1,0,0,0,0|2,0,0]=3 3508 B8R0.9 CCC(Cl)COC(=O)Cl Amb25967600 [0,1,0,0,0,0|2,0,0]=3 3509 B8R0.9 CCC(Cl)CSN(C)C Amb27490969 [0,1,0,0,0,0|3,0,0]=4 3510 B8R0.9 CCC(F)CSC(C)C Amb28049291 [0,1,0,0,0,0|2,0,1]=4 3511 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,1,0,0,0,0|1,0,2]=4 3512 B8R0.9 CCC(N)CC=C(C)C Amb27251594 [0,1,0,0,0,0|1,0,1]=3 3513 B8R0.9 CCC(N)CC=C(Cl)Cl Amb29869998 [0,1,0,0,0,0|2,0,1]=4 3514 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,1,0,0,0,0|1,0,0]=2 3515 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,1,0,0,0,0|1,0,0]=2 3516 B8R0.9 CCC(N)CCC(C)C Amb8869732 [0,1,0,0,0,0|1,0,1]=3 3517 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,1,0,0,0,0|1,0,0]=2 3518 B8R0.9 CCC(N)CCN(C)C Amb18203193 [0,1,0,0,0,0|2,0,0]=3 3519 B8R0.9 CCC(N)CNC(C)C Amb18305275 [0,1,0,0,0,0|2,0,1]=4 3520 B8R0.9 CCC(N)CNC(N)=O Amb27437062 [0,1,0,0,0,0|2,0,0]=3 3521 B8R0.9 CCC(N)CSC(=N)N Amb27179911 [0,1,0,0,0,0|3,0,0]=4 3522 B8R0.9 CCC(N)CSC(C)C Amb17485964 [0,1,0,0,0,0|2,0,1]=4 3523 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,1,0,0,0,0|1,0,2]=4 3524 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,1,0,0,0,0|1,0,2]=4 3525 B8R0.9 CCC(O)C=C=C(C)C Amb28315558 [0,1,0,0,0,0|1,0,2]=4 3526 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,1,0,0,0,0|2,0,1]=4 3527 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,1,0,0,0,0|1,0,0]=2 3528 B8R0.9 CCC(O)CCC(C)C Amb19944686 [0,1,0,0,0,0|1,0,1]=3 3529 B8R0.9 CCC(O)CCC(F)F Amb27431479 [0,1,0,0,0,0|2,0,1]=4 3530 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,1,0,0,0,0|1,0,0]=2 3531 B8R0.9 CCC(O)CC[C@@H](C)O Amb28049249 [0,1,0,0,0,0|0,0,2]=3 3532 B8R0.9 CCC(O)CNC(C)C Amb18304016 [0,1,0,0,0,0|2,0,1]=4 3533 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,1,0,0,0,0|2,0,0]=3 3534 B8R0.9 CCC(O)COC(N)=O Amb27175099 [0,1,0,0,0,0|2,0,0]=3 3535 B8R0.9 CCC(O)CSC(=N)N Amb27179945 [0,1,0,0,0,0|3,0,0]=4 3536 B8R0.9 CCC(O)C\C=C(\C)Br Amb27405191 [0,1,0,0,0,0|1,0,1]=3 3537 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,1,0,0,0,0|1,0,0]=2 3538 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,1,0,0,0,0|2,0,0]=3 3539 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,1,0,0,0,0|2,0,0]=3 3540 B8R0.9 CCN(C)CCC(C)F Amb27837646 [0,1,0,0,0,0|2,0,1]=4 3541 B8R0.9 CCN(C)CCN(C)C Amb24065168 [0,1,0,0,0,0|3,0,0]=4 3542 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,1,0,0,0,0|2,0,0]=3 3543 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,1,0,0,0,0|3,0,0]=4 3544 B8R0.9 CCS(=O)NCC(N)=O Amb27433455 [0,1,0,0,0,0|3,0,0]=4 3545 B8R0.9 CC[C@@H](Br)COC(C)=O Amb28254442 [0,1,0,0,0,0|1,0,0]=2 3546 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,1,0,0,0,0|1,0,2]=4 3547 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,1,0,0,0,0|1,0,0]=2 3548 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,1,0,0,0,0|1,0,2]=4 3549 B8R0.9 CC[C@@H](Cl)CC[C@H](C)Cl Amb27490986 [0,1,0,0,0,0|1,0,1]=3 3550 B8R0.9 CC[C@@H](N)CCC(C)C Amb27455872 [0,1,0,0,0,0|1,0,1]=3 3551 B8R0.9 CC[C@@H](N)CCN(C)C Amb27456957 [0,1,0,0,0,0|2,0,0]=3 3552 B8R0.9 CC[C@@H](N)COC(C)C Amb27428826 [0,1,0,0,0,0|2,0,1]=4 3553 B8R0.9 CC[C@@H](N)CSC(=N)N Amb27392045 [0,1,0,0,0,0|3,0,0]=4 3554 B8R0.9 CC[C@@H](N)CSC(C)C Amb28139028 [0,1,0,0,0,0|2,0,1]=4 3555 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,1,0,0,0,0|1,0,0]=2 3556 B8R0.9 CC[C@@H](O)CNC(C)C Amb27197410 [0,1,0,0,0,0|2,0,1]=4 3557 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,1,0,0,0,0|1,0,2]=4 3558 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,1,0,0,0,0|0,0,0]=1 3559 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,1,0,0,0,0|1,0,0]=2 3560 B8R0.9 CC[C@H](C)CC[C@H](C)O Amb27807458 [0,1,0,0,0,0|0,0,2]=3 3561 B8R0.9 CC[C@H](C)CNC(N)=S Amb28285101 [0,1,0,0,0,0|2,1,0]=4 3562 B8R0.9 CC[C@H](C)COC(C)=O Amb27408010 [0,1,0,0,0,0|1,0,0]=2 3563 B8R0.9 CC[C@H](N)CCC(C)C Amb28070136 [0,1,0,0,0,0|1,0,1]=3 3564 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,1,0,0,0,0|1,0,2]=4 3565 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,1,0,0,0,0|1,0,0]=2 3566 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,1,0,0,0,0|1,0,0]=2 3567 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,1,0,0,0,0|1,0,2]=4 3568 B8R0.9 CN(C)CCC(F)CN Amb27438608 [0,1,0,0,0,0|3,0,0]=4 3569 B8R0.9 CN(C)CCC(F)CO Amb28129904 [0,1,0,0,0,0|3,0,0]=4 3570 B8R0.9 CN(C)CCC(N)CF Amb27792212 [0,1,0,0,0,0|3,0,0]=4 3571 B8R0.9 CN(C)CCC(N)CN Amb27170695 [0,1,0,0,0,0|3,0,0]=4 3572 B8R0.9 CN(C)CCC(N)CO Amb26847148 [0,1,0,0,0,0|3,0,0]=4 3573 B8R0.9 CN(C)CCC(N)CO Amb33329311 [0,1,0,0,0,0|3,0,0]=4 3574 B8R0.9 CN(C)CCC(O)CBr Amb33485673 [0,1,0,0,0,0|3,0,0]=4 3575 B8R0.9 CN(C)CCC(O)CCl Amb33412515 [0,1,0,0,0,0|3,0,0]=4 3576 B8R0.9 CN(C)CCC(O)CF Amb33271983 [0,1,0,0,0,0|3,0,0]=4 3577 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,1,0,0,0,0|3,0,0]=4 3578 B8R0.9 CN(C)CCC(O)CO Amb27242879 [0,1,0,0,0,0|3,0,0]=4 3579 B8R0.9 CN(C)CC[C@@H](N)CO Amb33272271 [0,1,0,0,0,0|3,0,0]=4 3580 B8R0.9 CN(C)CC[C@@H](O)CN Amb33272523 [0,1,0,0,0,0|3,0,0]=4 3581 B8R0.9 CN(C)CC[C@H](N)CO Amb33272272 [0,1,0,0,0,0|3,0,0]=4 3582 B8R0.9 CN(C)CC[C@H](O)CN Amb33272522 [0,1,0,0,0,0|3,0,0]=4 3583 B8R0.9 CN(C)CC[C@H](O)CO Amb28079205 [0,1,0,0,0,0|3,0,0]=4 3584 B8R0.9 CNC(=N)SCC(C)=O Amb27461473 [0,1,0,0,0,0|2,0,1]=4 3585 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,1,0,0,0,0|2,0,1]=4 3586 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,1,0,0,0,0|1,0,1]=3 3587 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,1,0,0,0,0|2,0,1]=4 3588 B8R0.9 CNC(=O)CNC(C)=O Amb4034777 [0,1,0,0,0,0|2,0,1]=4 3589 B8R0.9 CNC(=O)COC(C)=O Amb26872495 [0,1,0,0,0,0|2,0,1]=4 3590 B8R0.9 CNC(C)CCS(C)=O Amb27791401 [0,1,0,0,0,0|2,0,0]=3 3591 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,1,0,0,0,0|2,0,1]=4 3592 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,1,0,0,0,0|2,0,1]=4 3593 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,1,0,0,0,0|1,0,1]=3 3594 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,1]=4 3595 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,1,0,0,0,0|2,0,1]=4 3596 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,1,0,0,0,0|2,0,1]=4 3597 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,1,0,0,0,0|2,0,1]=4 3598 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,1,0,0,0,0|2,0,0]=3 3599 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,1,0,0,0,0|1,0,0]=2 3600 B8R0.9 COC(C)CCC(C)Br Amb28385552 [0,1,0,0,0,0|2,0,1]=4 3601 B8R0.9 COC(C)CNC(=O)Cl Amb35633401 [0,1,0,0,0,0|3,0,0]=4 3602 B8R0.9 COC(C)COC(=O)Cl Amb32656121 [0,1,0,0,0,0|3,0,0]=4 3603 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,0]=3 3604 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,0]=3 3605 B8R0.9 COC(C)\C=C\C(C)=O Amb27841431 [0,1,0,0,0,0|1,0,2]=4 3606 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,1,0,0,0,0|3,0,0]=4 3607 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,1,0,0,0,0|2,0,0]=3 3608 B8R0.9 CO[C@@H](C)CC[C@@H](C)O Amb28065305 [0,1,0,0,0,0|1,0,2]=4 3609 B8R0.9 CO[C@@H](C)CNC(C)=O Amb35605355 [0,1,0,0,0,0|2,0,0]=3 3610 B8R0.9 CO[C@@H](C)CNC(N)=O Amb35641866 [0,1,0,0,0,0|3,0,0]=4 3611 B8R0.9 CO[C@H](C)CNC(C)=O Amb30024558 [0,1,0,0,0,0|2,0,0]=3 3612 B8R0.9 CO[C@H](C)CNC(N)=O Amb29883111 [0,1,0,0,0,0|3,0,0]=4 3613 B8R0.9 CS(=O)CCC(N)C#N Amb27236521 [0,1,0,0,0,0|2,0,1]=4 3614 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [0,1,0,0,0,0|2,0,0]=3 3615 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,1,0,0,0,0|2,0,0]=3 3616 B8R0.9 CS(=O)NCC(N)CO Amb27778086 [0,1,0,0,0,0|3,0,0]=4 3617 B8R0.9 CS(=O)NCC(O)CO Amb27437774 [0,1,0,0,0,0|3,0,0]=4 3618 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,1,0,0,0,0|2,0,0]=3 3619 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,1,0,0,0,0|2,0,0]=3 3620 B8R0.9 CSC(C)CNC(=O)Cl Amb35633460 [0,1,0,0,0,0|3,0,0]=4 3621 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,1,0,0,0,0|3,0,0]=4 3622 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] Amb13883660 [0,1,0,0,0,0|3,0,0]=4 3623 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,1,0,0,0,0|3,0,0]=4 3624 B8R0.9 C[C@H](CO)CC[N+](=O)[O-] Amb33743126 [0,1,0,0,0,0|3,0,0]=4 3625 B8R0.9 C[C@H](O)CC[C@H](C)CO Amb28049197 [0,1,0,0,0,0|1,0,2]=4 3626 B8R0.9 C\C(Br)=C/C[C@H](O)CO Amb28049194 [0,1,0,0,0,0|2,0,1]=4 3627 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,1,0,0,0,0|0,0,2]=3 3628 B8R0.9 C\C=C(\C)OCC(C)=O Amb27844138 [0,1,0,0,0,0|1,0,2]=4 3629 B8R0.9 C\N=[N+](/[O-])COC(C)=O Amb27258123 [0,1,0,0,0,0|3,0,0]=4 3630 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,1,0,0,0,0|2,0,1]=4 3631 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,1,0,0,0,0|2,0,1]=4 3632 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,1,0,0,0,0|2,0,0]=3 3633 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,1,0,0,0,0|2,0,0]=3 3634 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,1,0,0,0,0|2,0,0]=3 3635 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,1,0,0,0,0|3,0,0]=4 3636 B8R0.9 NC(=O)OCC(Cl)CCl Amb27771643 [0,1,0,0,0,0|3,0,0]=4 3637 B8R0.9 NC(=O)OCC(N)CO Amb27956487 [0,1,0,0,0,0|3,0,0]=4 3638 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,1,0,0,0,0|2,0,0]=3 3639 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,1,0,0,0,0|2,0,0]=3 3640 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,1,0,0,0,0|2,0,0]=3 3641 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,1,0,0,0,0|2,0,0]=3 3642 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,1,0,0,0,0|2,0,0]=3 3643 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,1,0,0,0,0|2,0,0]=3 3644 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,1,0,0,0,0|2,0,0]=3 3645 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,1,0,0,0,0|2,0,1]=4 3646 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,1,0,0,0,0|2,0,1]=4 3647 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,1,0,0,0,0|2,0,0]=3 3648 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,1,0,0,0,0|2,0,0]=3 3649 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,1,0,0,0,0|2,0,0]=3 3650 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,1,0,0,0,0|2,0,0]=3 3651 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,1,0,0,0,0|3,0,0]=4 3652 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,1,0,0,0,0|3,0,0]=4 3653 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,1,0,0,0,0|2,0,0]=3 3654 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,1,0,0,0,0|2,0,0]=3 3655 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,1,0,0,0,0|2,0,0]=3 3656 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,1,0,0,0,0|2,0,0]=3 3657 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,1,0,0,0,0|2,0,0]=3 3658 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,1,0,0,0,0|2,0,0]=3 3659 B8R0.9 O=C(Cl)OCC(Cl)CCl Amb27758582 [0,1,0,0,0,0|3,0,0]=4 3660 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|2,0,1]=4 3661 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,1,0,0,0,0|2,0,0]=3 3662 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,1,0,0,0,0|2,0,0]=3 3663 B8R0.21 C#CCCCS(C)(=O)=O Amb33058062 [0,1,0,0,0,0|1,0,2]=4 3664 B8R0.21 CC(C)(C)CCCCBr Amb18321785 [0,1,0,0,0,0|2,0,1]=4 3665 B8R0.21 CC(C)(C)CCCCCl Amb26021353 [0,1,0,0,0,0|2,0,1]=4 3666 B8R0.21 CC(C)(C)CCCCN Amb18523845 [0,1,0,0,0,0|2,0,1]=4 3667 B8R0.21 CC(C)(C)CCCCO Amb10572498 [0,1,0,0,0,0|2,0,1]=4 3668 B8R0.21 CC(C)(C)CCCCS Amb33362052 [0,1,0,0,0,0|2,0,1]=4 3669 B8R0.21 CC(C)(F)CCCCN Amb27775236 [0,1,0,0,0,0|2,0,1]=4 3670 B8R0.21 CC(C)(F)CCCCO Amb27494755 [0,1,0,0,0,0|2,0,1]=4 3671 B8R0.21 CC(C)(N)CCCCBr Amb27955156 [0,1,0,0,0,0|2,0,1]=4 3672 B8R0.21 CC(C)(N)CCCCF Amb28132019 [0,1,0,0,0,0|2,0,1]=4 3673 B8R0.21 CC(C)(N)CCCCO Amb17569935 [0,1,0,0,0,0|2,0,1]=4 3674 B8R0.21 CC(C)(O)CCCCN Amb17569932 [0,1,0,0,0,0|1,0,2]=4 3675 B8R0.21 CC(C)(O)CCCCO Amb26047691 [0,1,0,0,0,0|1,0,2]=4 3676 B8R0.21 CC(F)(F)CCCCCl Amb28129856 [0,1,0,0,0,0|2,0,1]=4 3677 B8R0.21 CC(F)(F)CCCCN Amb27151943 [0,1,0,0,0,0|2,0,1]=4 3678 B8R0.21 CCCCCC(C)(C)C Amb22228233 [0,1,0,0,0,0|1,0,1]=3 3679 B8R0.21 CCCCCC(F)(F)F Amb16185858 [0,1,0,0,0,0|2,0,1]=4 3680 B8R0.21 CCCCCS(=O)(=O)Cl Amb2690082 [0,1,0,0,0,0|2,0,0]=3 3681 B8R0.21 CCCCCS(=O)(=O)F Amb32718322 [0,1,0,0,0,0|2,0,0]=3 3682 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [0,1,0,0,0,0|2,0,0]=3 3683 B8R0.21 CCCCCS(=O)(=O)[O-] Amb2690072 [0,1,0,0,0,0|2,0,0]=3 3684 B8R0.21 CCCCCS(=O)(=O)[O-] Amb4025819 [0,1,0,0,0,0|2,0,0]=3 3685 B8R0.21 CCCCCS(C)(=O)=O Amb27455782 [0,1,0,0,0,0|1,0,0]=2 3686 B8R0.21 CCCCCS(N)(=O)=O Amb16191925 [0,1,0,0,0,0|2,0,0]=3 3687 B8R0.21 CCCCC[B-](F)(F)F Amb13890327 [0,1,0,0,0,0|3,0,0]=4 3688 B8R0.21 CCCCC[N+](C)(C)C Amb27403609 [0,1,0,0,0,0|2,0,0]=3 3689 B8R0.21 CCCCC[Si](C)(C)Cl Amb19893992 [0,1,0,0,0,0|1,1,0]=3 3690 B8R0.21 CCCCC[Si](Cl)(Cl)Cl Amb19893531 [0,1,0,0,0,0|2,1,0]=4 3691 B8R0.21 CCCCNC(C)(C)C Amb1124582 [0,1,0,0,0,0|2,0,1]=4 3692 B8R0.21 CCCCNP(N)(N)=O Amb17610387 [0,1,0,0,0,0|3,0,0]=4 3693 B8R0.21 CCCCNS(=O)(=O)Cl Amb17193917 [0,1,0,0,0,0|3,0,0]=4 3694 B8R0.21 CCCCNS(=O)(=O)O Amb4018979 [0,1,0,0,0,0|3,0,0]=4 3695 B8R0.21 CCCCNS(C)(=O)=O Amb3360690 [0,1,0,0,0,0|2,0,0]=3 3696 B8R0.21 CCCCNS(N)(=O)=O Amb22436420 [0,1,0,0,0,0|3,0,0]=4 3697 B8R0.21 CCCCOP(=O)(O)O Amb24419212 [0,1,0,0,0,0|3,0,0]=4 3698 B8R0.21 CCCCOP(=O)([O-])[O-] Amb24090708 [0,1,0,0,0,0|3,0,0]=4 3699 B8R0.21 CCCCOP(C)(=O)Cl Amb27445528 [0,1,0,0,0,0|2,0,0]=3 3700 B8R0.21 CCCCOS(=O)(=O)O Amb22169780 [0,1,0,0,0,0|3,0,0]=4 3701 B8R0.21 CCCCOS(C)(=O)=O Amb8395242 [0,1,0,0,0,0|2,0,0]=3 3702 B8R0.21 CCCCOS(N)(=O)=O Amb27150044 [0,1,0,0,0,0|3,0,0]=4 3703 B8R0.21 CCCCSC(C)(C)C Amb4020129 [0,1,0,0,0,0|2,0,1]=4 3704 B8R0.21 CCCNCC(C)(C)C Amb8853724 [0,1,0,0,0,0|2,0,1]=4 3705 B8R0.21 CCCNCC(C)(C)O Amb33534010 [0,1,0,0,0,0|1,0,2]=4 3706 B8R0.21 CCCNCC(C)(F)F Amb27640949 [0,1,0,0,0,0|2,0,1]=4 3707 B8R0.21 CCCOCC(C)(C)N Amb17485993 [0,1,0,0,0,0|2,0,1]=4 3708 B8R0.21 CCCSCC(C)(C)C Amb27448708 [0,1,0,0,0,0|2,0,1]=4 3709 B8R0.21 CCNCCC(C)(C)O Amb27881628 [0,1,0,0,0,0|1,0,2]=4 3710 B8R0.21 CCNCCP(=O)(O)O Amb27400507 [0,1,0,0,0,0|3,0,0]=4 3711 B8R0.21 CCNCCS(=O)(=O)F Amb33463757 [0,1,0,0,0,0|3,0,0]=4 3712 B8R0.21 CCNCCS(C)(=O)=O Amb18523815 [0,1,0,0,0,0|2,0,0]=3 3713 B8R0.21 CCOCCS(=O)(=O)Cl Amb9316468 [0,1,0,0,0,0|3,0,0]=4 3714 B8R0.21 CCOCCS(=O)(=O)F Amb25722585 [0,1,0,0,0,0|3,0,0]=4 3715 B8R0.21 CCOCCS(=O)(=O)[O-] Amb27616352 [0,1,0,0,0,0|3,0,0]=4 3716 B8R0.21 CCOCCS(N)(=O)=O Amb9316791 [0,1,0,0,0,0|3,0,0]=4 3717 B8R0.21 CCOCC[N+](C)(C)C Amb24545925 [0,1,0,0,0,0|3,0,0]=4 3718 B8R0.21 CCSCCC(C)(C)N Amb24717225 [0,1,0,0,0,0|2,0,1]=4 3719 B8R0.21 CCSCCC(C)(C)O Amb25888893 [0,1,0,0,0,0|1,0,2]=4 3720 B8R0.21 CCSCCS(=O)(=O)Cl Amb27656410 [0,1,0,0,0,0|3,0,0]=4 3721 B8R0.21 CCSCCS(=O)(=O)F Amb33053206 [0,1,0,0,0,0|3,0,0]=4 3722 B8R0.21 CCSCCS(C)(=O)=O Amb27833287 [0,1,0,0,0,0|2,0,0]=3 3723 B8R0.21 CCSCCS(N)(=O)=O Amb26596003 [0,1,0,0,0,0|3,0,0]=4 3724 B8R0.21 CNCCCC(C)(C)C Amb18312573 [0,1,0,0,0,0|2,0,1]=4 3725 B8R0.21 CNCCCC(C)(C)C Amb32410216 [0,1,0,0,0,0|2,0,1]=4 3726 B8R0.21 CNCCCC(C)(C)O Amb17569928 [0,1,0,0,0,0|1,0,2]=4 3727 B8R0.21 CNCCCS(=O)(=O)F Amb33463799 [0,1,0,0,0,0|3,0,0]=4 3728 B8R0.21 CNCCCS(C)(=O)=O Amb18304934 [0,1,0,0,0,0|2,0,0]=3 3729 B8R0.21 CNCCCS(C)(=O)=O Amb33527631 [0,1,0,0,0,0|2,0,0]=3 3730 B8R0.21 CNCCNS(C)(=O)=O Amb19410469 [0,1,0,0,0,0|3,0,0]=4 3731 B8R0.21 CNCCNS(C)(=O)=O Amb9408146 [0,1,0,0,0,0|3,0,0]=4 3732 B8R0.21 CNCCOS(C)(=O)=O Amb27657408 [0,1,0,0,0,0|3,0,0]=4 3733 B8R0.21 CNCCOS(C)(=O)=S Amb24065158 [0,1,0,0,0,0|3,0,0]=4 3734 B8R0.21 CNCCOS(C)(=O)=S Amb28055874 [0,1,0,0,0,0|3,0,0]=4 3735 B8R0.21 COCCCC(C)(C)N Amb17569949 [0,1,0,0,0,0|2,0,1]=4 3736 B8R0.21 COCCCC(C)(C)O Amb27409674 [0,1,0,0,0,0|1,0,2]=4 3737 B8R0.21 COCCCS(=O)(=O)Cl Amb18538494 [0,1,0,0,0,0|3,0,0]=4 3738 B8R0.21 COCCCS(=O)(=O)F Amb20623730 [0,1,0,0,0,0|3,0,0]=4 3739 B8R0.21 COCCCS(=O)(=O)O Amb22523485 [0,1,0,0,0,0|3,0,0]=4 3740 B8R0.21 COCCCS(C)(=O)=O Amb27968921 [0,1,0,0,0,0|2,0,0]=3 3741 B8R0.21 COCCCS(N)(=O)=O Amb18791542 [0,1,0,0,0,0|3,0,0]=4 3742 B8R0.21 COCCNS(C)(=O)=O Amb3357772 [0,1,0,0,0,0|3,0,0]=4 3743 B8R0.21 COCCOS(C)(=O)=O Amb15692334 [0,1,0,0,0,0|3,0,0]=4 3744 B8R0.21 CONCCS(C)(=O)=O Amb27206992 [0,1,0,0,0,0|3,0,0]=4 3745 B8R0.21 CP(=O)(O)SCCCN Amb27760346 [0,1,0,0,0,0|3,0,0]=4 3746 B8R0.21 CS(=O)(=O)CCCC#N Amb17504334 [0,1,0,0,0,0|2,0,1]=4 3747 B8R0.21 CS(=O)(=O)CCCC=O Amb18181110 [0,1,0,0,0,0|2,0,1]=4 3748 B8R0.21 CS(=O)(=O)CCCCBr Amb24401565 [0,1,0,0,0,0|2,0,0]=3 3749 B8R0.21 CS(=O)(=O)CCCCCl Amb17138674 [0,1,0,0,0,0|2,0,0]=3 3750 B8R0.21 CS(=O)(=O)CCCCN Amb17138437 [0,1,0,0,0,0|2,0,0]=3 3751 B8R0.21 CS(=O)(=O)CCCCN Amb33552110 [0,1,0,0,0,0|2,0,0]=3 3752 B8R0.21 CS(=O)(=O)CCCCO Amb18180175 [0,1,0,0,0,0|2,0,0]=3 3753 B8R0.21 CS(=O)(=O)CCCCS Amb33058066 [0,1,0,0,0,0|2,0,0]=3 3754 B8R0.21 CS(=O)(=O)CCCNN Amb21618681 [0,1,0,0,0,0|3,0,0]=4 3755 B8R0.21 CS(=O)(=O)CCCNO Amb33053745 [0,1,0,0,0,0|3,0,0]=4 3756 B8R0.21 CS(=O)(=O)CCCON Amb25888915 [0,1,0,0,0,0|3,0,0]=4 3757 B8R0.21 CS(=O)(=O)CSCCCl Amb27659226 [0,1,0,0,0,0|3,0,0]=4 3758 B8R0.21 CS(=O)(=O)NCCCBr Amb8826364 [0,1,0,0,0,0|3,0,0]=4 3759 B8R0.21 CS(=O)(=O)NCCCCl Amb3886729 [0,1,0,0,0,0|3,0,0]=4 3760 B8R0.21 CS(=O)(=O)NCCCN Amb33801433 [0,1,0,0,0,0|3,0,0]=4 3761 B8R0.21 CS(=O)(=O)NCCCN Amb6664983 [0,1,0,0,0,0|3,0,0]=4 3762 B8R0.21 CS(=O)(=O)NCCCO Amb9243393 [0,1,0,0,0,0|3,0,0]=4 3763 B8R0.21 CS(=O)(=O)OCCCBr Amb27627823 [0,1,0,0,0,0|3,0,0]=4 3764 B8R0.21 CS(=O)(=O)OCCCF Amb10841781 [0,1,0,0,0,0|3,0,0]=4 3765 B8R0.21 CS(=O)(=O)OCCCN Amb18626294 [0,1,0,0,0,0|3,0,0]=4 3766 B8R0.21 CS(=O)(=O)SCCCN Amb10069437 [0,1,0,0,0,0|3,0,0]=4 3767 B8R0.21 CS(=O)(=O)SCCCN Amb17608278 [0,1,0,0,0,0|3,0,0]=4 3768 B8R0.21 CS(C)(=O)=NCCCN Amb27640367 [0,1,0,0,0,0|3,0,0]=4 3769 B8R0.21 CSCCCC(C)(C)N Amb27272737 [0,1,0,0,0,0|2,0,1]=4 3770 B8R0.21 CSCCCC(C)(C)O Amb33198744 [0,1,0,0,0,0|1,0,2]=4 3771 B8R0.21 CSCCCS(=O)(=O)Cl Amb25922338 [0,1,0,0,0,0|3,0,0]=4 3772 B8R0.21 CSCCCS(=O)(=O)F Amb33076644 [0,1,0,0,0,0|3,0,0]=4 3773 B8R0.21 CSCCCS(C)(=O)=O Amb27838088 [0,1,0,0,0,0|2,0,0]=3 3774 B8R0.21 CSCCCS(N)(=O)=O Amb25032148 [0,1,0,0,0,0|3,0,0]=4 3775 B8R0.21 C[N+](C)(C)CCCCCl Amb27613463 [0,1,0,0,0,0|3,0,0]=4 3776 B8R0.21 C[N+](C)(C)CCCCN Amb27866246 [0,1,0,0,0,0|3,0,0]=4 3777 B8R0.21 C[N+](C)(C)CCCCN Amb32661058 [0,1,0,0,0,0|3,0,0]=4 3778 B8R0.21 C[N+](C)(C)CCCCN Amb32662609 [0,1,0,0,0,0|3,0,0]=4 3779 B8R0.21 C[Si](C)(C)CCCCO Amb22366478 [0,1,0,0,0,0|2,1,0]=4 3780 B8R0.21 C[Si](C)(Cl)CCCCBr Amb19894226 [0,1,0,0,0,0|2,1,0]=4 3781 B8R0.21 C[Si](C)(Cl)CCCCCl Amb2685797 [0,1,0,0,0,0|2,1,0]=4 3782 B8R0.21 C[Si](C)(Cl)CCCCN Amb24763570 [0,1,0,0,0,0|2,1,0]=4 3783 B8R0.21 NCCCCP(=O)(O)O Amb4036798 [0,1,0,0,0,0|3,0,0]=4 3784 B8R0.21 NCCCCS(=O)(=O)F Amb33463776 [0,1,0,0,0,0|3,0,0]=4 3785 B8R0.21 NCCCCS(=O)(=O)O Amb28285138 [0,1,0,0,0,0|3,0,0]=4 3786 B8R0.21 NCCCCS(N)(=O)=O Amb19016662 [0,1,0,0,0,0|3,0,0]=4 3787 B8R0.21 NCCCCS(N)(=O)=O Amb33552095 [0,1,0,0,0,0|3,0,0]=4 3788 B8R0.21 NP(=O)(O)CCCCCl Amb27659294 [0,1,0,0,0,0|3,0,0]=4 3789 B8R0.21 NS(=O)(=O)CCCCCl Amb25953993 [0,1,0,0,0,0|3,0,0]=4 3790 B8R0.21 NS(=O)(=O)CCCCF Amb28133885 [0,1,0,0,0,0|3,0,0]=4 3791 B8R0.21 O=P(O)(O)CCCCBr Amb22832006 [0,1,0,0,0,0|3,0,0]=4 3792 B8R0.21 O=P(O)(O)CCCCCl Amb22388731 [0,1,0,0,0,0|3,0,0]=4 3793 B8R0.21 O=S(=O)(Cl)CCCCCl Amb7101618 [0,1,0,0,0,0|3,0,0]=4 3794 B8R0.21 O=S(=O)(Cl)CCCCF Amb25325507 [0,1,0,0,0,0|3,0,0]=4 3795 B8R0.21 O=S(=O)(F)CCCCCl Amb26564787 [0,1,0,0,0,0|3,0,0]=4 3796 B8R0.21 O=S(=O)(F)CCCCF Amb32717467 [0,1,0,0,0,0|3,0,0]=4 3797 B8R0.21 O=S(=O)(O)CCCCO Amb25945104 [0,1,0,0,0,0|3,0,0]=4 3798 B8R0.21 O=S(=O)(O)CCCCS Amb26556587 [0,1,0,0,0,0|3,0,0]=4 3799 B8R0.21 O=S(=O)([O-])CCCCI Amb10880692 [0,1,0,0,0,0|3,0,0]=4 3800 B8R0.21 O=S(=O)([O-])CCCCI Amb25352406 [0,1,0,0,0,0|3,0,0]=4 3801 B8R0.21 O=S(=O)([O-])CCCCO Amb32650208 [0,1,0,0,0,0|3,0,0]=4 3802 B8R0.21 [C-]#[N+]CCCS(C)(=O)=O Amb33055786 [0,1,0,0,0,0|2,0,1]=4 3803 B8R0.28 C=C(Br)CNC[C@@H](C)O Amb28285300 [0,1,0,0,0,0|2,0,1]=4 3804 B8R0.28 C=C(Br)CNC[C@H](C)O Amb27184417 [0,1,0,0,0,0|2,0,1]=4 3805 B8R0.28 C=C(Br)COCC(C)C Amb28246325 [0,1,0,0,0,0|2,0,1]=4 3806 B8R0.28 C=C(Br)CSCC(C)N Amb27464775 [0,1,0,0,0,0|2,0,1]=4 3807 B8R0.28 C=C(C)C#CCC(C)O Amb2721687 [0,1,0,0,0,0|1,0,2]=4 3808 B8R0.28 C=C(C)CCC=C(C)C Amb27424700 [0,1,0,0,0,0|1,0,2]=4 3809 B8R0.28 C=C(C)CCCC(=C)C Amb22228385 [0,1,0,0,0,0|1,0,1]=3 3810 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,1,0,0,0,0|1,0,1]=3 3811 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,1,0,0,0,0|0,0,1]=2 3812 B8R0.28 C=C(C)CCCC(C)Br Amb27955163 [0,1,0,0,0,0|1,0,0]=2 3813 B8R0.28 C=C(C)CCCC(C)C Amb22228386 [0,1,0,0,0,0|1,0,0]=2 3814 B8R0.28 C=C(C)CCCC(C)Cl Amb27965952 [0,1,0,0,0,0|1,0,0]=2 3815 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,1,0,0,0,0|1,0,1]=3 3816 B8R0.28 C=C(C)CCC[C@@H](C)N Amb28049331 [0,1,0,0,0,0|1,0,0]=2 3817 B8R0.28 C=C(C)CCNC(C)=O Amb27780923 [0,1,0,0,0,0|1,0,1]=3 3818 B8R0.28 C=C(C)CCNN(C)C Amb27656804 [0,1,0,0,0,0|3,0,0]=4 3819 B8R0.28 C=C(C)CCOC(C)=O Amb4035107 [0,1,0,0,0,0|1,0,1]=3 3820 B8R0.28 C=C(C)CCSC(C)C Amb27443471 [0,1,0,0,0,0|2,0,0]=3 3821 B8R0.28 C=C(C)CNCC(=C)C Amb4032914 [0,1,0,0,0,0|2,0,1]=4 3822 B8R0.28 C=C(C)CNCC(C)C Amb17308640 [0,1,0,0,0,0|2,0,0]=3 3823 B8R0.28 C=C(C)CNC[C@H](C)O Amb27852384 [0,1,0,0,0,0|2,0,0]=3 3824 B8R0.28 C=C(C)CONC(C)=O Amb27813952 [0,1,0,0,0,0|2,0,1]=4 3825 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,1,0,0,0,0|2,0,1]=4 3826 B8R0.28 C=C(C)CSCC(C)=O Amb27877304 [0,1,0,0,0,0|1,0,1]=3 3827 B8R0.28 C=C(C)C[Ru]CC(=C)C Amb22002190 [0,1,0,0,0,0|2,0,1]=4 3828 B8R0.28 C=C(C)\C=C\CC(C)=O Amb24744667 [0,1,0,0,0,0|0,0,3]=4 3829 B8R0.28 C=C(Cl)CCCC(N)=O Amb27253854 [0,1,0,0,0,0|1,0,2]=4 3830 B8R0.28 C=C(Cl)CNC[C@H](C)O Amb27642026 [0,1,0,0,0,0|2,0,1]=4 3831 B8R0.28 C=C(Cl)CSCC(C)=O Amb28205790 [0,1,0,0,0,0|1,0,2]=4 3832 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,1,0,0,0,0|1,0,2]=4 3833 B8R0.28 CC(=N)NCCC(F)F Amb27589600 [0,1,0,0,0,0|3,0,0]=4 3834 B8R0.28 CC(=N)NCCC(N)=O Amb28049611 [0,1,0,0,0,0|2,0,1]=4 3835 B8R0.28 CC(=O)C#CCC(C)C Amb27442442 [0,1,0,0,0,0|0,0,2]=3 3836 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,1,0,0,0,0|0,0,3]=4 3837 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,1,0,0,0,0|0,0,2]=3 3838 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,1,0,0,0,0|1,0,1]=3 3839 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,1,0,0,0,0|0,0,1]=2 3840 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,1,0,0,0,0|0,0,0]=1 3841 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [0,1,0,0,0,0|0,0,0]=1 3842 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,1,0,0,0,0|1,0,1]=3 3843 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [0,1,0,0,0,0|1,0,0]=2 3844 B8R0.28 CC(=O)CCC[N+](=O)[O-] Amb18203187 [0,1,0,0,0,0|2,0,0]=3 3845 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [0,1,0,0,0,0|1,0,1]=3 3846 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,1,0,0,0,0|1,0,0]=2 3847 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,1,0,0,0,0|2,0,0]=3 3848 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [0,1,0,0,0,0|1,0,1]=3 3849 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,1,0,0,0,0|1,0,0]=2 3850 B8R0.28 CC(=O)CC\C=C(\C)Cl Amb17593664 [0,1,0,0,0,0|0,0,2]=3 3851 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,1,0,0,0,0|1,0,0]=2 3852 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,1,0,0,0,0|1,0,0]=2 3853 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,1,0,0,0,0|1,0,0]=2 3854 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,1,0,0,0,0|2,0,1]=4 3855 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [0,1,0,0,0,0|2,0,1]=4 3856 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,1,0,0,0,0|1,0,0]=2 3857 B8R0.28 CC(=O)CSCC(C)F Amb28135753 [0,1,0,0,0,0|1,0,0]=2 3858 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,1,0,0,0,0|1,0,0]=2 3859 B8R0.28 CC(=O)CSCC(F)F Amb27956449 [0,1,0,0,0,0|2,0,0]=3 3860 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,1,0,0,0,0|2,0,1]=4 3861 B8R0.28 CC(=O)C\C=C\C(C)C Amb26846089 [0,1,0,0,0,0|0,0,2]=3 3862 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,1,0,0,0,0|0,0,2]=3 3863 B8R0.28 CC(=O)C\C=C\N(C)C Amb27191796 [0,1,0,0,0,0|1,0,2]=4 3864 B8R0.28 CC(=O)NCC=C(C)C Amb26606550 [0,1,0,0,0,0|1,0,2]=4 3865 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,1,0,0,0,0|2,0,1]=4 3866 B8R0.28 CC(=O)NCCC(C)Cl Amb27952422 [0,1,0,0,0,0|1,0,0]=2 3867 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,1,0,0,0,0|2,0,1]=4 3868 B8R0.28 CC(=O)NCCC(N)=S Amb17232012 [0,1,0,0,0,0|2,0,1]=4 3869 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [0,1,0,0,0,0|3,0,0]=4 3870 B8R0.28 CC(=O)NCNC(C)=O Amb8485453 [0,1,0,0,0,0|2,0,1]=4 3871 B8R0.28 CC(=O)NCOC(C)=O Amb27810126 [0,1,0,0,0,0|2,0,1]=4 3872 B8R0.28 CC(=O)N\C=C/C(C)C Amb28437296 [0,1,0,0,0,0|1,0,2]=4 3873 B8R0.28 CC(=O)OCC=C(C)C Amb22002433 [0,1,0,0,0,0|1,0,2]=4 3874 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,1,0,0,0,0|2,0,1]=4 3875 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,1,0,0,0,0|1,0,0]=2 3876 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,1,0,0,0,0|1,0,0]=2 3877 B8R0.28 CC(=O)OCCC(C)S Amb25077156 [0,1,0,0,0,0|1,0,0]=2 3878 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,1,0,0,0,0|2,0,1]=4 3879 B8R0.28 CC(=O)OCCN(C)C Amb8516593 [0,1,0,0,0,0|2,0,0]=3 3880 B8R0.28 CC(=O)OCCS(=O)Cl Amb32720402 [0,1,0,0,0,0|3,0,0]=4 3881 B8R0.28 CC(=O)OCCS(=O)[O-] Amb32754519 [0,1,0,0,0,0|3,0,0]=4 3882 B8R0.28 CC(=O)OCCS(N)=O Amb32720403 [0,1,0,0,0,0|3,0,0]=4 3883 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,1,0,0,0,0|1,0,0]=2 3884 B8R0.28 CC(=O)OCOC(C)=O Amb9787622 [0,1,0,0,0,0|2,0,1]=4 3885 B8R0.28 CC(=O)OC\N=[N+](/C)[O-] Amb27770552 [0,1,0,0,0,0|3,0,0]=4 3886 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,1,0,0,0,0|1,0,2]=4 3887 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [0,1,0,0,0,0|2,0,1]=4 3888 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,1,0,0,0,0|2,0,1]=4 3889 B8R0.28 CC(=O)SCCN(C)C Amb27607143 [0,1,0,0,0,0|2,0,0]=3 3890 B8R0.28 CC(=O)\C=C/CC(C)C Amb27190424 [0,1,0,0,0,0|0,0,2]=3 3891 B8R0.28 CC(=O)\C=C/NC(C)C Amb28388378 [0,1,0,0,0,0|1,0,2]=4 3892 B8R0.28 CC(=O)\C=C\CC(C)C Amb3354778 [0,1,0,0,0,0|0,0,2]=3 3893 B8R0.28 CC(=O)\C=N\NC(C)C Amb27600772 [0,1,0,0,0,0|2,0,1]=4 3894 B8R0.28 CC(Br)CCCN(C)C Amb33007677 [0,1,0,0,0,0|2,0,0]=3 3895 B8R0.28 CC(Br)CCOC(C)C Amb25966606 [0,1,0,0,0,0|2,0,1]=4 3896 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,1,0,0,0,0|1,0,2]=4 3897 B8R0.28 CC(C)=CCCC(C)C Amb30023884 [0,1,0,0,0,0|1,0,1]=3 3898 B8R0.28 CC(C)=CCCC(C)Cl Amb25032126 [0,1,0,0,0,0|1,0,1]=3 3899 B8R0.28 CC(C)=CCCC(C)N Amb3371996 [0,1,0,0,0,0|1,0,1]=3 3900 B8R0.28 CC(C)=CCCC(Cl)Cl Amb27400284 [0,1,0,0,0,0|2,0,1]=4 3901 B8R0.28 CC(C)=CCCC(F)F Amb35582946 [0,1,0,0,0,0|2,0,1]=4 3902 B8R0.28 CC(C)=CCC[C@@H](C)Br Amb27400323 [0,1,0,0,0,0|1,0,1]=3 3903 B8R0.28 CC(C)=CCC[C@@H](C)N Amb27404604 [0,1,0,0,0,0|1,0,1]=3 3904 B8R0.28 CC(C)=CCC[C@@H](C)O Amb22049561 [0,1,0,0,0,0|1,0,1]=3 3905 B8R0.28 CC(C)=CCC[C@H](C)N Amb27162485 [0,1,0,0,0,0|1,0,1]=3 3906 B8R0.28 CC(C)=CCC[C@H](C)O Amb22049564 [0,1,0,0,0,0|1,0,1]=3 3907 B8R0.28 CC(C)=CCNC(C)C Amb18642550 [0,1,0,0,0,0|2,0,1]=4 3908 B8R0.28 CC(C)=CNCC(C)C Amb28364333 [0,1,0,0,0,0|2,0,1]=4 3909 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,1,0,0,0,0|1,0,2]=4 3910 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,1,0,0,0,0|1,0,2]=4 3911 B8R0.28 CC(C)CCCC(=N)N Amb23569433 [0,1,0,0,0,0|2,0,0]=3 3912 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,1,0,0,0,0|1,0,0]=2 3913 B8R0.28 CC(C)CCCC(C)Br Amb18330330 [0,1,0,0,0,0|1,0,1]=3 3914 B8R0.28 CC(C)CCCC(C)C Amb22228384 [0,1,0,0,0,0|1,0,1]=3 3915 B8R0.28 CC(C)CCCC(C)Cl Amb28435889 [0,1,0,0,0,0|1,0,1]=3 3916 B8R0.28 CC(C)CCCC(C)N Amb3939833 [0,1,0,0,0,0|1,0,1]=3 3917 B8R0.28 CC(C)CCCC(C)O Amb2721284 [0,1,0,0,0,0|0,0,2]=3 3918 B8R0.28 CC(C)CCCC(N)=S Amb28285193 [0,1,0,0,0,0|1,1,0]=3 3919 B8R0.28 CC(C)CCCP(O)O Amb27835938 [0,1,0,0,0,0|2,0,1]=4 3920 B8R0.28 CC(C)CCCS(=O)Cl Amb32720416 [0,1,0,0,0,0|2,0,0]=3 3921 B8R0.28 CC(C)CCCS(=O)[O-] Amb32754454 [0,1,0,0,0,0|2,0,0]=3 3922 B8R0.28 CC(C)CCCS(N)=O Amb32720417 [0,1,0,0,0,0|2,0,0]=3 3923 B8R0.28 CC(C)CCC[C@@H](C)N Amb22232273 [0,1,0,0,0,0|1,0,1]=3 3924 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,1,0,0,0,0|0,0,2]=3 3925 B8R0.28 CC(C)CCC[C@H](C)N Amb22225819 [0,1,0,0,0,0|1,0,1]=3 3926 B8R0.28 CC(C)CCC[C@H](C)O Amb28291294 [0,1,0,0,0,0|0,0,2]=3 3927 B8R0.28 CC(C)CCC[N+](=O)[O-] Amb33226988 [0,1,0,0,0,0|2,0,0]=3 3928 B8R0.28 CC(C)CCNC(=N)N Amb24524670 [0,1,0,0,0,0|3,0,0]=4 3929 B8R0.28 CC(C)CCNC(C)C Amb6247916 [0,1,0,0,0,0|2,0,1]=4 3930 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,1,0,0,0,0|2,0,0]=3 3931 B8R0.28 CC(C)CCNC(N)=S Amb386166 [0,1,0,0,0,0|2,1,0]=4 3932 B8R0.28 CC(C)CCOC(=N)N Amb27169586 [0,1,0,0,0,0|3,0,0]=4 3933 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,1,0,0,0,0|2,0,0]=3 3934 B8R0.28 CC(C)CCOC(=S)[S-] Amb13777309 [0,1,0,0,0,0|2,1,0]=4 3935 B8R0.28 CC(C)CCOC(C)Cl Amb25724972 [0,1,0,0,0,0|2,0,1]=4 3936 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,1,0,0,0,0|2,0,0]=3 3937 B8R0.28 CC(C)CCOS(=O)[O-] Amb24524507 [0,1,0,0,0,0|3,0,0]=4 3938 B8R0.28 CC(C)CCO[N+](=O)[O-] Amb2720793 [0,1,0,0,0,0|3,0,0]=4 3939 B8R0.28 CC(C)CCSC(=N)N Amb20676007 [0,1,0,0,0,0|3,0,0]=4 3940 B8R0.28 CC(C)CCSC(C)C Amb28291781 [0,1,0,0,0,0|2,0,1]=4 3941 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,1,0,0,0,0|2,0,0]=3 3942 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,1,0,0,0,0|2,0,0]=3 3943 B8R0.28 CC(C)CNCC(C)C Amb3938961 [0,1,0,0,0,0|2,0,1]=4 3944 B8R0.28 CC(C)CNCC(C)O Amb534459 [0,1,0,0,0,0|1,0,2]=4 3945 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,1,0,0,0,0|2,0,0]=3 3946 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,1,0,0,0,0|2,0,0]=3 3947 B8R0.28 CC(C)CNC[C@@H](C)N Amb28341760 [0,1,0,0,0,0|2,0,1]=4 3948 B8R0.28 CC(C)CNC[C@H](C)N Amb27956495 [0,1,0,0,0,0|2,0,1]=4 3949 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,1,0,0,0,0|2,0,0]=3 3950 B8R0.28 CC(C)COCC(C)C Amb9787620 [0,1,0,0,0,0|2,0,1]=4 3951 B8R0.28 CC(C)COCC(C)N Amb13952731 [0,1,0,0,0,0|2,0,1]=4 3952 B8R0.28 CC(C)COCC(C)N Amb6660615 [0,1,0,0,0,0|2,0,1]=4 3953 B8R0.28 CC(C)COCC(C)O Amb9787471 [0,1,0,0,0,0|1,0,2]=4 3954 B8R0.28 CC(C)COCC(N)=S Amb6279156 [0,1,0,0,0,0|2,1,0]=4 3955 B8R0.28 CC(C)COC[C@@H](C)N Amb28146471 [0,1,0,0,0,0|2,0,1]=4 3956 B8R0.28 CC(C)COC[C@H](C)N Amb28285168 [0,1,0,0,0,0|2,0,1]=4 3957 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,1,0,0,0,0|2,0,0]=3 3958 B8R0.28 CC(C)CSCC(C)N Amb28285127 [0,1,0,0,0,0|2,0,1]=4 3959 B8R0.28 CC(C)CSCC(C)O Amb27260857 [0,1,0,0,0,0|1,0,2]=4 3960 B8R0.28 CC(C)C[AlH3+]CC(C)C Amb20240962 [0,1,0,0,0,0|2,0,1]=4 3961 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,1,0,0,0,0|1,0,2]=4 3962 B8R0.28 CC(C)C\C=N\S(C)=O Amb35681170 [0,1,0,0,0,0|2,0,1]=4 3963 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,1,0,0,0,0|2,0,0]=3 3964 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,1,0,0,0,0|2,0,0]=3 3965 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,1,0,0,0,0|2,0,0]=3 3966 B8R0.28 CC(C)NCCN(C)C Amb1111866 [0,1,0,0,0,0|3,0,0]=4 3967 B8R0.28 CC(C)NCCN(C)N Amb18642857 [0,1,0,0,0,0|3,0,0]=4 3968 B8R0.28 CC(C)NCCS(C)=O Amb27489425 [0,1,0,0,0,0|2,0,0]=3 3969 B8R0.28 CC(C)NCC[C@H](C)O Amb27829826 [0,1,0,0,0,0|1,0,2]=4 3970 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,1,0,0,0,0|3,0,0]=4 3971 B8R0.28 CC(C)OCCC(=N)N Amb32674823 [0,1,0,0,0,0|3,0,0]=4 3972 B8R0.28 CC(C)OCCC(=N)N Amb6276326 [0,1,0,0,0,0|3,0,0]=4 3973 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,1,0,0,0,0|2,0,0]=3 3974 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,1,0,0,0,0|2,0,0]=3 3975 B8R0.28 CC(C)OCCC(N)=S Amb6256598 [0,1,0,0,0,0|2,1,0]=4 3976 B8R0.28 CC(C)OCCN(C)C Amb27205777 [0,1,0,0,0,0|3,0,0]=4 3977 B8R0.28 CC(C)OCCN(C)N Amb28203943 [0,1,0,0,0,0|3,0,0]=4 3978 B8R0.28 CC(C)OCCN(C)O Amb33274847 [0,1,0,0,0,0|2,0,1]=4 3979 B8R0.28 CC(C)OCCS(=O)Cl Amb28286105 [0,1,0,0,0,0|3,0,0]=4 3980 B8R0.28 CC(C)OCCS(=O)[O-] Amb27476549 [0,1,0,0,0,0|3,0,0]=4 3981 B8R0.28 CC(C)OCCS(N)=O Amb32720491 [0,1,0,0,0,0|3,0,0]=4 3982 B8R0.28 CC(C)OCC[C@@H](C)N Amb27489790 [0,1,0,0,0,0|2,0,1]=4 3983 B8R0.28 CC(C)OCC[C@@H](C)O Amb28065212 [0,1,0,0,0,0|1,0,2]=4 3984 B8R0.28 CC(C)OCC[C@H](C)N Amb27264599 [0,1,0,0,0,0|2,0,1]=4 3985 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,1,0,0,0,0|1,0,2]=4 3986 B8R0.28 CC(C)OCC[N+](=O)[O-] Amb33274121 [0,1,0,0,0,0|3,0,0]=4 3987 B8R0.28 CC(C)SCCC(=N)N Amb27623018 [0,1,0,0,0,0|3,0,0]=4 3988 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,1,0,0,0,0|2,0,0]=3 3989 B8R0.28 CC(C)SCCC(N)=S Amb17307561 [0,1,0,0,0,0|2,1,0]=4 3990 B8R0.28 CC(C)SCCN(C)C Amb27241372 [0,1,0,0,0,0|3,0,0]=4 3991 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,1,0,0,0,0|1,0,2]=4 3992 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [0,1,0,0,0,0|1,0,0]=2 3993 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [0,1,0,0,0,0|1,0,0]=2 3994 B8R0.28 CC(Cl)CCCN(C)C Amb27790115 [0,1,0,0,0,0|2,0,0]=3 3995 B8R0.28 CC(Cl)CCCS(C)=O Amb27627114 [0,1,0,0,0,0|1,0,0]=2 3996 B8R0.28 CC(Cl)CCNC(C)C Amb28254047 [0,1,0,0,0,0|2,0,1]=4 3997 B8R0.28 CC(Cl)CCOC(C)C Amb27454710 [0,1,0,0,0,0|2,0,1]=4 3998 B8R0.28 CC(Cl)CNCC(C)Cl Amb17600138 [0,1,0,0,0,0|2,0,1]=4 3999 B8R0.28 CC(Cl)COCC(C)Cl Amb27165754 [0,1,0,0,0,0|2,0,1]=4 4000 B8R0.28 CC(Cl)CSCC(C)Cl Amb27637644 [0,1,0,0,0,0|2,0,1]=4 4001 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,1,0,0,0,0|1,0,0]=2 4002 B8R0.28 CC(F)CNCC(C)F Amb27959139 [0,1,0,0,0,0|2,0,1]=4 4003 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,1,0,0,0,0|1,0,0]=2 4004 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,1,0,0,0,0|1,0,0]=2 4005 B8R0.28 CC(N)CCCN(C)C Amb27398806 [0,1,0,0,0,0|2,0,0]=3 4006 B8R0.28 CC(N)CCNC(C)C Amb19008024 [0,1,0,0,0,0|2,0,1]=4 4007 B8R0.28 CC(N)CCOC(C)C Amb19025758 [0,1,0,0,0,0|2,0,1]=4 4008 B8R0.28 CC(N)CNCC(C)N Amb4034607 [0,1,0,0,0,0|2,0,1]=4 4009 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,1,0,0,0,0|2,0,0]=3 4010 B8R0.28 CC(N)CSCC(C)N Amb27249834 [0,1,0,0,0,0|2,0,1]=4 4011 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,1,0,0,0,0|1,0,2]=4 4012 B8R0.28 CC(O)CCC=C(Cl)Cl Amb35710409 [0,1,0,0,0,0|2,0,1]=4 4013 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,1,0,0,0,0|2,0,1]=4 4014 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,1,0,0,0,0|1,0,0]=2 4015 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [0,1,0,0,0,0|1,0,0]=2 4016 B8R0.28 CC(O)CCCC(N)=S Amb27265713 [0,1,0,0,0,0|1,1,0]=3 4017 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,1,0,0,0,0|2,0,0]=3 4018 B8R0.28 CC(O)CCNC(C)C Amb24117028 [0,1,0,0,0,0|1,0,2]=4 4019 B8R0.28 CC(O)CCNC(N)=S Amb27950544 [0,1,0,0,0,0|2,1,0]=4 4020 B8R0.28 CC(O)CCOC(C)C Amb28049548 [0,1,0,0,0,0|1,0,2]=4 4021 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,1,0,0,0,0|2,0,0]=3 4022 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,1,0,0,0,0|2,0,0]=3 4023 B8R0.28 CC(O)CNCC(C)O Amb4036799 [0,1,0,0,0,0|1,0,2]=4 4024 B8R0.28 CC(O)CNC[C@H](C)O Amb27236687 [0,1,0,0,0,0|1,0,2]=4 4025 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,1,0,0,0,0|2,0,0]=3 4026 B8R0.28 CC(O)COCC(C)O Amb8516611 [0,1,0,0,0,0|1,0,2]=4 4027 B8R0.28 CC(O)COCC(N)=O Amb27216633 [0,1,0,0,0,0|2,0,0]=3 4028 B8R0.28 CC(O)COC[C@H](C)O Amb27470308 [0,1,0,0,0,0|1,0,2]=4 4029 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,1,0,0,0,0|2,0,0]=3 4030 B8R0.28 CN(C)CCCC(=N)N Amb32751305 [0,1,0,0,0,0|3,0,0]=4 4031 B8R0.28 CN(C)CCCC(=N)N Amb6278287 [0,1,0,0,0,0|3,0,0]=4 4032 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [0,1,0,0,0,0|2,0,0]=3 4033 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [0,1,0,0,0,0|2,0,0]=3 4034 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,1,0,0,0,0|2,0,0]=3 4035 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,1,0,0,0,0|2,0,0]=3 4036 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [0,1,0,0,0,0|2,0,0]=3 4037 B8R0.28 CN(C)CCCC(N)=S Amb6256460 [0,1,0,0,0,0|2,1,0]=4 4038 B8R0.28 CN(C)CCCN(C)C Amb4037025 [0,1,0,0,0,0|3,0,0]=4 4039 B8R0.28 CN(C)CCCN(C)O Amb33272648 [0,1,0,0,0,0|2,0,1]=4 4040 B8R0.28 CN(C)CCCS(=O)[O-] Amb32755542 [0,1,0,0,0,0|3,0,0]=4 4041 B8R0.28 CN(C)CCC[N+](=O)[O-] Amb26394292 [0,1,0,0,0,0|3,0,0]=4 4042 B8R0.28 CN(C)CCNC(N)=O Amb1129425 [0,1,0,0,0,0|3,0,0]=4 4043 B8R0.28 CN(C)CCNC(N)=O Amb33552131 [0,1,0,0,0,0|3,0,0]=4 4044 B8R0.28 CN(C)CCOC(N)=O Amb28423955 [0,1,0,0,0,0|3,0,0]=4 4045 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,1,0,0,0,0|3,0,0]=4 4046 B8R0.28 CN(C)NCCS(C)=O Amb27795934 [0,1,0,0,0,0|3,0,0]=4 4047 B8R0.28 CP(C)CCCP(C)C Amb22731671 [0,1,0,0,0,0|3,0,0]=4 4048 B8R0.28 CS(=O)CCNC(=O)Cl Amb35633190 [0,1,0,0,0,0|3,0,0]=4 4049 B8R0.28 C[C@@H](N)CCCN(C)C Amb33272249 [0,1,0,0,0,0|2,0,0]=3 4050 B8R0.28 C[C@@H](O)CCCN(C)C Amb33272247 [0,1,0,0,0,0|2,0,0]=3 4051 B8R0.28 C[C@@H](O)CCC[C@@H](C)O Amb4166306 [0,1,0,0,0,0|0,0,2]=3 4052 B8R0.28 C[C@@H](O)CCNC(=N)N Amb28063422 [0,1,0,0,0,0|3,0,0]=4 4053 B8R0.28 C[C@H](N)CCCN(C)C Amb33272875 [0,1,0,0,0,0|2,0,0]=3 4054 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,1,0,0,0,0|1,0,2]=4 4055 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,1,0,0,0,0|1,0,2]=4 4056 B8R0.28 C[C@H](O)CCCN(C)C Amb33272243 [0,1,0,0,0,0|2,0,0]=3 4057 B8R0.28 C[C@H](O)CCNC(=N)N Amb27211779 [0,1,0,0,0,0|3,0,0]=4 4058 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,1,0,0,0,0|2,0,0]=3 4059 B8R0.28 C[C@H](O)COC[C@H](C)O Amb27662102 [0,1,0,0,0,0|1,0,2]=4 4060 B8R0.28 C[C@H](O)CSC[C@H](C)O Amb27603289 [0,1,0,0,0,0|1,0,2]=4 4061 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,1,0,0,0,0|1,0,2]=4 4062 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,1,0,0,0,0|2,0,0]=3 4063 B8R0.28 C\C(Br)=C/CCC(C)C Amb8389870 [0,1,0,0,0,0|1,0,1]=3 4064 B8R0.28 C\C(Cl)=C\CCC(C)O Amb27653025 [0,1,0,0,0,0|1,0,1]=3 4065 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,1,0,0,0,0|2,0,1]=4 4066 B8R0.28 NC(=O)CCC[N+](=O)[O-] Amb22432425 [0,1,0,0,0,0|3,0,0]=4 4067 B8R0.28 NC(=O)CCSC(F)F Amb27809296 [0,1,0,0,0,0|3,0,0]=4 4068 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,1,0,0,0,0|2,0,1]=4 4069 B8R0.28 O=C(Cl)CCCC(=O)Cl Amb3940242 [0,1,0,0,0,0|2,0,1]=4 4070 B8R0.28 O=C(Cl)NCCC(F)F Amb35625886 [0,1,0,0,0,0|3,0,0]=4 4071 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,1,0,0,0,0|2,0,1]=4 4072 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [0,1,0,0,0,0|2,0,0]=3 4073 B8R0.28 O=C(O)CCCN(Cl)Cl Amb28313437 [0,1,0,0,0,0|3,0,0]=4 4074 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [0,1,0,0,0,0|3,0,0]=4 4075 B8R0.28 O=C(O)CCSC(F)F Amb8840854 [0,1,0,0,0,0|3,0,0]=4 4076 B8R0.28 O=C(O)COCC(F)F Amb27218102 [0,1,0,0,0,0|3,0,0]=4 4077 B8R0.28 O=C(O)CSCC(F)F Amb18791606 [0,1,0,0,0,0|3,0,0]=4 4078 B8R1.1 C=C1CCC(C#N)C1 Amb18641604 [0,0,0,1,0,0|2,0,1]=4 4079 B8R1.1 C=C1CCC(CO)C1 Amb27869714 [0,0,0,1,0,0|2,0,0]=3 4080 B8R1.1 C=C1CC[C@H](CO)C1 Amb28430210 [0,0,0,1,0,0|2,0,0]=3 4081 B8R1.1 C=C1CN[C@H](CO)C1 Amb27205082 [0,0,0,1,0,0|3,0,0]=4 4082 B8R1.1 C=C1COC(CC)C1 Amb35614622 [0,0,0,1,0,0|2,0,0]=3 4083 B8R1.1 C=CC1CCC(=O)C1 Amb26592031 [0,0,0,1,0,0|0,0,2]=3 4084 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,0,0,1,0,0|1,0,2]=4 4085 B8R1.1 C=CC1CCC(=O)O1 Amb33249669 [0,0,0,1,0,0|1,0,2]=4 4086 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,0,0,1,0,0|1,0,2]=4 4087 B8R1.1 C=C[C@@H]1CCC(=O)N1 Amb27838334 [0,0,0,1,0,0|1,0,2]=4 4088 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,0,0,1,0,0|1,0,2]=4 4089 B8R1.1 C=C[C@H]1CCC(=O)N1 Amb27459295 [0,0,0,1,0,0|1,0,2]=4 4090 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,0,0,1,0,0|1,0,2]=4 4091 B8R1.1 CC1=CC(CO)SC1 Amb27197197 [0,0,0,1,0,0|3,0,0]=4 4092 B8R1.1 CC1=CC[C@@H](CO)C1 Amb24481425 [0,0,0,1,0,0|2,0,1]=4 4093 B8R1.1 CC1=NC(CCl)CO1 Amb27809665 [0,0,0,1,0,0|3,0,0]=4 4094 B8R1.1 CC1=NC(CF)CO1 Amb27491686 [0,0,0,1,0,0|3,0,0]=4 4095 B8R1.1 CC1=NC(CO)CN1 Amb27635310 [0,0,0,1,0,0|3,0,0]=4 4096 B8R1.1 CC1CCC(CBr)C1 Amb27165684 [0,0,0,1,0,0|2,0,1]=4 4097 B8R1.1 CC1CCC(CCl)C1 Amb27172991 [0,0,0,1,0,0|2,0,1]=4 4098 B8R1.1 CC1CCC(CI)O1 Amb28386366 [0,0,0,1,0,0|1,0,2]=4 4099 B8R1.1 CC1CCC(CN)C1 Amb33528071 [0,0,0,1,0,0|2,0,1]=4 4100 B8R1.1 CC1CCC(CN)O1 Amb33551292 [0,0,0,1,0,0|1,0,2]=4 4101 B8R1.1 CC1CCC(CO)N1 Amb26316183 [0,0,0,1,0,0|2,0,1]=4 4102 B8R1.1 CC1CCC(CO)N1 Amb32666058 [0,0,0,1,0,0|2,0,1]=4 4103 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,0,0,1,0,0|1,0,2]=4 4104 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [0,0,0,1,0,0|0,0,2]=3 4105 B8R1.1 CCC1=CC(C)CC1 Amb25810526 [0,0,0,1,0,0|1,0,2]=4 4106 B8R1.1 CCC1=CCC(=O)O1 Amb27974572 [0,0,0,1,0,0|1,0,2]=4 4107 B8R1.1 CCC1=CCC(=O)S1 Amb27631498 [0,0,0,1,0,0|1,0,2]=4 4108 B8R1.1 CCC1=CCC(C)=C1 Amb22229283 [0,0,0,1,0,0|1,0,2]=4 4109 B8R1.1 CCC1=NNC(=O)C1 Amb4335453 [0,0,0,1,0,0|2,0,1]=4 4110 B8R1.1 CCC1=NOC(=O)C1 Amb26614539 [0,0,0,1,0,0|2,0,1]=4 4111 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,0,0,1,0,0|1,0,2]=4 4112 B8R1.1 CCC1CC(=O)CO1 Amb27856666 [0,0,0,1,0,0|1,0,0]=2 4113 B8R1.1 CCC1CC(=O)NN1 Amb29862365 [0,0,0,1,0,0|2,0,0]=3 4114 B8R1.1 CCC1CC(Br)CO1 Amb27657725 [0,0,0,1,0,0|2,0,1]=4 4115 B8R1.1 CCC1CC(C)CN1 Amb19375396 [0,0,0,1,0,0|2,0,1]=4 4116 B8R1.1 CCC1CC(Cl)CO1 Amb29870833 [0,0,0,1,0,0|2,0,1]=4 4117 B8R1.1 CCC1CC(F)CN1 Amb28199169 [0,0,0,1,0,0|2,0,1]=4 4118 B8R1.1 CCC1CC(N)CO1 Amb29866234 [0,0,0,1,0,0|2,0,1]=4 4119 B8R1.1 CCC1CC(O)CN1 Amb27398576 [0,0,0,1,0,0|1,0,2]=4 4120 B8R1.1 CCC1CC(O)CN1 Amb32753264 [0,0,0,1,0,0|1,0,2]=4 4121 B8R1.1 CCC1CC(S)CO1 Amb32788423 [0,0,0,1,0,0|1,1,1]=4 4122 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,0,0,1,0,0|1,0,0]=2 4123 B8R1.1 CCC1CCC(=O)O1 Amb3941505 [0,0,0,1,0,0|1,0,0]=2 4124 B8R1.1 CCC1CCC(C)C1 Amb4016287 [0,0,0,1,0,0|1,0,1]=3 4125 B8R1.1 CCC1CCC(C)N1 Amb25786145 [0,0,0,1,0,0|1,0,1]=3 4126 B8R1.1 CCC1CCC(C)N1 Amb28934845 [0,0,0,1,0,0|1,0,1]=3 4127 B8R1.1 CCC1CCC(Cl)C1 Amb27169802 [0,0,0,1,0,0|1,0,1]=3 4128 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,0,0,1,0,0|0,0,2]=3 4129 B8R1.1 CCC1CCC(O)O1 Amb27804358 [0,0,0,1,0,0|1,0,2]=4 4130 B8R1.1 CCC1CCC(S)C1 Amb25082172 [0,0,0,1,0,0|0,1,1]=3 4131 B8R1.1 CCC1CCN(N)C1 Amb26475629 [0,0,0,1,0,0|2,0,0]=3 4132 B8R1.1 CCC1CN=C(Br)S1 Amb27783911 [0,0,0,1,0,0|2,1,0]=4 4133 B8R1.1 CCC1CN=C(C)N1 Amb25732193 [0,0,0,1,0,0|2,0,0]=3 4134 B8R1.1 CCC1CN=C(C)S1 Amb25197984 [0,0,0,1,0,0|1,1,0]=3 4135 B8R1.1 CCC1CN=C(Cl)S1 Amb28315725 [0,0,0,1,0,0|2,1,0]=4 4136 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,0,0,1,0,0|1,0,0]=2 4137 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,0,0,1,0,0|2,0,0]=3 4138 B8R1.1 CCC1CNC(=O)O1 Amb27237218 [0,0,0,1,0,0|2,0,0]=3 4139 B8R1.1 CCC1CNC(=S)S1 Amb28428460 [0,0,0,1,0,0|2,1,0]=4 4140 B8R1.1 CCC1CNC(C)C1 Amb27880324 [0,0,0,1,0,0|2,0,1]=4 4141 B8R1.1 CCC1CNC(S)=N1 Amb25072509 [0,0,0,1,0,0|2,1,0]=4 4142 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,0,0,1,0,0|1,0,0]=2 4143 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,0|2,0,0]=3 4144 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,0,0,1,0,0|2,0,0]=3 4145 B8R1.1 CCC1COC(=S)N1 Amb27264047 [0,0,0,1,0,0|2,1,0]=4 4146 B8R1.1 CCC1CSC(=S)N1 Amb25078191 [0,0,0,1,0,0|2,1,0]=4 4147 B8R1.1 CCC1CSC(Br)=N1 Amb25749236 [0,0,0,1,0,0|3,0,0]=4 4148 B8R1.1 CCC1CSC(C)=N1 Amb24325349 [0,0,0,1,0,0|2,0,0]=3 4149 B8R1.1 CCC1CSC(Cl)=N1 Amb28049028 [0,0,0,1,0,0|3,0,0]=4 4150 B8R1.1 CCC1N=C(C)CS1 Amb24664975 [0,0,0,1,0,0|2,0,0]=3 4151 B8R1.1 CCC1OCC(C)O1 Amb19892405 [0,0,0,1,0,0|1,0,2]=4 4152 B8R1.1 CCN1CCC(N)=N1 Amb27875572 [0,0,0,1,0,0|3,0,0]=4 4153 B8R1.1 CCN1CCC(N)C1 Amb28992626 [0,0,0,1,0,0|2,0,1]=4 4154 B8R1.1 CCN1CCC(N)C1 Amb33528251 [0,0,0,1,0,0|2,0,1]=4 4155 B8R1.1 CCN1CCC(O)C1 Amb3939019 [0,0,0,1,0,0|1,0,2]=4 4156 B8R1.1 CCN1CCC(S)C1 Amb26356699 [0,0,0,1,0,0|1,1,1]=4 4157 B8R1.1 CCN1CC[C@@H](Cl)C1 Amb28315138 [0,0,0,1,0,0|2,0,1]=4 4158 B8R1.1 CCN1CC[C@@H](N)C1 Amb19892061 [0,0,0,1,0,0|2,0,1]=4 4159 B8R1.1 CCN1CC[C@@H](N)C1 Amb28398590 [0,0,0,1,0,0|2,0,1]=4 4160 B8R1.1 CCN1CC[C@H](N)C1 Amb19892530 [0,0,0,1,0,0|2,0,1]=4 4161 B8R1.1 CCN1CC[C@H](N)C1 Amb25084601 [0,0,0,1,0,0|2,0,1]=4 4162 B8R1.1 CC[C@@H]1C=CC(=O)O1 Amb27954643 [0,0,0,1,0,0|1,0,2]=4 4163 B8R1.1 CC[C@@H]1CCC(=O)O1 Amb26626757 [0,0,0,1,0,0|1,0,0]=2 4164 B8R1.1 CC[C@@H]1CC[C@H](O)C1 Amb27626637 [0,0,0,1,0,0|0,0,2]=3 4165 B8R1.1 CC[C@@H]1COC(=S)N1 Amb27838333 [0,0,0,1,0,0|2,1,0]=4 4166 B8R1.1 CC[C@@H]1C[C@H](C)CN1 Amb18833051 [0,0,0,1,0,0|2,0,1]=4 4167 B8R1.1 CC[C@@H]1C[C@H](O)CN1 Amb27787989 [0,0,0,1,0,0|1,0,2]=4 4168 B8R1.1 CC[C@H]1C=CC(=O)O1 Amb28195329 [0,0,0,1,0,0|1,0,2]=4 4169 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,0,0,1,0,0|1,0,0]=2 4170 B8R1.1 CC[C@H]1CC[C@@H](C)C1 Amb27780680 [0,0,0,1,0,0|1,0,1]=3 4171 B8R1.1 CC[C@H]1CNC(=O)O1 Amb27954656 [0,0,0,1,0,0|2,0,0]=3 4172 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,0,0,1,0,0|2,0,0]=3 4173 B8R1.1 CC[C@H]1COC(=S)N1 Amb27596053 [0,0,0,1,0,0|2,1,0]=4 4174 B8R1.1 CC[C@H]1CSC(=S)N1 Amb27810512 [0,0,0,1,0,0|2,1,0]=4 4175 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676625 [0,0,0,1,0,0|1,0,2]=4 4176 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676626 [0,0,0,1,0,0|1,0,2]=4 4177 B8R1.1 CN1CCC(CBr)C1 Amb19516954 [0,0,0,1,0,0|3,0,0]=4 4178 B8R1.1 CN1CCC(CBr)C1 Amb20668372 [0,0,0,1,0,0|3,0,0]=4 4179 B8R1.1 CN1CCC(CCl)C1 Amb1090894 [0,0,0,1,0,0|3,0,0]=4 4180 B8R1.1 CN1CCC(CCl)C1 Amb21961466 [0,0,0,1,0,0|3,0,0]=4 4181 B8R1.1 CN1CCC(CN)C1 Amb21857704 [0,0,0,1,0,0|3,0,0]=4 4182 B8R1.1 CN1CCC(CN)C1 Amb2237146 [0,0,0,1,0,0|3,0,0]=4 4183 B8R1.1 CN1CCC(CO)C1 Amb33530057 [0,0,0,1,0,0|3,0,0]=4 4184 B8R1.1 CN1CCC(CS)C1 Amb27165502 [0,0,0,1,0,0|3,0,0]=4 4185 B8R1.1 CN1CC[C@@H](CN)C1 Amb27147412 [0,0,0,1,0,0|3,0,0]=4 4186 B8R1.1 CN1CC[C@@H](CN)C1 Amb33801369 [0,0,0,1,0,0|3,0,0]=4 4187 B8R1.1 CN1CC[C@@H](CO)C1 Amb25831158 [0,0,0,1,0,0|3,0,0]=4 4188 B8R1.1 CN1CC[C@H](CN)C1 Amb23439250 [0,0,0,1,0,0|3,0,0]=4 4189 B8R1.1 CN1CC[C@H](CN)C1 Amb30633705 [0,0,0,1,0,0|3,0,0]=4 4190 B8R1.1 CN1CC[C@H](CO)C1 Amb22744754 [0,0,0,1,0,0|3,0,0]=4 4191 B8R1.1 CNC1CCC(=O)C1 Amb28316112 [0,0,0,1,0,0|1,0,0]=2 4192 B8R1.1 CNC1CCC(C)C1 Amb24271088 [0,0,0,1,0,0|2,0,1]=4 4193 B8R1.1 CNC1CCC(N)C1 Amb28422900 [0,0,0,1,0,0|2,0,1]=4 4194 B8R1.1 CNC1CCC(O)C1 Amb27595077 [0,0,0,1,0,0|1,0,2]=4 4195 B8R1.1 CNC1CCN(C)C1 Amb32410222 [0,0,0,1,0,0|3,0,0]=4 4196 B8R1.1 CNC1CCN(C)C1 Amb33528221 [0,0,0,1,0,0|3,0,0]=4 4197 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,0,0,1,0,0|2,0,0]=3 4198 B8R1.1 CNC1COC(=O)C1 Amb26505382 [0,0,0,1,0,0|2,0,0]=3 4199 B8R1.1 CN[C@@H]1CCN(C)C1 Amb22230913 [0,0,0,1,0,0|3,0,0]=4 4200 B8R1.1 CN[C@H]1CCN(C)C1 Amb22230931 [0,0,0,1,0,0|3,0,0]=4 4201 B8R1.1 COC1=CC(=O)CC1 Amb21864758 [0,0,0,1,0,0|1,0,2]=4 4202 B8R1.1 COC1CC(=O)CO1 Amb27409395 [0,0,0,1,0,0|2,0,0]=3 4203 B8R1.1 COC1CCC(=O)C1 Amb24483163 [0,0,0,1,0,0|1,0,0]=2 4204 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,0,0,1,0,0|2,0,0]=3 4205 B8R1.1 COC1CCC(Br)C1 Amb27760426 [0,0,0,1,0,0|2,0,1]=4 4206 B8R1.1 COC1CCC(C)N1 Amb27838380 [0,0,0,1,0,0|2,0,1]=4 4207 B8R1.1 COC1CCC(N)C1 Amb24183578 [0,0,0,1,0,0|2,0,1]=4 4208 B8R1.1 COC1CCC(N)C1 Amb33541943 [0,0,0,1,0,0|2,0,1]=4 4209 B8R1.1 COC1CCC(O)C1 Amb26330676 [0,0,0,1,0,0|1,0,2]=4 4210 B8R1.1 COC1CCN(N)C1 Amb27196206 [0,0,0,1,0,0|3,0,0]=4 4211 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,0,0,1,0,0|2,0,0]=3 4212 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,0,0,1,0,0|3,0,0]=4 4213 B8R1.1 COC1CSC(C)=N1 Amb28041660 [0,0,0,1,0,0|3,0,0]=4 4214 B8R1.1 CO[C@@H]1CC[C@@H](N)C1 Amb31308566 [0,0,0,1,0,0|2,0,1]=4 4215 B8R1.1 CO[C@@H]1CC[C@@H](N)C1 Amb34164914 [0,0,0,1,0,0|2,0,1]=4 4216 B8R1.1 CO[C@@H]1CC[C@H](O)C1 Amb25913334 [0,0,0,1,0,0|1,0,2]=4 4217 B8R1.1 CO[C@H]1CC[C@@H](N)C1 Amb27630701 [0,0,0,1,0,0|2,0,1]=4 4218 B8R1.1 CO[C@H]1CC[C@@H](N)C1 Amb34912797 [0,0,0,1,0,0|2,0,1]=4 4219 B8R1.1 CO[C@H]1CC[C@H](N)C1 Amb33871487 [0,0,0,1,0,0|2,0,1]=4 4220 B8R1.1 CSC1CCC(=O)C1 Amb28184431 [0,0,0,1,0,0|1,0,0]=2 4221 B8R1.1 CSC1CCC(N)C1 Amb19337233 [0,0,0,1,0,0|2,0,1]=4 4222 B8R1.1 CSC1CCC(O)C1 Amb33620320 [0,0,0,1,0,0|1,0,2]=4 4223 B8R1.1 CSC1COC(=O)O1 Amb27395888 [0,0,0,1,0,0|3,0,0]=4 4224 B8R1.1 C[C@@H]1CCC(CBr)O1 Amb33331125 [0,0,0,1,0,0|1,0,2]=4 4225 B8R1.1 C[C@@H]1CCC(CN)O1 Amb33423847 [0,0,0,1,0,0|1,0,2]=4 4226 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,0,0,1,0,0|1,0,2]=4 4227 B8R1.1 C[C@@H]1CCC(CS)O1 Amb32730401 [0,0,0,1,0,0|1,0,2]=4 4228 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb24679369 [0,0,0,1,0,0|2,0,1]=4 4229 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb30594251 [0,0,0,1,0,0|2,0,1]=4 4230 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,0,0,1,0,0|1,0,2]=4 4231 B8R1.1 C[C@H]1CCC(CCl)O1 Amb27874116 [0,0,0,1,0,0|1,0,2]=4 4232 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb22886262 [0,0,0,1,0,0|2,0,1]=4 4233 B8R1.1 C[C@H]1CC[C@@H](CO)O1 Amb27640536 [0,0,0,1,0,0|1,0,2]=4 4234 B8R1.1 C[C@H]1CC[C@H](CO)O1 Amb27484806 [0,0,0,1,0,0|1,0,2]=4 4235 B8R1.1 C\C=C1\CCC(=O)O1 Amb27421031 [0,0,0,1,0,0|1,0,2]=4 4236 B8R1.1 C\N=C1/CCC(=O)N1 Amb26457426 [0,0,0,1,0,0|2,0,1]=4 4237 B8R1.1 FC1CCC(CBr)C1 Amb32943806 [0,0,0,1,0,0|2,0,1]=4 4238 B8R1.1 FC1CCC(CCl)C1 Amb32943805 [0,0,0,1,0,0|2,0,1]=4 4239 B8R1.1 N#CC1CCC(=O)C1 Amb22886979 [0,0,0,1,0,0|1,0,1]=3 4240 B8R1.1 N#CC1CCC(=O)N1 Amb26361514 [0,0,0,1,0,0|2,0,1]=4 4241 B8R1.1 N#CC1CNC(=O)C1 Amb25873600 [0,0,0,1,0,0|2,0,1]=4 4242 B8R1.1 N#C[C@H]1CCC(=O)C1 Amb26562820 [0,0,0,1,0,0|1,0,1]=3 4243 B8R1.1 N#C[C@H]1CCC(=O)N1 Amb27404492 [0,0,0,1,0,0|2,0,1]=4 4244 B8R1.1 N=C1CC[C@H](CO)N1 Amb27431528 [0,0,0,1,0,0|3,0,0]=4 4245 B8R1.1 NC1CCC(CO)C1 Amb18641837 [0,0,0,1,0,0|2,0,1]=4 4246 B8R1.1 NC1CCC(CO)C1 Amb32666336 [0,0,0,1,0,0|2,0,1]=4 4247 B8R1.1 NC1CCC(CS)C1 Amb29855102 [0,0,0,1,0,0|2,0,1]=4 4248 B8R1.1 NCC1CCC(=O)C1 Amb24644946 [0,0,0,1,0,0|1,0,0]=2 4249 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,0,0,1,0,0|2,0,0]=3 4250 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,0,0,1,0,0|2,0,0]=3 4251 B8R1.1 NCC1CCC(=O)N1 Amb2699145 [0,0,0,1,0,0|2,0,0]=3 4252 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,0,0,1,0,0|2,0,0]=3 4253 B8R1.1 NCC1CCC(=O)O1 Amb28934914 [0,0,0,1,0,0|2,0,0]=3 4254 B8R1.1 NCC1CCC(F)C1 Amb22886212 [0,0,0,1,0,0|2,0,1]=4 4255 B8R1.1 NCC1CCC(F)C1 Amb23456103 [0,0,0,1,0,0|2,0,1]=4 4256 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,0,0,1,0,0|1,0,2]=4 4257 B8R1.1 NCC1CCC(O)C1 Amb33547590 [0,0,0,1,0,0|1,0,2]=4 4258 B8R1.1 NCC1CCC(S)C1 Amb32788858 [0,0,0,1,0,0|1,1,1]=4 4259 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,0,0,1,0,0|2,0,0]=3 4260 B8R1.1 NCC1CNC(=O)C1 Amb32434789 [0,0,0,1,0,0|2,0,0]=3 4261 B8R1.1 NCC1CNC(=O)C1 Amb8009790 [0,0,0,1,0,0|2,0,0]=3 4262 B8R1.1 NCC1CNC(=O)N1 Amb32666643 [0,0,0,1,0,0|3,0,0]=4 4263 B8R1.1 NCC1CNC(=O)N1 Amb33339243 [0,0,0,1,0,0|3,0,0]=4 4264 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,0,0,1,0,0|3,0,0]=4 4265 B8R1.1 NCC1CNC(=O)O1 Amb33527727 [0,0,0,1,0,0|3,0,0]=4 4266 B8R1.1 NCC1COC(=O)N1 Amb27852206 [0,0,0,1,0,0|3,0,0]=4 4267 B8R1.1 NCC1COC(=O)N1 Amb28934922 [0,0,0,1,0,0|3,0,0]=4 4268 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,0,0,1,0,0|2,0,0]=3 4269 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb2699146 [0,0,0,1,0,0|2,0,0]=3 4270 B8R1.1 NC[C@@H]1CC[C@@H](F)C1 Amb22886221 [0,0,0,1,0,0|2,0,1]=4 4271 B8R1.1 NC[C@@H]1CC[C@@H](F)C1 Amb24641345 [0,0,0,1,0,0|2,0,1]=4 4272 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 Amb10066974 [0,0,0,1,0,0|1,0,2]=4 4273 B8R1.1 NC[C@@H]1CC[C@H](F)C1 Amb33714554 [0,0,0,1,0,0|2,0,1]=4 4274 B8R1.1 NC[C@@H]1CC[C@H](O)C1 Amb10066982 [0,0,0,1,0,0|1,0,2]=4 4275 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,0,0,1,0,0|2,0,0]=3 4276 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,0,0,1,0,0|2,0,0]=3 4277 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,0,0,1,0,0|3,0,0]=4 4278 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,0,0,1,0,0|3,0,0]=4 4279 B8R1.1 NC[C@H]1CCC(=O)N1 Amb2699147 [0,0,0,1,0,0|2,0,0]=3 4280 B8R1.1 NC[C@H]1CCC(=O)N1 Amb32721612 [0,0,0,1,0,0|2,0,0]=3 4281 B8R1.1 NC[C@H]1CC[C@@H](O)C1 Amb10066975 [0,0,0,1,0,0|1,0,2]=4 4282 B8R1.1 NC[C@H]1CNC(=O)C1 Amb27797276 [0,0,0,1,0,0|2,0,0]=3 4283 B8R1.1 NC[C@H]1CNC(=O)C1 Amb31204575 [0,0,0,1,0,0|2,0,0]=3 4284 B8R1.1 NC[C@H]1CNC(=O)O1 Amb27403470 [0,0,0,1,0,0|3,0,0]=4 4285 B8R1.1 NC[C@H]1CNC(=O)O1 Amb30869777 [0,0,0,1,0,0|3,0,0]=4 4286 B8R1.1 N[C@@H]1CC[C@@H](CO)C1 Amb24603976 [0,0,0,1,0,0|2,0,1]=4 4287 B8R1.1 N[C@@H]1CC[C@H](CO)C1 Amb24526904 [0,0,0,1,0,0|2,0,1]=4 4288 B8R1.1 N[C@H]1CC[C@@H](CF)C1 Amb23598383 [0,0,0,1,0,0|2,0,1]=4 4289 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb26949648 [0,0,0,1,0,0|2,0,1]=4 4290 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb32661812 [0,0,0,1,0,0|2,0,1]=4 4291 B8R1.1 O=C1CC(CBr)CN1 Amb33548071 [0,0,0,1,0,0|2,0,0]=3 4292 B8R1.1 O=C1CC(CCl)CN1 Amb27259904 [0,0,0,1,0,0|2,0,0]=3 4293 B8R1.1 O=C1CC(CF)CN1 Amb33379247 [0,0,0,1,0,0|2,0,0]=3 4294 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,0,0,1,0,0|2,0,0]=3 4295 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,0,0,1,0,0|2,0,0]=3 4296 B8R1.1 O=C1CC(CO)CN1 Amb9902173 [0,0,0,1,0,0|2,0,0]=3 4297 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [0,0,0,1,0,0|2,0,0]=3 4298 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [0,0,0,1,0,0|3,0,0]=4 4299 B8R1.1 O=C1CC(CS)CN1 Amb27850787 [0,0,0,1,0,0|2,0,0]=3 4300 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,0,0,1,0,0|2,0,0]=3 4301 B8R1.1 O=C1CCC(CBr)N1 Amb32752580 [0,0,0,1,0,0|2,0,0]=3 4302 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,0,0,1,0,0|2,0,0]=3 4303 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,0,0,1,0,0|2,0,0]=3 4304 B8R1.1 O=C1CCC(CCl)O1 Amb10608418 [0,0,0,1,0,0|2,0,0]=3 4305 B8R1.1 O=C1CCC(CF)N1 Amb27838313 [0,0,0,1,0,0|2,0,0]=3 4306 B8R1.1 O=C1CCC(CI)C1 Amb27481152 [0,0,0,1,0,0|1,0,0]=2 4307 B8R1.1 O=C1CCC(CI)N1 Amb25955610 [0,0,0,1,0,0|2,0,0]=3 4308 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,0,0,1,0,0|2,0,0]=3 4309 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [0,0,0,1,0,0|1,0,0]=2 4310 B8R1.1 O=C1CCC(CO)N1 Amb33544815 [0,0,0,1,0,0|2,0,0]=3 4311 B8R1.1 O=C1CCC(CO)O1 Amb20240701 [0,0,0,1,0,0|2,0,0]=3 4312 B8R1.1 O=C1CCC(CO)S1 Amb28202904 [0,0,0,1,0,0|2,0,0]=3 4313 B8R1.1 O=C1CCC(CS)C1 Amb27828867 [0,0,0,1,0,0|1,0,0]=2 4314 B8R1.1 O=C1CCC(CS)N1 Amb32788463 [0,0,0,1,0,0|2,0,0]=3 4315 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb2694702 [0,0,0,1,0,0|2,0,0]=3 4316 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb32664923 [0,0,0,1,0,0|2,0,0]=3 4317 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,0,0,1,0,0|2,0,0]=3 4318 B8R1.1 O=C1CC[C@@H](CI)O1 Amb27175447 [0,0,0,1,0,0|2,0,0]=3 4319 B8R1.1 O=C1CC[C@@H](CO)N1 Amb2371840 [0,0,0,1,0,0|2,0,0]=3 4320 B8R1.1 O=C1CC[C@@H](CO)O1 Amb8515911 [0,0,0,1,0,0|2,0,0]=3 4321 B8R1.1 O=C1CC[C@H](CBr)C1 Amb26032409 [0,0,0,1,0,0|1,0,0]=2 4322 B8R1.1 O=C1CC[C@H](CBr)N1 Amb2695539 [0,0,0,1,0,0|2,0,0]=3 4323 B8R1.1 O=C1CC[C@H](CCl)N1 Amb26508557 [0,0,0,1,0,0|2,0,0]=3 4324 B8R1.1 O=C1CC[C@H](CO)N1 Amb2694795 [0,0,0,1,0,0|2,0,0]=3 4325 B8R1.1 O=C1CC[C@H](CO)O1 Amb4037005 [0,0,0,1,0,0|2,0,0]=3 4326 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [0,0,0,1,0,0|2,0,0]=3 4327 B8R1.1 O=C1COC(CO)C1 Amb24117838 [0,0,0,1,0,0|2,0,0]=3 4328 B8R1.1 O=C1COC(CO)N1 Amb27789986 [0,0,0,1,0,0|3,0,0]=4 4329 B8R1.1 O=C1C[C@@H](CBr)CO1 Amb27590526 [0,0,0,1,0,0|2,0,0]=3 4330 B8R1.1 O=C1C[C@@H](CO)CN1 Amb24515579 [0,0,0,1,0,0|2,0,0]=3 4331 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,0,0,1,0,0|2,0,0]=3 4332 B8R1.1 O=C1C[C@H](CO)CN1 Amb25745471 [0,0,0,1,0,0|2,0,0]=3 4333 B8R1.1 O=C1NC(CCl)CO1 Amb28282690 [0,0,0,1,0,0|3,0,0]=4 4334 B8R1.1 O=C1NC(CF)CO1 Amb33358226 [0,0,0,1,0,0|3,0,0]=4 4335 B8R1.1 O=C1NC(CO)CO1 Amb22410779 [0,0,0,1,0,0|3,0,0]=4 4336 B8R1.1 O=C1NC(CO)CS1 Amb27170689 [0,0,0,1,0,0|3,0,0]=4 4337 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,0,0,1,0,0|3,0,0]=4 4338 B8R1.1 O=C1NCC(CBr)S1 Amb7968758 [0,0,0,1,0,0|3,0,0]=4 4339 B8R1.1 O=C1NCC(CCl)O1 Amb1152954 [0,0,0,1,0,0|3,0,0]=4 4340 B8R1.1 O=C1NCC(CF)O1 Amb33379234 [0,0,0,1,0,0|3,0,0]=4 4341 B8R1.1 O=C1NCC(CI)O1 Amb28282085 [0,0,0,1,0,0|3,0,0]=4 4342 B8R1.1 O=C1NCC(CO)O1 Amb9421413 [0,0,0,1,0,0|3,0,0]=4 4343 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,0,0,1,0,0|3,0,0]=4 4344 B8R1.1 O=C1NC[C@@H](CBr)O1 Amb27401944 [0,0,0,1,0,0|3,0,0]=4 4345 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,0,0,1,0,0|3,0,0]=4 4346 B8R1.1 O=C1NC[C@@H](CO)N1 Amb33482781 [0,0,0,1,0,0|3,0,0]=4 4347 B8R1.1 O=C1NC[C@@H](CO)O1 Amb24183552 [0,0,0,1,0,0|3,0,0]=4 4348 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,0,0,1,0,0|3,0,0]=4 4349 B8R1.1 O=C1NC[C@H](CO)N1 Amb33620311 [0,0,0,1,0,0|3,0,0]=4 4350 B8R1.1 O=C1NC[C@H](CO)O1 Amb22737250 [0,0,0,1,0,0|3,0,0]=4 4351 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,0,0,1,0,0|3,0,0]=4 4352 B8R1.1 O=C1N[C@@H](CO)CO1 Amb26396455 [0,0,0,1,0,0|3,0,0]=4 4353 B8R1.1 O=C1N[C@H](CI)CO1 Amb28048135 [0,0,0,1,0,0|3,0,0]=4 4354 B8R1.1 O=C1N[C@H](CO)CO1 Amb26653948 [0,0,0,1,0,0|3,0,0]=4 4355 B8R1.1 O=C1N[C@H](CO)CS1 Amb27655608 [0,0,0,1,0,0|3,0,0]=4 4356 B8R1.1 O=C1OCC(CCl)O1 Amb3940630 [0,0,0,1,0,0|3,0,0]=4 4357 B8R1.1 O=C1OCC(CF)O1 Amb28348445 [0,0,0,1,0,0|3,0,0]=4 4358 B8R1.1 O=C1OCC(CO)O1 Amb3939438 [0,0,0,1,0,0|3,0,0]=4 4359 B8R1.1 O=C1OCC(CS)O1 Amb32650873 [0,0,0,1,0,0|3,0,0]=4 4360 B8R1.1 O=C1SCC(CCl)S1 Amb27975820 [0,0,0,1,0,0|3,0,0]=4 4361 B8R1.1 O=C1SCC(CO)S1 Amb27394779 [0,0,0,1,0,0|3,0,0]=4 4362 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [0,0,0,1,0,0|1,0,1]=3 4363 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,0,0,1,0,0|2,0,1]=4 4364 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,0,0,1,0,0|2,0,1]=4 4365 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [0,0,0,1,0,0|2,0,1]=4 4366 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [0,0,0,1,0,0|2,0,1]=4 4367 B8R1.1 O=C[C@H]1CCC(=O)O1 Amb27964499 [0,0,0,1,0,0|2,0,1]=4 4368 B8R1.1 O=C[C@H]1CCC(=O)S1 Amb27792268 [0,0,0,1,0,0|2,0,1]=4 4369 B8R1.1 O=S1CCC(CO)C1 Amb27763052 [0,0,0,1,0,0|2,0,0]=3 4370 B8R1.1 O=S1COC(CCl)C1 Amb27257436 [0,0,0,1,0,0|3,0,0]=4 4371 B8R1.1 OCC1CCC(=S)N1 Amb28076783 [0,0,0,1,0,0|2,1,0]=4 4372 B8R1.1 OCC1CCC(F)C1 Amb23455679 [0,0,0,1,0,0|2,0,1]=4 4373 B8R1.1 OCC1CCC(O)C1 Amb22168730 [0,0,0,1,0,0|1,0,2]=4 4374 B8R1.1 OCC1CCC(S)C1 Amb27453693 [0,0,0,1,0,0|1,1,1]=4 4375 B8R1.1 OC[C@@H]1CCC(=S)N1 Amb27205006 [0,0,0,1,0,0|2,1,0]=4 4376 B8R1.1 OC[C@@H]1CC[C@@H](F)C1 Amb33714553 [0,0,0,1,0,0|2,0,1]=4 4377 B8R1.1 OC[C@@H]1CC[C@H](F)C1 Amb33714552 [0,0,0,1,0,0|2,0,1]=4 4378 B8R1.1 OC[C@H]1CC[C@H](O)C1 Amb24544575 [0,0,0,1,0,0|1,0,2]=4 4379 B8R1.1 O[C@@H]1CC[C@@H](CS)C1 Amb27448845 [0,0,0,1,0,0|1,0,2]=4 4380 B8R1.1 S=C1CCC(CCl)N1 Amb27605868 [0,0,0,1,0,0|2,1,0]=4 4381 B8R1.1 [NH3+]C[C@@H]1CCC(=O)O1 Amb28464028 [0,0,0,1,0,0|2,0,0]=3 4382 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,0,0,1,0,0|1,0,2]=4 4383 B8R1.4 C=C1CCCC(=O)C1 Amb28132034 [0,0,0,1,0,0|0,0,2]=3 4384 B8R1.4 C=C1CCNC(C)C1 Amb29849450 [0,0,0,1,0,0|2,0,0]=3 4385 B8R1.4 C=C1CCOC(C)C1 Amb25235098 [0,0,0,1,0,0|2,0,0]=3 4386 B8R1.4 C=C1CNCC(C)C1 Amb35719512 [0,0,0,1,0,0|2,0,0]=3 4387 B8R1.4 C=C1COCC(O)C1 Amb27484750 [0,0,0,1,0,0|3,0,0]=4 4388 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,1,0,0|0,0,2]=3 4389 B8R1.4 CC1=CC(=O)CSC1 Amb28316129 [0,0,0,1,0,0|1,0,2]=4 4390 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,0,0,1,0,0|1,0,2]=4 4391 B8R1.4 CC1=CC(C)CCC1 Amb26410159 [0,0,0,1,0,0|1,0,0]=2 4392 B8R1.4 CC1=CC(C)CNC1 Amb25757457 [0,0,0,1,0,0|2,0,0]=3 4393 B8R1.4 CC1=CC(C)CNC1 Amb28934871 [0,0,0,1,0,0|2,0,0]=3 4394 B8R1.4 CC1=CC(C)OCC1 Amb17689157 [0,0,0,1,0,0|2,0,0]=3 4395 B8R1.4 CC1=CC(Cl)CCC1 Amb27860262 [0,0,0,1,0,0|2,0,0]=3 4396 B8R1.4 CC1=CC(Cl)CNC1 Amb32989055 [0,0,0,1,0,0|3,0,0]=4 4397 B8R1.4 CC1=CC(N)CNC1 Amb32989560 [0,0,0,1,0,0|3,0,0]=4 4398 B8R1.4 CC1=CC(O)CCC1 Amb10844732 [0,0,0,1,0,0|2,0,0]=3 4399 B8R1.4 CC1=CC(O)CNC1 Amb32989170 [0,0,0,1,0,0|3,0,0]=4 4400 B8R1.4 CC1=CCCC(=O)C1 Amb27661853 [0,0,0,1,0,0|0,0,2]=3 4401 B8R1.4 CC1=CCCC(=O)N1 Amb27949580 [0,0,0,1,0,0|1,0,2]=4 4402 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,0,0,1,0,0|1,0,2]=4 4403 B8R1.4 CC1=C[C@@H](O)CCC1 Amb27466476 [0,0,0,1,0,0|2,0,0]=3 4404 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,0,0,1,0,0|1,0,1]=3 4405 B8R1.4 CC1=NC(C)CCC1 Amb27589065 [0,0,0,1,0,0|1,0,0]=2 4406 B8R1.4 CC1=NN(C)CCN1 Amb27982433 [0,0,0,1,0,0|3,0,0]=4 4407 B8R1.4 CC1CC(=O)C=CN1 Amb28423365 [0,0,0,1,0,0|1,0,2]=4 4408 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,0,0,1,0,0|1,0,2]=4 4409 B8R1.4 CC1CC(=O)CCN1 Amb1087926 [0,0,0,1,0,0|1,0,0]=2 4410 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,0,0,1,0,0|1,0,0]=2 4411 B8R1.4 CC1CC(=O)CCN1 Amb30585094 [0,0,0,1,0,0|1,0,0]=2 4412 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,0,0,1,0,0|1,0,0]=2 4413 B8R1.4 CC1CC(=O)CCS1 Amb27256424 [0,0,0,1,0,0|1,0,0]=2 4414 B8R1.4 CC1CC(Br)CCN1 Amb25704461 [0,0,0,1,0,0|2,0,1]=4 4415 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,0,0,1,0,0|2,0,1]=4 4416 B8R1.4 CC1CC(Cl)CCO1 Amb26046391 [0,0,0,1,0,0|2,0,1]=4 4417 B8R1.4 CC1CC(F)CCN1 Amb28053000 [0,0,0,1,0,0|2,0,1]=4 4418 B8R1.4 CC1CC(F)CCN1 Amb33714396 [0,0,0,1,0,0|2,0,1]=4 4419 B8R1.4 CC1CC(N)CCN1 Amb23440606 [0,0,0,1,0,0|2,0,1]=4 4420 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,0,0,1,0,0|2,0,1]=4 4421 B8R1.4 CC1CC(N)CCO1 Amb33715162 [0,0,0,1,0,0|2,0,1]=4 4422 B8R1.4 CC1CC(N)CCS1 Amb18642861 [0,0,0,1,0,0|2,0,1]=4 4423 B8R1.4 CC1CC(O)CCN1 Amb1051141 [0,0,0,1,0,0|1,0,2]=4 4424 B8R1.4 CC1CC(O)CCN1 Amb32661025 [0,0,0,1,0,0|1,0,2]=4 4425 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,0,0,1,0,0|1,0,2]=4 4426 B8R1.4 CC1CC(S)CCN1 Amb27976788 [0,0,0,1,0,0|1,1,1]=4 4427 B8R1.4 CC1CC(S)CCO1 Amb26515745 [0,0,0,1,0,0|1,1,1]=4 4428 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,0,0,1,0,0|0,0,2]=3 4429 B8R1.4 CC1CC=CC(=O)N1 Amb27788159 [0,0,0,1,0,0|1,0,2]=4 4430 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,0,0,1,0,0|1,0,2]=4 4431 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,0,0,1,0,0|0,0,0]=1 4432 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,0,0,1,0,0|1,0,0]=2 4433 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,0,0,1,0,0|1,0,0]=2 4434 B8R1.4 CC1CCCC(Br)C1 Amb9204166 [0,0,0,1,0,0|1,0,1]=3 4435 B8R1.4 CC1CCCC(C)C1 Amb4036439 [0,0,0,1,0,0|1,0,1]=3 4436 B8R1.4 CC1CCCC(C)N1 Amb2720338 [0,0,0,1,0,0|1,0,1]=3 4437 B8R1.4 CC1CCCC(C)N1 Amb6340189 [0,0,0,1,0,0|1,0,1]=3 4438 B8R1.4 CC1CCCC(Cl)C1 Amb9205059 [0,0,0,1,0,0|1,0,1]=3 4439 B8R1.4 CC1CCCC(I)C1 Amb25954445 [0,0,0,1,0,0|1,0,1]=3 4440 B8R1.4 CC1CCCC(N)C1 Amb6892976 [0,0,0,1,0,0|1,0,1]=3 4441 B8R1.4 CC1CCCC(N)C1 Amb9706328 [0,0,0,1,0,0|1,0,1]=3 4442 B8R1.4 CC1CCCC(O)C1 Amb9702772 [0,0,0,1,0,0|0,0,2]=3 4443 B8R1.4 CC1CCCC(S)C1 Amb9208049 [0,0,0,1,0,0|0,1,1]=3 4444 B8R1.4 CC1CCCN(N)C1 Amb17231819 [0,0,0,1,0,0|2,0,0]=3 4445 B8R1.4 CC1CCCN(O)C1 Amb27631256 [0,0,0,1,0,0|1,0,1]=3 4446 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,0,0,1,0,0|2,1,0]=4 4447 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,0,0,1,0,0|1,0,0]=2 4448 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,0,0,1,0,0|2,0,0]=3 4449 B8R1.4 CC1CCNC(=S)N1 Amb27838373 [0,0,0,1,0,0|2,1,0]=4 4450 B8R1.4 CC1CCNC(C)C1 Amb19957920 [0,0,0,1,0,0|2,0,1]=4 4451 B8R1.4 CC1CCNC(C)C1 Amb2714084 [0,0,0,1,0,0|2,0,1]=4 4452 B8R1.4 CC1CCNC(C)O1 Amb33193276 [0,0,0,1,0,0|1,0,2]=4 4453 B8R1.4 CC1CCNC(N)=N1 Amb25879219 [0,0,0,1,0,0|3,0,0]=4 4454 B8R1.4 CC1CCNC(N)=N1 Amb35747071 [0,0,0,1,0,0|3,0,0]=4 4455 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,0,0,1,0,0|2,0,0]=3 4456 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,0,0,1,0,0|2,0,0]=3 4457 B8R1.4 CC1CCOC(C)N1 Amb33194285 [0,0,0,1,0,0|2,0,1]=4 4458 B8R1.4 CC1CCOC(C)O1 Amb4017488 [0,0,0,1,0,0|1,0,2]=4 4459 B8R1.4 CC1CCOC(I)C1 Amb32419164 [0,0,0,1,0,0|2,0,1]=4 4460 B8R1.4 CC1CCOS(=O)O1 Amb4010773 [0,0,0,1,0,0|3,0,0]=4 4461 B8R1.4 CC1CN(C)CCN1 Amb18062087 [0,0,0,1,0,0|3,0,0]=4 4462 B8R1.4 CC1CN(C)CCN1 Amb32666407 [0,0,0,1,0,0|3,0,0]=4 4463 B8R1.4 CC1CN(N)CCO1 Amb18559327 [0,0,0,1,0,0|3,0,0]=4 4464 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,0,0,1,0,0|1,0,0]=2 4465 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,0,0,1,0,0|1,0,0]=2 4466 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,0,0,1,0,0|2,0,0]=3 4467 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,0,0,1,0,0|2,0,0]=3 4468 B8R1.4 CC1CNCC(C)C1 Amb2792848 [0,0,0,1,0,0|2,0,1]=4 4469 B8R1.4 CC1CNCC(C)N1 Amb10067760 [0,0,0,1,0,0|2,0,1]=4 4470 B8R1.4 CC1CNCC(C)N1 Amb23412204 [0,0,0,1,0,0|2,0,1]=4 4471 B8R1.4 CC1CNCC(C)O1 Amb5716863 [0,0,0,1,0,0|1,0,2]=4 4472 B8R1.4 CC1CNCC(C)S1 Amb18642865 [0,0,0,1,0,0|1,1,1]=4 4473 B8R1.4 CC1CNCC(C)S1 Amb19373865 [0,0,0,1,0,0|1,1,1]=4 4474 B8R1.4 CC1CNCC(F)C1 Amb26031747 [0,0,0,1,0,0|2,0,1]=4 4475 B8R1.4 CC1CNCC(N)C1 Amb28398927 [0,0,0,1,0,0|2,0,1]=4 4476 B8R1.4 CC1CNCC(O)C1 Amb24507417 [0,0,0,1,0,0|1,0,2]=4 4477 B8R1.4 CC1CNCC(O)C1 Amb28934840 [0,0,0,1,0,0|1,0,2]=4 4478 B8R1.4 CC1CNCC(S)C1 Amb32788285 [0,0,0,1,0,0|1,1,1]=4 4479 B8R1.4 CC1CNC[C@H](C)C1 Amb27166502 [0,0,0,1,0,0|2,0,1]=4 4480 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,0,0,1,0,0|2,0,0]=3 4481 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,1,0,0|2,0,0]=3 4482 B8R1.4 CC1COCC(C)N1 Amb19515707 [0,0,0,1,0,0|2,0,1]=4 4483 B8R1.4 CC1COCC(C)N1 Amb8631067 [0,0,0,1,0,0|2,0,1]=4 4484 B8R1.4 CC1COCC(C)O1 Amb26515760 [0,0,0,1,0,0|1,0,2]=4 4485 B8R1.4 CC1COC[C@H](C)N1 Amb27192784 [0,0,0,1,0,0|2,0,1]=4 4486 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,0,0,1,0,0|2,0,0]=3 4487 B8R1.4 CC1CSCC(C)N1 Amb18642862 [0,0,0,1,0,0|2,0,1]=4 4488 B8R1.4 CC1CSCC(C)N1 Amb20622324 [0,0,0,1,0,0|2,0,1]=4 4489 B8R1.4 CC1CSCC(C)O1 Amb4016354 [0,0,0,1,0,0|1,0,2]=4 4490 B8R1.4 CC1NCCC(=O)N1 Amb32418334 [0,0,0,1,0,0|2,0,0]=3 4491 B8R1.4 CN1CC=CC(=O)C1 Amb27186211 [0,0,0,1,0,0|1,0,2]=4 4492 B8R1.4 CN1CCC=C(Br)C1 Amb10975875 [0,0,0,1,0,0|2,0,1]=4 4493 B8R1.4 CN1CCC=C(Br)C1 Amb13888761 [0,0,0,1,0,0|2,0,1]=4 4494 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,0,0,1,0,0|1,0,0]=2 4495 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [0,0,0,1,0,0|1,0,0]=2 4496 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [0,0,0,1,0,0|1,0,0]=2 4497 B8R1.4 CN1CCCC(Br)C1 Amb21860296 [0,0,0,1,0,0|2,0,1]=4 4498 B8R1.4 CN1CCCC(Br)C1 Amb22496801 [0,0,0,1,0,0|2,0,1]=4 4499 B8R1.4 CN1CCCC(N)C1 Amb2694376 [0,0,0,1,0,0|2,0,1]=4 4500 B8R1.4 CN1CCCC(N)C1 Amb2785276 [0,0,0,1,0,0|2,0,1]=4 4501 B8R1.4 CN1CCCC(O)C1 Amb33623580 [0,0,0,1,0,0|1,0,2]=4 4502 B8R1.4 CN1CCCC(O)C1 Amb534752 [0,0,0,1,0,0|1,0,2]=4 4503 B8R1.4 CN1CCCC(S)C1 Amb24608915 [0,0,0,1,0,0|1,1,1]=4 4504 B8R1.4 CN1CCC[C@@H](Br)C1 Amb22225308 [0,0,0,1,0,0|2,0,1]=4 4505 B8R1.4 CN1CCC[C@@H](Cl)C1 Amb22225319 [0,0,0,1,0,0|2,0,1]=4 4506 B8R1.4 CN1CCC[C@@H](N)C1 Amb22225152 [0,0,0,1,0,0|2,0,1]=4 4507 B8R1.4 CN1CCC[C@@H](N)C1 Amb24053176 [0,0,0,1,0,0|2,0,1]=4 4508 B8R1.4 CN1CCC[C@@H](O)C1 Amb22225150 [0,0,0,1,0,0|1,0,2]=4 4509 B8R1.4 CN1CCC[C@H](Br)C1 Amb22226654 [0,0,0,1,0,0|2,0,1]=4 4510 B8R1.4 CN1CCC[C@H](I)C1 Amb22226477 [0,0,0,1,0,0|2,0,1]=4 4511 B8R1.4 CN1CCC[C@H](N)C1 Amb17134810 [0,0,0,1,0,0|2,0,1]=4 4512 B8R1.4 CN1CCC[C@H](N)C1 Amb22405886 [0,0,0,1,0,0|2,0,1]=4 4513 B8R1.4 CN1CCC[C@H](N)C1 Amb24053175 [0,0,0,1,0,0|2,0,1]=4 4514 B8R1.4 CN1CCC[C@H](O)C1 Amb22225471 [0,0,0,1,0,0|1,0,2]=4 4515 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,0,0,1,0,0|2,0,0]=3 4516 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,0,0,1,0,0|2,0,0]=3 4517 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,0,0,1,0,0|2,0,0]=3 4518 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,0,0,1,0,0|1,0,2]=4 4519 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,0,0,1,0,0|1,0,0]=2 4520 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,0,0,1,0,0|1,0,0]=2 4521 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb27593729 [0,0,0,1,0,0|1,0,0]=2 4522 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,0,0,1,0,0|1,0,0]=2 4523 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,0,0,1,0,0|0,0,2]=3 4524 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,0,0,1,0,0|0,0,0]=1 4525 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,0,0,1,0,0|1,0,0]=2 4526 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,0,0,1,0,0|1,0,0]=2 4527 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Amb26932464 [0,0,0,1,0,0|1,0,1]=3 4528 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 Amb28719530 [0,0,0,1,0,0|1,0,1]=3 4529 B8R1.4 C[C@@H]1CCC[C@@H](Cl)C1 Amb27626999 [0,0,0,1,0,0|1,0,1]=3 4530 B8R1.4 C[C@@H]1CCC[C@@H](N)C1 Amb24629158 [0,0,0,1,0,0|1,0,1]=3 4531 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 Amb24383351 [0,0,0,1,0,0|0,0,2]=3 4532 B8R1.4 C[C@@H]1CCC[C@H](Br)C1 Amb27484045 [0,0,0,1,0,0|1,0,1]=3 4533 B8R1.4 C[C@@H]1CCC[C@H](N)C1 Amb27800615 [0,0,0,1,0,0|1,0,1]=3 4534 B8R1.4 C[C@@H]1CCC[C@H](O)C1 Amb24713971 [0,0,0,1,0,0|0,0,2]=3 4535 B8R1.4 C[C@@H]1CCN[C@H](C)C1 Amb24603758 [0,0,0,1,0,0|2,0,1]=4 4536 B8R1.4 C[C@@H]1CCN[C@H](C)C1 Amb28644774 [0,0,0,1,0,0|2,0,1]=4 4537 B8R1.4 C[C@@H]1CCO[C@@H](O)C1 Amb27854200 [0,0,0,1,0,0|1,0,2]=4 4538 B8R1.4 C[C@@H]1CCO[C@H](O)C1 Amb27484825 [0,0,0,1,0,0|1,0,2]=4 4539 B8R1.4 C[C@@H]1CN(C)CCN1 Amb18833028 [0,0,0,1,0,0|3,0,0]=4 4540 B8R1.4 C[C@@H]1CN(C)CCN1 Amb22756297 [0,0,0,1,0,0|3,0,0]=4 4541 B8R1.4 C[C@@H]1CN(C)CCN1 Amb23439872 [0,0,0,1,0,0|3,0,0]=4 4542 B8R1.4 C[C@@H]1CN(C)CCN1 Amb24054699 [0,0,0,1,0,0|3,0,0]=4 4543 B8R1.4 C[C@@H]1CN(C)CCN1 Amb30585095 [0,0,0,1,0,0|3,0,0]=4 4544 B8R1.4 C[C@@H]1CN(C)CCN1 Amb31205628 [0,0,0,1,0,0|3,0,0]=4 4545 B8R1.4 C[C@@H]1CN(C)CCN1 Amb33620431 [0,0,0,1,0,0|3,0,0]=4 4546 B8R1.4 C[C@@H]1CN(C)CCN1 Amb34137428 [0,0,0,1,0,0|3,0,0]=4 4547 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,0,0,1,0,0|2,0,0]=3 4548 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,0,0,1,0,0|2,0,0]=3 4549 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb22745664 [0,0,0,1,0,0|2,0,1]=4 4550 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb22746818 [0,0,0,1,0,0|2,0,1]=4 4551 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb23439675 [0,0,0,1,0,0|2,0,1]=4 4552 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,0,0,1,0,0|1,0,2]=4 4553 B8R1.4 C[C@@H]1CNC[C@@H](C)S1 Amb27881645 [0,0,0,1,0,0|1,1,1]=4 4554 B8R1.4 C[C@@H]1CNC[C@H](C)C1 Amb8629548 [0,0,0,1,0,0|2,0,1]=4 4555 B8R1.4 C[C@@H]1CNC[C@H](N)C1 Amb28129362 [0,0,0,1,0,0|2,0,1]=4 4556 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb27212277 [0,0,0,1,0,0|1,0,2]=4 4557 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb28644756 [0,0,0,1,0,0|1,0,2]=4 4558 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,1,0,0|2,0,0]=3 4559 B8R1.4 C[C@@H]1COC[C@@H](C)N1 Amb22744738 [0,0,0,1,0,0|2,0,1]=4 4560 B8R1.4 C[C@@H]1COC[C@@H](C)N1 Amb22744959 [0,0,0,1,0,0|2,0,1]=4 4561 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,0,0,1,0,0|2,0,1]=4 4562 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,0,0,1,0,0|2,0,1]=4 4563 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,0,0,1,0,0|1,0,2]=4 4564 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,0,0,1,0,0|1,0,2]=4 4565 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,0,0,1,0,0|1,0,2]=4 4566 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,0,0,1,0,0|1,0,0]=2 4567 B8R1.4 C[C@H]1CC(=O)CCN1 Amb28072876 [0,0,0,1,0,0|1,0,0]=2 4568 B8R1.4 C[C@H]1CC(=O)CCN1 Amb33801725 [0,0,0,1,0,0|1,0,0]=2 4569 B8R1.4 C[C@H]1CC(=O)CCO1 Amb27969730 [0,0,0,1,0,0|1,0,0]=2 4570 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,0,0,1,0,0|1,0,2]=4 4571 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,0,0,1,0,0|0,0,0]=1 4572 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,0,0,1,0,0|1,0,0]=2 4573 B8R1.4 C[C@H]1CCCC(O)C1 Amb27410880 [0,0,0,1,0,0|0,0,2]=3 4574 B8R1.4 C[C@H]1CCCC(O)O1 Amb28206458 [0,0,0,1,0,0|1,0,2]=4 4575 B8R1.4 C[C@H]1CCC[C@@H](C)N1 Amb3941399 [0,0,0,1,0,0|1,0,1]=3 4576 B8R1.4 C[C@H]1CCC[C@@H](O)C1 Amb22800307 [0,0,0,1,0,0|0,0,2]=3 4577 B8R1.4 C[C@H]1CCC[C@H](C)N1 Amb33457277 [0,0,0,1,0,0|1,0,1]=3 4578 B8R1.4 C[C@H]1CCC[C@H](C)N1 Amb8393083 [0,0,0,1,0,0|1,0,1]=3 4579 B8R1.4 C[C@H]1CCC[C@H](O)C1 Amb26633070 [0,0,0,1,0,0|0,0,2]=3 4580 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,0,0,1,0,0|1,0,0]=2 4581 B8R1.4 C[C@H]1CCN[C@@H](C)C1 Amb22748742 [0,0,0,1,0,0|2,0,1]=4 4582 B8R1.4 C[C@H]1CCN[C@@H](C)C1 Amb26017367 [0,0,0,1,0,0|2,0,1]=4 4583 B8R1.4 C[C@H]1CCO[C@@H](O)C1 Amb28197437 [0,0,0,1,0,0|1,0,2]=4 4584 B8R1.4 C[C@H]1CN(C)CCN1 Amb15701224 [0,0,0,1,0,0|3,0,0]=4 4585 B8R1.4 C[C@H]1CN(C)CCN1 Amb22736681 [0,0,0,1,0,0|3,0,0]=4 4586 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,0,0,1,0,0|2,0,0]=3 4587 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,0,0,1,0,0|2,0,0]=3 4588 B8R1.4 C[C@H]1CNC[C@@H](C)N1 Amb23399869 [0,0,0,1,0,0|2,0,1]=4 4589 B8R1.4 C[C@H]1CNC[C@@H](C)N1 Amb8390654 [0,0,0,1,0,0|2,0,1]=4 4590 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb33719087 [0,0,0,1,0,0|1,0,2]=4 4591 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb3939625 [0,0,0,1,0,0|1,0,2]=4 4592 B8R1.4 C[C@H]1CNC[C@@H](N)C1 Amb25975262 [0,0,0,1,0,0|2,0,1]=4 4593 B8R1.4 C[C@H]1CNC[C@@H](O)C1 Amb28057034 [0,0,0,1,0,0|1,0,2]=4 4594 B8R1.4 C[C@H]1CNC[C@H](C)N1 Amb24697595 [0,0,0,1,0,0|2,0,1]=4 4595 B8R1.4 C[C@H]1CNC[C@H](C)N1 Amb32409382 [0,0,0,1,0,0|2,0,1]=4 4596 B8R1.4 C[C@H]1CNC[C@H](C)N1 Amb33801319 [0,0,0,1,0,0|2,0,1]=4 4597 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,0,0,1,0,0|1,0,2]=4 4598 B8R1.4 C[C@H]1CNC[C@H](C)S1 Amb27422036 [0,0,0,1,0,0|1,1,1]=4 4599 B8R1.4 C[C@H]1CNC[C@H](O)C1 Amb27630532 [0,0,0,1,0,0|1,0,2]=4 4600 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,1,0,0|2,0,0]=3 4601 B8R1.4 C[C@H]1COC[C@@H](C)N1 Amb22745382 [0,0,0,1,0,0|2,0,1]=4 4602 B8R1.4 C[C@H]1COC[C@@H](C)N1 Amb22749660 [0,0,0,1,0,0|2,0,1]=4 4603 B8R1.4 C[C@H]1COC[C@H](C)N1 Amb24514970 [0,0,0,1,0,0|2,0,1]=4 4604 B8R1.4 C[C@H]1COC[C@H](C)N1 Amb33801643 [0,0,0,1,0,0|2,0,1]=4 4605 B8R1.4 C[C@H]1CS(=O)CCN1 Amb27866032 [0,0,0,1,0,0|2,0,0]=3 4606 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,0,0,1,0,0|1,0,2]=4 4607 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb26916893 [0,0,0,1,0,0|1,0,2]=4 4608 B8R1.4 C[C@H]1C[C@@H](O)CCO1 Amb26549571 [0,0,0,1,0,0|1,0,2]=4 4609 B8R1.4 C[C@H]1C[C@H](O)CCO1 Amb26891979 [0,0,0,1,0,0|1,0,2]=4 4610 B8R1.4 Cl[C@@H]1CCC[C@@H](Br)C1 Amb28245319 [0,0,0,1,0,0|2,0,1]=4 4611 B8R1.4 Cl[C@@H]1CCC[C@@H](Cl)C1 Amb28383882 [0,0,0,1,0,0|2,0,1]=4 4612 B8R1.4 Cl[C@@H]1CCC[C@H](Br)C1 Amb27878812 [0,0,0,1,0,0|2,0,1]=4 4613 B8R1.4 Cl[C@H]1CCC[C@H](Cl)C1 Amb28287430 [0,0,0,1,0,0|2,0,1]=4 4614 B8R1.4 FC1CCCC(Br)C1 Amb27638331 [0,0,0,1,0,0|2,0,1]=4 4615 B8R1.4 F[C@@H]1CCC[C@H](Cl)C1 Amb27444957 [0,0,0,1,0,0|2,0,1]=4 4616 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,0,0,1,0,0|1,0,2]=4 4617 B8R1.4 NC1=CC(O)CCC1 Amb28127332 [0,0,0,1,0,0|2,0,1]=4 4618 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,0,0,1,0,0|1,0,0]=2 4619 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,0,0,1,0,0|1,0,0]=2 4620 B8R1.4 NC1CCCC(Cl)C1 Amb16233743 [0,0,0,1,0,0|2,0,1]=4 4621 B8R1.4 NC1CCCC(Cl)C1 Amb31030969 [0,0,0,1,0,0|2,0,1]=4 4622 B8R1.4 NC1CCCC(F)C1 Amb22233777 [0,0,0,1,0,0|2,0,1]=4 4623 B8R1.4 NC1CCCC(F)C1 Amb29837922 [0,0,0,1,0,0|2,0,1]=4 4624 B8R1.4 NC1CCCC(N)C1 Amb2686627 [0,0,0,1,0,0|2,0,1]=4 4625 B8R1.4 NC1CCCC(O)C1 Amb22491291 [0,0,0,1,0,0|1,0,2]=4 4626 B8R1.4 NC1CCCC(O)C1 Amb9717357 [0,0,0,1,0,0|1,0,2]=4 4627 B8R1.4 NC1CCCC(S)C1 Amb32788364 [0,0,0,1,0,0|1,1,1]=4 4628 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,1,0,0|2,0,0]=3 4629 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,0,0,1,0,0|2,0,0]=3 4630 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,0,0,1,0,0|2,0,0]=3 4631 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,0,0,1,0,0|2,0,0]=3 4632 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,0,0,1,0,0|2,0,0]=3 4633 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,0,0,1,0,0|2,0,0]=3 4634 B8R1.4 N[C@@H]1CCC[C@@H](F)C1 Amb27437379 [0,0,0,1,0,0|2,0,1]=4 4635 B8R1.4 N[C@@H]1CCC[C@@H](F)C1 Amb33871571 [0,0,0,1,0,0|2,0,1]=4 4636 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24074365 [0,0,0,1,0,0|1,0,2]=4 4637 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24671187 [0,0,0,1,0,0|1,0,2]=4 4638 B8R1.4 N[C@@H]1CCC[C@H](O)C1 Amb33870222 [0,0,0,1,0,0|1,0,2]=4 4639 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,0,0,1,0,0|2,0,0]=3 4640 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,0,0,1,0,0|2,0,0]=3 4641 B8R1.4 N[C@H]1CCC[C@@H](F)C1 Amb25912931 [0,0,0,1,0,0|2,0,1]=4 4642 B8R1.4 N[C@H]1CCC[C@@H](F)C1 Amb34912826 [0,0,0,1,0,0|2,0,1]=4 4643 B8R1.4 N[C@H]1CCC[C@@H](N)C1 Amb22746528 [0,0,0,1,0,0|2,0,1]=4 4644 B8R1.4 N[C@H]1CCC[C@@H](N)C1 Amb24323764 [0,0,0,1,0,0|2,0,1]=4 4645 B8R1.4 N[C@H]1CCC[C@@H](N)C1 Amb33801645 [0,0,0,1,0,0|2,0,1]=4 4646 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22746547 [0,0,0,1,0,0|1,0,2]=4 4647 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22752827 [0,0,0,1,0,0|1,0,2]=4 4648 B8R1.4 N[C@H]1CCC[C@H](F)C1 Amb22886235 [0,0,0,1,0,0|2,0,1]=4 4649 B8R1.4 N[C@H]1CCC[C@H](N)C1 Amb24323765 [0,0,0,1,0,0|2,0,1]=4 4650 B8R1.4 N[C@H]1CCC[C@H](N)C1 Amb30869367 [0,0,0,1,0,0|2,0,1]=4 4651 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22828171 [0,0,0,1,0,0|1,0,2]=4 4652 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22886176 [0,0,0,1,0,0|1,0,2]=4 4653 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,0,0,1,0,0|2,0,0]=3 4654 B8R1.4 O=C1C=C(Br)CCC1 Amb33542768 [0,0,0,1,0,0|1,0,2]=4 4655 B8R1.4 O=C1C=C(Cl)CCC1 Amb2697044 [0,0,0,1,0,0|1,0,2]=4 4656 B8R1.4 O=C1C=C(I)CCC1 Amb25706767 [0,0,0,1,0,0|1,0,2]=4 4657 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,0,0,1,0,0|1,0,2]=4 4658 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,0,0,1,0,0|1,0,2]=4 4659 B8R1.4 O=C1C=[N+]([O-])CCC1 Amb27751417 [0,0,0,1,0,0|2,0,1]=4 4660 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,0,0,1,0,0|2,0,0]=3 4661 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,0,0,1,0,0|2,0,0]=3 4662 B8R1.4 O=C1CC(S)NCN1 Amb28245543 [0,0,0,1,0,0|3,0,0]=4 4663 B8R1.4 O=C1CCCC(=O)C1 Amb932798 [0,0,0,1,0,0|1,0,1]=3 4664 B8R1.4 O=C1CCCC(=O)N1 Amb8386485 [0,0,0,1,0,0|2,0,1]=4 4665 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [0,0,0,1,0,0|2,0,1]=4 4666 B8R1.4 O=C1CCCC(=O)S1 Amb27849467 [0,0,0,1,0,0|2,0,1]=4 4667 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,0,0,1,0,0|1,0,0]=2 4668 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,0,0,1,0,0|1,0,0]=2 4669 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,0,0,1,0,0|2,0,0]=3 4670 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,0,0,1,0,0|1,0,0]=2 4671 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,0,0,1,0,0|1,0,0]=2 4672 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,0,0,1,0,0|1,0,0]=2 4673 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,0,0,1,0,0|2,0,0]=3 4674 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,0,0,1,0,0|1,0,0]=2 4675 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,0,0,1,0,0|1,0,0]=2 4676 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,0,0,1,0,0|2,0,1]=4 4677 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,0,0,1,0,0|2,0,1]=4 4678 B8R1.4 O=C1CNCC(=O)C1 Amb26464137 [0,0,0,1,0,0|2,0,1]=4 4679 B8R1.4 O=C1COCC(=O)C1 Amb8392404 [0,0,0,1,0,0|2,0,1]=4 4680 B8R1.4 O=C1CS(=O)CCN1 Amb27184590 [0,0,0,1,0,0|3,0,0]=4 4681 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,0,0,1,0,0|2,0,1]=4 4682 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,0,0,1,0,0|2,0,0]=3 4683 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,0,0,1,0,0|2,0,0]=3 4684 B8R1.4 O=S1CCCC(Br)C1 Amb26370333 [0,0,0,1,0,0|2,0,0]=3 4685 B8R1.4 O=S1CCCC(Cl)C1 Amb27876412 [0,0,0,1,0,0|2,0,0]=3 4686 B8R1.4 O=S1CCCC(O)C1 Amb26354128 [0,0,0,1,0,0|2,0,0]=3 4687 B8R1.4 O=S1CCCS(=O)C1 Amb22363746 [0,0,0,1,0,0|3,0,0]=4 4688 B8R1.4 O=S1CCC[C@H](O)C1 Amb28206445 [0,0,0,1,0,0|2,0,0]=3 4689 B8R1.4 OC1C=C(Cl)CCC1 Amb28138656 [0,0,0,1,0,0|2,0,1]=4 4690 B8R1.4 OC1CCCC(O)C1 Amb4035048 [0,0,0,1,0,0|1,0,2]=4 4691 B8R1.4 O[C@@H]1CCC[C@@H](O)C1 Amb27950165 [0,0,0,1,0,0|1,0,2]=4 4692 B8R1.4 O[C@H]1C=C(Br)CCC1 Amb27980419 [0,0,0,1,0,0|2,0,1]=4 4693 B8R1.4 O[C@H]1CCC[C@@H](O)C1 Amb22801622 [0,0,0,1,0,0|1,0,2]=4 4694 B8R1.4 O[C@H]1CCC[C@H](O)C1 Amb22801014 [0,0,0,1,0,0|1,0,2]=4 4695 B8R1.6 C=C1CC(CCO)C1 Amb33328881 [0,0,0,1,0,0|2,0,0]=3 4696 B8R1.6 C=C1CN(CCN)C1 Amb35614364 [0,0,0,1,0,0|3,0,0]=4 4697 B8R1.6 C=CCC1CC(=O)N1 Amb24453069 [0,0,0,1,0,0|1,0,2]=4 4698 B8R1.6 CC1CC(CCN)C1 Amb23590279 [0,0,0,1,0,0|2,0,1]=4 4699 B8R1.6 CCCC1CC(=O)C1 Amb27398824 [0,0,0,1,0,0|0,0,0]=1 4700 B8R1.6 CCCC1CC(=O)N1 Amb26494598 [0,0,0,1,0,0|1,0,0]=2 4701 B8R1.6 CCCC1CC(Br)C1 Amb35788274 [0,0,0,1,0,0|1,0,1]=3 4702 B8R1.6 CCCC1CC(O)C1 Amb27252902 [0,0,0,1,0,0|0,0,2]=3 4703 B8R1.6 CCCC1CC(O)S1 Amb28139454 [0,0,0,1,0,0|1,0,2]=4 4704 B8R1.6 CCCC1CN(N)C1 Amb28316118 [0,0,0,1,0,0|2,0,0]=3 4705 B8R1.6 CCCN1CC(O)C1 Amb25747214 [0,0,0,1,0,0|1,0,2]=4 4706 B8R1.6 CCCN1CC(O)C1 Amb34164272 [0,0,0,1,0,0|1,0,2]=4 4707 B8R1.6 CCC[C@H]1CC(=O)N1 Amb27184591 [0,0,0,1,0,0|1,0,0]=2 4708 B8R1.6 CCNC1CC(O)C1 Amb32410243 [0,0,0,1,0,0|1,0,2]=4 4709 B8R1.6 CCNC1CN(C)C1 Amb23439678 [0,0,0,1,0,0|3,0,0]=4 4710 B8R1.6 CCNC1CN(C)C1 Amb33309513 [0,0,0,1,0,0|3,0,0]=4 4711 B8R1.6 CCNC1CS(=O)C1 Amb32794922 [0,0,0,1,0,0|2,0,0]=3 4712 B8R1.6 CCOC1CC(=O)C1 Amb33530910 [0,0,0,1,0,0|1,0,0]=2 4713 B8R1.6 CCOC1CC(Br)C1 Amb23455006 [0,0,0,1,0,0|2,0,1]=4 4714 B8R1.6 CCOC1CC(Cl)C1 Amb24661818 [0,0,0,1,0,0|2,0,1]=4 4715 B8R1.6 CCOC1CC(N)C1 Amb25210766 [0,0,0,1,0,0|2,0,1]=4 4716 B8R1.6 CCOC1CC(N)C1 Amb28934899 [0,0,0,1,0,0|2,0,1]=4 4717 B8R1.6 CCOC1CC(O)C1 Amb25079645 [0,0,0,1,0,0|1,0,2]=4 4718 B8R1.6 CCOC1CC(S)C1 Amb26370334 [0,0,0,1,0,0|1,1,1]=4 4719 B8R1.6 CCO[C@H]1C[C@@H](N)C1 Amb25367725 [0,0,0,1,0,0|2,0,1]=4 4720 B8R1.6 CCO[C@H]1C[C@@H](N)C1 Amb30594201 [0,0,0,1,0,0|2,0,1]=4 4721 B8R1.6 CCO[C@H]1C[C@@H](O)C1 Amb28131607 [0,0,0,1,0,0|1,0,2]=4 4722 B8R1.6 CCO[C@H]1C[C@H](Br)C1 Amb26075156 [0,0,0,1,0,0|2,0,1]=4 4723 B8R1.6 CCO[C@H]1C[C@H](N)C1 Amb28365856 [0,0,0,1,0,0|2,0,1]=4 4724 B8R1.6 CCO[C@H]1C[C@H](N)C1 Amb28989955 [0,0,0,1,0,0|2,0,1]=4 4725 B8R1.6 CCO[C@H]1C[C@H](O)C1 Amb24482985 [0,0,0,1,0,0|1,0,2]=4 4726 B8R1.6 CCSC1CC(O)C1 Amb32753230 [0,0,0,1,0,0|1,0,2]=4 4727 B8R1.6 CCS[C@H]1C[C@@H](O)C1 Amb32674536 [0,0,0,1,0,0|1,0,2]=4 4728 B8R1.6 CN1CC(CCBr)C1 Amb27172417 [0,0,0,1,0,0|3,0,0]=4 4729 B8R1.6 CN1CC(CCBr)C1 Amb33313522 [0,0,0,1,0,0|3,0,0]=4 4730 B8R1.6 CN1CC(CCN)C1 Amb26874930 [0,0,0,1,0,0|3,0,0]=4 4731 B8R1.6 CN1CC(CCN)C1 Amb30585138 [0,0,0,1,0,0|3,0,0]=4 4732 B8R1.6 CN1CC(CCO)C1 Amb21962977 [0,0,0,1,0,0|3,0,0]=4 4733 B8R1.6 CNCC1CC(C)C1 Amb23580217 [0,0,0,1,0,0|2,0,1]=4 4734 B8R1.6 CNCC1CC(F)C1 Amb32757625 [0,0,0,1,0,0|2,0,1]=4 4735 B8R1.6 CNCC1CC(N)C1 Amb30039915 [0,0,0,1,0,0|2,0,1]=4 4736 B8R1.6 CNCC1CC(O)C1 Amb25732572 [0,0,0,1,0,0|1,0,2]=4 4737 B8R1.6 CNCC1CN(C)C1 Amb24079724 [0,0,0,1,0,0|3,0,0]=4 4738 B8R1.6 CNCC1CN(C)C1 Amb34913674 [0,0,0,1,0,0|3,0,0]=4 4739 B8R1.6 CNC[C@H]1C[C@@H](N)C1 Amb30032546 [0,0,0,1,0,0|2,0,1]=4 4740 B8R1.6 CNC[C@H]1C[C@@H](O)C1 Amb22831752 [0,0,0,1,0,0|1,0,2]=4 4741 B8R1.6 CNC[C@H]1C[C@H](N)C1 Amb35609439 [0,0,0,1,0,0|2,0,1]=4 4742 B8R1.6 COCC1CC(=O)C1 Amb25771052 [0,0,0,1,0,0|1,0,0]=2 4743 B8R1.6 COCC1CC(N)C1 Amb10603646 [0,0,0,1,0,0|2,0,1]=4 4744 B8R1.6 COCC1CC(N)C1 Amb25698388 [0,0,0,1,0,0|2,0,1]=4 4745 B8R1.6 COCC1CC(O)C1 Amb32679362 [0,0,0,1,0,0|1,0,2]=4 4746 B8R1.6 COC[C@H]1C[C@@H](N)C1 Amb26973845 [0,0,0,1,0,0|2,0,1]=4 4747 B8R1.6 COC[C@H]1C[C@@H](N)C1 Amb30869351 [0,0,0,1,0,0|2,0,1]=4 4748 B8R1.6 COC[C@H]1C[C@H](N)C1 Amb34146670 [0,0,0,1,0,0|2,0,1]=4 4749 B8R1.6 CSCC1CC(N)C1 Amb29892535 [0,0,0,1,0,0|2,0,1]=4 4750 B8R1.6 CSCC1CC(N)C1 Amb35788607 [0,0,0,1,0,0|2,0,1]=4 4751 B8R1.6 CSC[C@H]1C[C@@H](N)C1 Amb35789278 [0,0,0,1,0,0|2,0,1]=4 4752 B8R1.6 CSC[C@H]1C[C@@H](N)C1 Amb35789844 [0,0,0,1,0,0|2,0,1]=4 4753 B8R1.6 N#CCC1CC(=O)C1 Amb30869389 [0,0,0,1,0,0|1,0,1]=3 4754 B8R1.6 N#CCC1CC(=O)N1 Amb27630655 [0,0,0,1,0,0|2,0,1]=4 4755 B8R1.6 NC1CC(CCO)C1 Amb33072413 [0,0,0,1,0,0|2,0,1]=4 4756 B8R1.6 NCCC1CC(F)C1 Amb34913202 [0,0,0,1,0,0|2,0,1]=4 4757 B8R1.6 NCCC1CC(O)C1 Amb24715768 [0,0,0,1,0,0|1,0,2]=4 4758 B8R1.6 NCCC1CC(O)C1 Amb28934909 [0,0,0,1,0,0|1,0,2]=4 4759 B8R1.6 NCC[C@H]1C[C@@H](O)C1 Amb30526926 [0,0,0,1,0,0|1,0,2]=4 4760 B8R1.6 NCC[C@H]1C[C@H](F)C1 Amb33329126 [0,0,0,1,0,0|2,0,1]=4 4761 B8R1.6 NCC[C@H]1C[C@H](F)C1 Amb33329127 [0,0,0,1,0,0|2,0,1]=4 4762 B8R1.6 NCC[C@H]1C[C@H](N)C1 Amb32696725 [0,0,0,1,0,0|2,0,1]=4 4763 B8R1.6 NCC[C@H]1C[C@H](O)C1 Amb30526899 [0,0,0,1,0,0|1,0,2]=4 4764 B8R1.6 O=C1CC(CCBr)C1 Amb28385574 [0,0,0,1,0,0|1,0,0]=2 4765 B8R1.6 O=C1CC(CCBr)N1 Amb28255540 [0,0,0,1,0,0|2,0,0]=3 4766 B8R1.6 O=C1CC(CCCl)C1 Amb27832893 [0,0,0,1,0,0|1,0,0]=2 4767 B8R1.6 O=C1CC(CCO)N1 Amb27467326 [0,0,0,1,0,0|2,0,0]=3 4768 B8R1.6 O=C1C[C@@H](CCO)N1 Amb27838874 [0,0,0,1,0,0|2,0,0]=3 4769 B8R1.6 O=CC[C@@H]1CC(=O)N1 Amb27402326 [0,0,0,1,0,0|2,0,1]=4 4770 B8R1.7 C=C(C)C1CCCC1 Amb26515703 [0,0,0,1,0,0|1,0,0]=2 4771 B8R1.7 C=C(C)C1CCCN1 Amb23536664 [0,0,0,1,0,0|2,0,0]=3 4772 B8R1.7 C=C(C)C1CCNC1 Amb27460933 [0,0,0,1,0,0|2,0,0]=3 4773 B8R1.7 C=C(C)C1OCCO1 Amb17334060 [0,0,0,1,0,0|3,0,0]=4 4774 B8R1.7 C=C(C)[C@@H]1CCCN1 Amb28186967 [0,0,0,1,0,0|2,0,0]=3 4775 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,0,0,1,0,0|0,0,2]=3 4776 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [0,0,0,1,0,0|1,0,2]=4 4777 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,0,0,1,0,0|1,0,2]=4 4778 B8R1.7 CC(=O)C1=CNCC1 Amb27455189 [0,0,0,1,0,0|1,0,2]=4 4779 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,0,0,1,0,0|2,0,1]=4 4780 B8R1.7 CC(=O)C1=NCCS1 Amb8384455 [0,0,0,1,0,0|2,0,1]=4 4781 B8R1.7 CC(=O)C1=NCSC1 Amb27985534 [0,0,0,1,0,0|2,0,1]=4 4782 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [0,0,0,1,0,0|1,0,2]=4 4783 B8R1.7 CC(=O)C1CC=NO1 Amb27481847 [0,0,0,1,0,0|2,0,1]=4 4784 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,0,0,1,0,0|1,0,1]=3 4785 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [0,0,0,1,0,0|0,0,0]=1 4786 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,0,0,1,0,0|1,0,0]=2 4787 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [0,0,0,1,0,0|1,0,0]=2 4788 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,0,0,1,0,0|1,0,0]=2 4789 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [0,0,0,1,0,0|1,0,0]=2 4790 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [0,0,0,1,0,0|1,0,0]=2 4791 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [0,0,0,1,0,0|1,0,0]=2 4792 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [0,0,0,1,0,0|1,0,0]=2 4793 B8R1.7 CC(=O)C1CCSC1 Amb27412975 [0,0,0,1,0,0|1,0,0]=2 4794 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,0,0,1,0,0|2,0,0]=3 4795 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,0,0,1,0,0|2,0,0]=3 4796 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [0,0,0,1,0,0|2,0,0]=3 4797 B8R1.7 CC(=O)N1CCCC1 Amb3358093 [0,0,0,1,0,0|1,0,0]=2 4798 B8R1.7 CC(=O)N1CCNC1 Amb27795361 [0,0,0,1,0,0|2,0,0]=3 4799 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [0,0,0,1,0,0|1,0,0]=2 4800 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [0,0,0,1,0,0|1,0,0]=2 4801 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,0,0,1,0,0|1,0,0]=2 4802 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [0,0,0,1,0,0|1,0,0]=2 4803 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [0,0,0,1,0,0|1,0,0]=2 4804 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,0,0,1,0,0|1,0,0]=2 4805 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [0,0,0,1,0,0|1,0,0]=2 4806 B8R1.7 CC(Br)C1CCCC1 Amb18183992 [0,0,0,1,0,0|1,0,1]=3 4807 B8R1.7 CC(Br)C1CCCO1 Amb28396581 [0,0,0,1,0,0|2,0,1]=4 4808 B8R1.7 CC(Br)C1CCOC1 Amb27779768 [0,0,0,1,0,0|2,0,1]=4 4809 B8R1.7 CC(C)=C1CCNC1 Amb27227642 [0,0,0,1,0,0|2,0,1]=4 4810 B8R1.7 CC(C)C1CCCC1 Amb4019557 [0,0,0,1,0,0|1,0,1]=3 4811 B8R1.7 CC(C)C1CCCN1 Amb2234804 [0,0,0,1,0,0|2,0,1]=4 4812 B8R1.7 CC(C)C1CCCN1 Amb2237165 [0,0,0,1,0,0|2,0,1]=4 4813 B8R1.7 CC(C)C1CCNC1 Amb18946972 [0,0,0,1,0,0|2,0,1]=4 4814 B8R1.7 CC(C)C1CCNC1 Amb20630556 [0,0,0,1,0,0|2,0,1]=4 4815 B8R1.7 CC(C)N1CCCC1 Amb16186699 [0,0,0,1,0,0|2,0,1]=4 4816 B8R1.7 CC(C)[C@@H]1CCCN1 Amb24183507 [0,0,0,1,0,0|2,0,1]=4 4817 B8R1.7 CC(C)[C@@H]1CCCN1 Amb26515753 [0,0,0,1,0,0|2,0,1]=4 4818 B8R1.7 CC(C)[C@@H]1CCNC1 Amb27169420 [0,0,0,1,0,0|2,0,1]=4 4819 B8R1.7 CC(C)[C@@H]1CCNC1 Amb33805295 [0,0,0,1,0,0|2,0,1]=4 4820 B8R1.7 CC(C)[C@H]1CCCN1 Amb28071990 [0,0,0,1,0,0|2,0,1]=4 4821 B8R1.7 CC(C)[C@H]1CCCN1 Amb31204629 [0,0,0,1,0,0|2,0,1]=4 4822 B8R1.7 CC(C)[C@H]1CCNC1 Amb25890032 [0,0,0,1,0,0|2,0,1]=4 4823 B8R1.7 CC(C)[C@H]1CCNC1 Amb31307953 [0,0,0,1,0,0|2,0,1]=4 4824 B8R1.7 CC(Cl)C1CCCC1 Amb27638560 [0,0,0,1,0,0|1,0,1]=3 4825 B8R1.7 CC(Cl)C1CCOC1 Amb27979615 [0,0,0,1,0,0|2,0,1]=4 4826 B8R1.7 CC(F)C1CCCN1 Amb23454743 [0,0,0,1,0,0|2,0,1]=4 4827 B8R1.7 CC(N)C1CCCC1 Amb15701536 [0,0,0,1,0,0|1,0,1]=3 4828 B8R1.7 CC(N)C1CCCC1 Amb33537422 [0,0,0,1,0,0|1,0,1]=3 4829 B8R1.7 CC(N)C1CCCN1 Amb10609840 [0,0,0,1,0,0|2,0,1]=4 4830 B8R1.7 CC(N)C1CCCN1 Amb10610386 [0,0,0,1,0,0|2,0,1]=4 4831 B8R1.7 CC(N)C1CCCO1 Amb21955382 [0,0,0,1,0,0|2,0,1]=4 4832 B8R1.7 CC(N)C1CCCO1 Amb6888490 [0,0,0,1,0,0|2,0,1]=4 4833 B8R1.7 CC(N)C1CCCS1 Amb25173848 [0,0,0,1,0,0|2,0,1]=4 4834 B8R1.7 CC(N)C1CCNC1 Amb23448554 [0,0,0,1,0,0|2,0,1]=4 4835 B8R1.7 CC(N)C1CCOC1 Amb18203285 [0,0,0,1,0,0|2,0,1]=4 4836 B8R1.7 CC(N)C1CCOC1 Amb28934817 [0,0,0,1,0,0|2,0,1]=4 4837 B8R1.7 CC(N)C1CCSC1 Amb18831918 [0,0,0,1,0,0|2,0,1]=4 4838 B8R1.7 CC(O)C1CCCC1 Amb32409773 [0,0,0,1,0,0|0,0,2]=3 4839 B8R1.7 CC(O)C1CCCC1 Amb4035956 [0,0,0,1,0,0|0,0,2]=3 4840 B8R1.7 CC(O)C1CCCN1 Amb17231822 [0,0,0,1,0,0|1,0,2]=4 4841 B8R1.7 CC(O)C1CCCO1 Amb26319231 [0,0,0,1,0,0|1,0,2]=4 4842 B8R1.7 CC(O)C1CCNC1 Amb22886901 [0,0,0,1,0,0|1,0,2]=4 4843 B8R1.7 CC(O)C1CCNC1 Amb9782643 [0,0,0,1,0,0|1,0,2]=4 4844 B8R1.7 CC(O)C1CCOC1 Amb20623722 [0,0,0,1,0,0|1,0,2]=4 4845 B8R1.7 CC(O)N1CCCC1 Amb27650167 [0,0,0,1,0,0|1,0,2]=4 4846 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [0,0,0,1,0,0|1,0,2]=4 4847 B8R1.7 CC(O)[C@@H]1CCNC1 Amb35603308 [0,0,0,1,0,0|1,0,2]=4 4848 B8R1.7 CC(O)[C@H]1CCCN1 Amb26394098 [0,0,0,1,0,0|1,0,2]=4 4849 B8R1.7 CC(O)[C@H]1CCNC1 Amb35662397 [0,0,0,1,0,0|1,0,2]=4 4850 B8R1.7 CC(S)C1CCCC1 Amb25348009 [0,0,0,1,0,0|0,1,1]=3 4851 B8R1.7 CC(S)C1CCCN1 Amb30029014 [0,0,0,1,0,0|1,1,1]=4 4852 B8R1.7 CC(S)C1CCCO1 Amb28284983 [0,0,0,1,0,0|1,1,1]=4 4853 B8R1.7 CC(S)C1CCNC1 Amb32788344 [0,0,0,1,0,0|1,1,1]=4 4854 B8R1.7 CC(S)C1CCOC1 Amb25337944 [0,0,0,1,0,0|1,1,1]=4 4855 B8R1.7 CC(S)C1CCSC1 Amb32788169 [0,0,0,1,0,0|1,1,1]=4 4856 B8R1.7 CN(C)C1CCCC1 Amb4514269 [0,0,0,1,0,0|2,0,0]=3 4857 B8R1.7 CN(C)C1CCNC1 Amb20240914 [0,0,0,1,0,0|3,0,0]=4 4858 B8R1.7 CN(C)C1CCNC1 Amb22000872 [0,0,0,1,0,0|3,0,0]=4 4859 B8R1.7 CN(C)C1CCNC1 Amb9782211 [0,0,0,1,0,0|3,0,0]=4 4860 B8R1.7 CN(C)C1CCSC1 Amb29862248 [0,0,0,1,0,0|3,0,0]=4 4861 B8R1.7 CN(C)N1CCCC1 Amb28316233 [0,0,0,1,0,0|3,0,0]=4 4862 B8R1.7 CN(C)[C@@H]1CCNC1 Amb17935654 [0,0,0,1,0,0|3,0,0]=4 4863 B8R1.7 CN(C)[C@@H]1CCNC1 Amb3939662 [0,0,0,1,0,0|3,0,0]=4 4864 B8R1.7 CN(C)[C@H]1CCNC1 Amb22226436 [0,0,0,1,0,0|3,0,0]=4 4865 B8R1.7 CN(C)[C@H]1CCNC1 Amb8384312 [0,0,0,1,0,0|3,0,0]=4 4866 B8R1.7 CN(N)C1CCOC1 Amb27834079 [0,0,0,1,0,0|3,0,0]=4 4867 B8R1.7 CS(=O)C1CCCC1 Amb28049298 [0,0,0,1,0,0|1,0,0]=2 4868 B8R1.7 C[C@@H](N)C1CCCC1 Amb19515477 [0,0,0,1,0,0|1,0,1]=3 4869 B8R1.7 C[C@@H](N)C1CCCC1 Amb22748795 [0,0,0,1,0,0|1,0,1]=3 4870 B8R1.7 C[C@@H](N)C1CCCO1 Amb19514591 [0,0,0,1,0,0|2,0,1]=4 4871 B8R1.7 C[C@@H](N)C1CCCO1 Amb29838275 [0,0,0,1,0,0|2,0,1]=4 4872 B8R1.7 C[C@@H](N)C1CCCS1 Amb25115255 [0,0,0,1,0,0|2,0,1]=4 4873 B8R1.7 C[C@@H](N)C1CCOC1 Amb27668893 [0,0,0,1,0,0|2,0,1]=4 4874 B8R1.7 C[C@@H](N)C1CCSC1 Amb33141515 [0,0,0,1,0,0|2,0,1]=4 4875 B8R1.7 C[C@@H](N)[C@H]1CCNC1 Amb28053707 [0,0,0,1,0,0|2,0,1]=4 4876 B8R1.7 C[C@@H](N)[C@H]1CCOC1 Amb27613257 [0,0,0,1,0,0|2,0,1]=4 4877 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [0,0,0,1,0,0|0,0,2]=3 4878 B8R1.7 C[C@@H](O)C1CCCO1 Amb26854223 [0,0,0,1,0,0|1,0,2]=4 4879 B8R1.7 C[C@@H](O)C1CCCS1 Amb33416214 [0,0,0,1,0,0|1,0,2]=4 4880 B8R1.7 C[C@@H](O)C1CCOC1 Amb25724373 [0,0,0,1,0,0|1,0,2]=4 4881 B8R1.7 C[C@@H](O)C1CCSC1 Amb33141336 [0,0,0,1,0,0|1,0,2]=4 4882 B8R1.7 C[C@H](Br)[C@@H]1CCCO1 Amb27844359 [0,0,0,1,0,0|2,0,1]=4 4883 B8R1.7 C[C@H](N)C1CCCC1 Amb26017270 [0,0,0,1,0,0|1,0,1]=3 4884 B8R1.7 C[C@H](N)C1CCCC1 Amb33864065 [0,0,0,1,0,0|1,0,1]=3 4885 B8R1.7 C[C@H](N)C1CCCO1 Amb26872609 [0,0,0,1,0,0|2,0,1]=4 4886 B8R1.7 C[C@H](N)C1CCCS1 Amb24719948 [0,0,0,1,0,0|2,0,1]=4 4887 B8R1.7 C[C@H](N)C1CCOC1 Amb25889299 [0,0,0,1,0,0|2,0,1]=4 4888 B8R1.7 C[C@H](N)C1CCSC1 Amb33141514 [0,0,0,1,0,0|2,0,1]=4 4889 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [0,0,0,1,0,0|0,0,2]=3 4890 B8R1.7 C[C@H](O)C1CCCO1 Amb25985121 [0,0,0,1,0,0|1,0,2]=4 4891 B8R1.7 C[C@H](O)C1CCCS1 Amb33416213 [0,0,0,1,0,0|1,0,2]=4 4892 B8R1.7 C[C@H](O)C1CCNC1 Amb27264787 [0,0,0,1,0,0|1,0,2]=4 4893 B8R1.7 C[C@H](O)C1CCOC1 Amb24365203 [0,0,0,1,0,0|1,0,2]=4 4894 B8R1.7 C[C@H](O)C1CCSC1 Amb33141325 [0,0,0,1,0,0|1,0,2]=4 4895 B8R1.7 C[C@H](O)[C@H]1CCCO1 Amb26563465 [0,0,0,1,0,0|1,0,2]=4 4896 B8R1.7 C[N+](C)=C1CCCC1 Amb2779779 [0,0,0,1,0,0|2,0,1]=4 4897 B8R1.7 FC(Br)=C1CCCC1 Amb32993482 [0,0,0,1,0,0|2,0,1]=4 4898 B8R1.7 N=C(N)C1CCCC1 Amb2695059 [0,0,0,1,0,0|2,0,0]=3 4899 B8R1.7 N=C(N)C1CCCC1 Amb8630086 [0,0,0,1,0,0|2,0,0]=3 4900 B8R1.7 N=C(N)C1CCCN1 Amb24549144 [0,0,0,1,0,0|3,0,0]=4 4901 B8R1.7 N=C(N)C1CCCN1 Amb32718817 [0,0,0,1,0,0|3,0,0]=4 4902 B8R1.7 N=C(N)C1CCCO1 Amb22059430 [0,0,0,1,0,0|3,0,0]=4 4903 B8R1.7 N=C(N)C1CCCO1 Amb28934896 [0,0,0,1,0,0|3,0,0]=4 4904 B8R1.7 N=C(N)C1CCCS1 Amb24470321 [0,0,0,1,0,0|3,0,0]=4 4905 B8R1.7 N=C(N)C1CCNC1 Amb17934233 [0,0,0,1,0,0|3,0,0]=4 4906 B8R1.7 N=C(N)C1CCNC1 Amb24502578 [0,0,0,1,0,0|3,0,0]=4 4907 B8R1.7 N=C(N)C1CCNC1 Amb30585137 [0,0,0,1,0,0|3,0,0]=4 4908 B8R1.7 N=C(N)C1CCOC1 Amb28249322 [0,0,0,1,0,0|3,0,0]=4 4909 B8R1.7 N=C(N)C1CCOC1 Amb32434758 [0,0,0,1,0,0|3,0,0]=4 4910 B8R1.7 N=C(N)C1CCOC1 Amb33533170 [0,0,0,1,0,0|3,0,0]=4 4911 B8R1.7 N=C(N)C1CCSC1 Amb29849405 [0,0,0,1,0,0|3,0,0]=4 4912 B8R1.7 N=C(N)N1CCCC1 Amb2079636 [0,0,0,1,0,0|3,0,0]=4 4913 B8R1.7 N=C(N)N1CCCC1 Amb22736590 [0,0,0,1,0,0|3,0,0]=4 4914 B8R1.7 N=C(N)N1CCCC1 Amb2724397 [0,0,0,1,0,0|3,0,0]=4 4915 B8R1.7 N=C(N)N1CCCC1 Amb3429818 [0,0,0,1,0,0|3,0,0]=4 4916 B8R1.7 N=C(N)N1CCCC1 Amb453141 [0,0,0,1,0,0|3,0,0]=4 4917 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [0,0,0,1,0,0|1,0,2]=4 4918 B8R1.7 NC(=O)C1C=CCC1 Amb25063981 [0,0,0,1,0,0|1,0,2]=4 4919 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,0,0,1,0,0|1,0,2]=4 4920 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [0,0,0,1,0,0|1,0,0]=2 4921 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [0,0,0,1,0,0|2,0,0]=3 4922 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [0,0,0,1,0,0|2,0,0]=3 4923 B8R1.7 NC(=O)C1CCCO1 Amb33545693 [0,0,0,1,0,0|2,0,0]=3 4924 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [0,0,0,1,0,0|2,0,0]=3 4925 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [0,0,0,1,0,0|2,0,0]=3 4926 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [0,0,0,1,0,0|2,0,0]=3 4927 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [0,0,0,1,0,0|3,0,0]=4 4928 B8R1.7 NC(=O)C1NCCS1 Amb27655014 [0,0,0,1,0,0|3,0,0]=4 4929 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,0,0,1,0,0|2,0,0]=3 4930 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,0,0,1,0,0|2,0,0]=3 4931 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [0,0,0,1,0,0|2,0,0]=3 4932 B8R1.7 NC(=O)[C@@H]1CCCO1 Amb4166303 [0,0,0,1,0,0|2,0,0]=3 4933 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [0,0,0,1,0,0|2,0,0]=3 4934 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [0,0,0,1,0,0|2,0,0]=3 4935 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [0,0,0,1,0,0|2,0,0]=3 4936 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [0,0,0,1,0,0|3,0,0]=4 4937 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,0,0,1,0,0|2,0,0]=3 4938 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [0,0,0,1,0,0|2,0,0]=3 4939 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [0,0,0,1,0,0|2,0,0]=3 4940 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [0,0,0,1,0,0|2,0,0]=3 4941 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [0,0,0,1,0,0|2,0,0]=3 4942 B8R1.7 NC(=O)[C@H]1CNCO1 Amb27838356 [0,0,0,1,0,0|3,0,0]=4 4943 B8R1.7 NC(=O)[C@H]1CNCS1 Amb27488571 [0,0,0,1,0,0|3,0,0]=4 4944 B8R1.7 NC(=S)C1CCCC1 Amb6245625 [0,0,0,1,0,0|1,1,0]=3 4945 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [0,0,0,1,0,0|2,1,0]=4 4946 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,0,0,1,0,0|2,1,0]=4 4947 B8R1.7 NC(=S)C1CCCS1 Amb26896532 [0,0,0,1,0,0|2,1,0]=4 4948 B8R1.7 NC(=S)C1CCNC1 Amb35605372 [0,0,0,1,0,0|2,1,0]=4 4949 B8R1.7 NC(=S)C1CCOC1 Amb9704089 [0,0,0,1,0,0|2,1,0]=4 4950 B8R1.7 NC(=S)C1CCSC1 Amb30011189 [0,0,0,1,0,0|2,1,0]=4 4951 B8R1.7 NC(=S)N1CCCC1 Amb405550 [0,0,0,1,0,0|2,1,0]=4 4952 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [0,0,0,1,0,0|2,1,0]=4 4953 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [0,0,0,1,0,0|2,1,0]=4 4954 B8R1.7 NC(=[NH2+])N1CCCC1 Amb22269903 [0,0,0,1,0,0|3,0,0]=4 4955 B8R1.7 NC(=[NH2+])N1CCCC1 Amb9799909 [0,0,0,1,0,0|3,0,0]=4 4956 B8R1.7 NS(=O)C1CCCC1 Amb26405101 [0,0,0,1,0,0|2,0,0]=3 4957 B8R1.7 NS(=O)C1CCOC1 Amb32720361 [0,0,0,1,0,0|3,0,0]=4 4958 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [0,0,0,1,0,0|1,0,0]=2 4959 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [0,0,0,1,0,0|1,0,2]=4 4960 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,0,0,1,0,0|1,0,2]=4 4961 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [0,0,0,1,0,0|1,0,0]=2 4962 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [0,0,0,1,0,0|2,0,0]=3 4963 B8R1.7 O=C(Cl)C1CCCO1 Amb5747111 [0,0,0,1,0,0|2,0,0]=3 4964 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,0,0,1,0,0|2,0,0]=3 4965 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [0,0,0,1,0,0|2,0,0]=3 4966 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [0,0,0,1,0,0|2,0,0]=3 4967 B8R1.7 O=C(Cl)C1CCSC1 Amb27778382 [0,0,0,1,0,0|2,0,0]=3 4968 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [0,0,0,1,0,0|3,0,0]=4 4969 B8R1.7 O=C(Cl)N1CCCC1 Amb8516771 [0,0,0,1,0,0|2,0,0]=3 4970 B8R1.7 O=C(Cl)N1CCOC1 Amb32863956 [0,0,0,1,0,0|3,0,0]=4 4971 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [0,0,0,1,0,0|2,0,0]=3 4972 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [0,0,0,1,0,0|1,0,2]=4 4973 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [0,0,0,1,0,0|1,0,2]=4 4974 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,0,0,1,0,0|1,0,2]=4 4975 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,0,0,1,0,0|2,0,1]=4 4976 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,0,0,1,0,0|1,0,0]=2 4977 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,0,0,1,0,0|2,0,0]=3 4978 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,0,0,1,0,0|2,0,0]=3 4979 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,0,0,1,0,0|2,0,0]=3 4980 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,0,0,1,0,0|2,0,0]=3 4981 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [0,0,0,1,0,0|2,0,0]=3 4982 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [0,0,0,1,0,0|2,0,0]=3 4983 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [0,0,0,1,0,0|2,0,0]=3 4984 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,0,0,1,0,0|3,0,0]=4 4985 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,0,0,1,0,0|3,0,0]=4 4986 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [0,0,0,1,0,0|2,0,0]=3 4987 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [0,0,0,1,0,0|2,0,0]=3 4988 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [0,0,0,1,0,0|3,0,0]=4 4989 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [0,0,0,1,0,0|3,0,0]=4 4990 B8R1.7 O=C(O)C1COCN1 Amb2694915 [0,0,0,1,0,0|3,0,0]=4 4991 B8R1.7 O=C(O)C1COCN1 Amb2696354 [0,0,0,1,0,0|3,0,0]=4 4992 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,0,0,1,0,0|3,0,0]=4 4993 B8R1.7 O=C(O)C1CSCN1 Amb532947 [0,0,0,1,0,0|3,0,0]=4 4994 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [0,0,0,1,0,0|3,0,0]=4 4995 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [0,0,0,1,0,0|3,0,0]=4 4996 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,0,0,1,0,0|3,0,0]=4 4997 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [0,0,0,1,0,0|3,0,0]=4 4998 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,0,0,1,0,0|2,0,0]=3 4999 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,0,0,1,0,0|2,0,0]=3 5000 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,0,0,1,0,0|2,0,0]=3 5001 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [0,0,0,1,0,0|2,0,0]=3 5002 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [0,0,0,1,0,0|2,0,0]=3 5003 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [0,0,0,1,0,0|2,0,0]=3 5004 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [0,0,0,1,0,0|3,0,0]=4 5005 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [0,0,0,1,0,0|3,0,0]=4 5006 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [0,0,0,1,0,0|3,0,0]=4 5007 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [0,0,0,1,0,0|1,0,2]=4 5008 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,0,0,1,0,0|2,0,1]=4 5009 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,0,0,1,0,0|2,0,0]=3 5010 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,0,0,1,0,0|2,0,0]=3 5011 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [0,0,0,1,0,0|2,0,0]=3 5012 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [0,0,0,1,0,0|2,0,0]=3 5013 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [0,0,0,1,0,0|2,0,0]=3 5014 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [0,0,0,1,0,0|2,0,0]=3 5015 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [0,0,0,1,0,0|3,0,0]=4 5016 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [0,0,0,1,0,0|3,0,0]=4 5017 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [0,0,0,1,0,0|3,0,0]=4 5018 B8R1.7 O=C(S)C1CCCO1 Amb27827519 [0,0,0,1,0,0|2,0,0]=3 5019 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [0,0,0,1,0,0|2,0,0]=3 5020 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,0,0,1,0,0|2,0,0]=3 5021 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [0,0,0,1,0,0|2,0,1]=4 5022 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [0,0,0,1,0,0|2,0,0]=3 5023 B8R1.7 O=S(Cl)C1CCCC1 Amb25914787 [0,0,0,1,0,0|2,0,0]=3 5024 B8R1.7 O=S(Cl)C1CCOC1 Amb32720381 [0,0,0,1,0,0|3,0,0]=4 5025 B8R1.7 O=S([O-])C1CCCC1 Amb26419894 [0,0,0,1,0,0|2,0,0]=3 5026 B8R1.7 O=S([O-])C1CCOC1 Amb32754091 [0,0,0,1,0,0|3,0,0]=4 5027 B8R1.7 O=[N+]([O-])C1CCCC1 Amb8517343 [0,0,0,1,0,0|2,0,0]=3 5028 B8R1.7 O=[N+]([O-])C1CCOC1 Amb32992809 [0,0,0,1,0,0|3,0,0]=4 5029 B8R1.7 O=[N+]([O-])C1CCSC1 Amb33299031 [0,0,0,1,0,0|3,0,0]=4 5030 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [0,0,0,1,0,0|3,0,0]=4 5031 B8R1.7 OB(O)C1CCCC1 Amb2447144 [0,0,0,1,0,0|2,0,1]=4 5032 B8R1.7 S=C(S)N1CCCC1 Amb391421 [0,0,0,1,0,0|2,1,0]=4 5033 B8R1.7 S=C([S-])N1CCCC1 Amb15741178 [0,0,0,1,0,0|2,1,0]=4 5034 B8R1.7 S=C([S-])N1CCCC1 Amb6357434 [0,0,0,1,0,0|2,1,0]=4 5035 B8R1.9 C=C1CC1CCC=O Amb27256377 [0,0,0,1,0,0|2,0,1]=4 5036 B8R1.9 C=C1CC1CCCO Amb27801929 [0,0,0,1,0,0|2,0,0]=3 5037 B8R1.9 CC1CC1CCCBr Amb33431531 [0,0,0,1,0,0|2,0,1]=4 5038 B8R1.9 CC1CC1CCCN Amb33224007 [0,0,0,1,0,0|2,0,1]=4 5039 B8R1.9 CC1CC1CCCO Amb33213606 [0,0,0,1,0,0|2,0,1]=4 5040 B8R1.9 CC1CC1CCCS Amb33143845 [0,0,0,1,0,0|2,0,1]=4 5041 B8R1.9 CC1OC1CCCBr Amb28383540 [0,0,0,1,0,0|1,0,2]=4 5042 B8R1.9 CC1OC1CCCO Amb28344681 [0,0,0,1,0,0|1,0,2]=4 5043 B8R1.9 CCCCC1CC1N Amb25989937 [0,0,0,1,0,0|1,0,1]=3 5044 B8R1.9 CCCCC1OC1O Amb27493204 [0,0,0,1,0,0|1,0,2]=4 5045 B8R1.9 CCCC[C@@H]1C[C@@H]1Cl Amb27857045 [0,0,0,1,0,0|1,0,1]=3 5046 B8R1.9 CCCC[C@@H]1C[C@H]1N Amb27188372 [0,0,0,1,0,0|1,0,1]=3 5047 B8R1.9 CCCO[C@@H]1C[C@H]1N Amb33347099 [0,0,0,1,0,0|2,0,1]=4 5048 B8R1.9 CCSCC1CC1N Amb33324026 [0,0,0,1,0,0|2,0,1]=4 5049 B8R1.9 CCSC[C@@H]1C[C@H]1N Amb33324037 [0,0,0,1,0,0|2,0,1]=4 5050 B8R1.9 CNCCC1CC1C Amb33359776 [0,0,0,1,0,0|2,0,1]=4 5051 B8R1.9 COCCC1CC1N Amb33377825 [0,0,0,1,0,0|2,0,1]=4 5052 B8R1.9 COCC[C@@H]1C[C@H]1N Amb33377826 [0,0,0,1,0,0|2,0,1]=4 5053 B8R1.9 CSCCC1CC1N Amb33198754 [0,0,0,1,0,0|2,0,1]=4 5054 B8R1.9 CSCC[C@@H]1C[C@H]1N Amb33198755 [0,0,0,1,0,0|2,0,1]=4 5055 B8R1.9 C[C@H]1O[C@@H]1CCCCl Amb27229206 [0,0,0,1,0,0|1,0,2]=4 5056 B8R1.9 C[C@H]1O[C@H]1CCCBr Amb27863536 [0,0,0,1,0,0|1,0,2]=4 5057 B8R1.9 O[C@@H]1C[C@H]1CCCCl Amb27202822 [0,0,0,1,0,0|1,0,2]=4 5058 B8R1.9 O[C@H]1C[C@@H]1CCCCl Amb27428217 [0,0,0,1,0,0|1,0,2]=4 5059 B8R1.19 CC1(C)CCCC1Br Amb24710278 [0,0,0,1,0,0|2,0,1]=4 5060 B8R1.19 CC1(C)CCCC1N Amb20622593 [0,0,0,1,0,0|2,0,1]=4 5061 B8R1.19 CC1(C)CCCC1N Amb31291554 [0,0,0,1,0,0|2,0,1]=4 5062 B8R1.19 CC1(C)CCCC1O Amb8496594 [0,0,0,1,0,0|2,0,1]=4 5063 B8R1.19 CC1(C)CCCC1S Amb24409187 [0,0,0,1,0,0|2,0,1]=4 5064 B8R1.19 CC1(C)CCC[C@@H]1O Amb25802028 [0,0,0,1,0,0|2,0,1]=4 5065 B8R1.19 CC1(C)CCC[C@H]1O Amb24689522 [0,0,0,1,0,0|2,0,1]=4 5066 B8R1.19 CC1(Cl)CCCC1Br Amb28076642 [0,0,0,1,0,0|2,0,1]=4 5067 B8R1.19 CC1(F)CCCC1O Amb27853543 [0,0,0,1,0,0|2,0,1]=4 5068 B8R1.19 CC1(N)CCCC1F Amb27804167 [0,0,0,1,0,0|2,0,1]=4 5069 B8R1.19 CC1(N)CCCC1N Amb18641817 [0,0,0,1,0,0|2,0,1]=4 5070 B8R1.19 CC1(N)CCCC1O Amb25169116 [0,0,0,1,0,0|2,0,1]=4 5071 B8R1.19 CC1(O)CCCC1N Amb22295747 [0,0,0,1,0,0|1,0,2]=4 5072 B8R1.19 CC1(O)CCCC1N Amb32674775 [0,0,0,1,0,0|1,0,2]=4 5073 B8R1.19 CC1CCCC1(C)C Amb25368248 [0,0,0,1,0,0|1,0,1]=3 5074 B8R1.19 CC1CCCC1(C)N Amb26887663 [0,0,0,1,0,0|1,0,1]=3 5075 B8R1.19 CC1CCCC1(C)O Amb28318222 [0,0,0,1,0,0|0,0,2]=3 5076 B8R1.19 CC1CCCC1(F)F Amb20669929 [0,0,0,1,0,0|2,0,1]=4 5077 B8R1.19 CC1CCCS1(=O)=O Amb2797231 [0,0,0,1,0,0|2,0,0]=3 5078 B8R1.19 CC1CCNC1(C)C Amb18277514 [0,0,0,1,0,0|2,0,1]=4 5079 B8R1.19 CC1CCNS1(=O)=O Amb33298956 [0,0,0,1,0,0|3,0,0]=4 5080 B8R1.19 CC1CNCC1(C)C Amb28048566 [0,0,0,1,0,0|2,0,1]=4 5081 B8R1.19 CC1NCCC1(C)C Amb18943920 [0,0,0,1,0,0|2,0,1]=4 5082 B8R1.19 CC1NCCC1(C)C Amb31156693 [0,0,0,1,0,0|2,0,1]=4 5083 B8R1.19 CC1OCCC1(C)N Amb24742098 [0,0,0,1,0,0|2,0,1]=4 5084 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,0,0,1,0,0|3,0,0]=4 5085 B8R1.19 C[C@@H]1CNC[C@@]1(C)N Amb27216638 [0,0,0,1,0,0|2,0,1]=4 5086 B8R1.19 C[C@@H]1COC[C@]1(C)O Amb22886885 [0,0,0,1,0,0|1,0,2]=4 5087 B8R1.19 C[C@@]1(Cl)CCC[C@H]1Br Amb28144743 [0,0,0,1,0,0|2,0,1]=4 5088 B8R1.19 C[C@@]1(Cl)CCC[C@H]1Cl Amb27845480 [0,0,0,1,0,0|2,0,1]=4 5089 B8R1.19 C[C@@]1(O)CCC[C@@H]1O Amb27207789 [0,0,0,1,0,0|1,0,2]=4 5090 B8R1.19 C[C@@]1(O)CCC[C@H]1O Amb27437196 [0,0,0,1,0,0|1,0,2]=4 5091 B8R1.19 C[C@]1(O)CCC[C@@H]1N Amb28059560 [0,0,0,1,0,0|1,0,2]=4 5092 B8R1.19 NC1CCCS1(=O)=O Amb27421871 [0,0,0,1,0,0|3,0,0]=4 5093 B8R1.20 C=C(C)C[C@@H]1O[C@H]1Cl Amb27227484 [0,0,0,1,0,0|3,0,0]=4 5094 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,0,0,1,0,0|1,0,2]=4 5095 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,0,0,1,0,0|0,0,2]=3 5096 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 5097 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,0,0,1,0,0|0,0,0]=1 5098 B8R1.20 CC(=O)CC1OC1C Amb27767850 [0,0,0,1,0,0|1,0,0]=2 5099 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,0,0,1,0,0|0,0,0]=1 5100 B8R1.20 CC(=O)NC1CC1N Amb32663550 [0,0,0,1,0,0|2,0,0]=3 5101 B8R1.20 CC(=O)NC1CC1N Amb9457357 [0,0,0,1,0,0|2,0,0]=3 5102 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664511 [0,0,0,1,0,0|2,0,0]=3 5103 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664512 [0,0,0,1,0,0|2,0,0]=3 5104 B8R1.20 CC(Br)CC1CC1C Amb33433867 [0,0,0,1,0,0|1,0,1]=3 5105 B8R1.20 CC(C)CC1CC1N Amb18285795 [0,0,0,1,0,0|2,0,1]=4 5106 B8R1.20 CC(C)CC1CC1N Amb32661702 [0,0,0,1,0,0|2,0,1]=4 5107 B8R1.20 CC(C)CC1CC1O Amb27625280 [0,0,0,1,0,0|2,0,1]=4 5108 B8R1.20 CC(C)C[C@@H]1C[C@H]1N Amb25964927 [0,0,0,1,0,0|2,0,1]=4 5109 B8R1.20 CC(C)C[C@@H]1C[C@H]1N Amb28736198 [0,0,0,1,0,0|2,0,1]=4 5110 B8R1.20 CC(O)CC1CC1C Amb28284530 [0,0,0,1,0,0|0,0,2]=3 5111 B8R1.20 CC(O)CC1OC1C Amb27763687 [0,0,0,1,0,0|1,0,2]=4 5112 B8R1.20 CC(O)C[C@@H]1C[C@H]1C Amb27456742 [0,0,0,1,0,0|0,0,2]=3 5113 B8R1.20 CC(O)C[C@@H]1O[C@@H]1C Amb27852494 [0,0,0,1,0,0|1,0,2]=4 5114 B8R1.20 CC(O)C[C@@H]1O[C@H]1C Amb28197530 [0,0,0,1,0,0|1,0,2]=4 5115 B8R1.20 CC(O)C[C@H]1O[C@H]1C Amb27220288 [0,0,0,1,0,0|1,0,2]=4 5116 B8R1.20 CC1CC1CC(=N)N Amb33144831 [0,0,0,1,0,0|2,0,0]=3 5117 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,0|1,0,0]=2 5118 B8R1.20 CC1CC1CC(N)=S Amb33144881 [0,0,0,1,0,0|1,1,0]=3 5119 B8R1.20 CC1CC1CN(C)O Amb33145039 [0,0,0,1,0,0|1,0,1]=3 5120 B8R1.20 CC1CC1C[C@@H](C)N Amb33144899 [0,0,0,1,0,0|1,0,1]=3 5121 B8R1.20 CC1CC1C[C@@H](C)O Amb33144240 [0,0,0,1,0,0|0,0,2]=3 5122 B8R1.20 CC1CC1C[C@H](C)N Amb33144898 [0,0,0,1,0,0|1,0,1]=3 5123 B8R1.20 CC1CC1C[C@H](C)O Amb33144242 [0,0,0,1,0,0|0,0,2]=3 5124 B8R1.20 CC1CC1C[N+](=O)[O-] Amb33144229 [0,0,0,1,0,0|2,0,0]=3 5125 B8R1.20 CC1CC1NC(=O)Cl Amb35625773 [0,0,0,1,0,0|2,0,0]=3 5126 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,0|2,1,0]=4 5127 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,0,0,1,0,0|1,0,2]=4 5128 B8R1.20 C[C@@H]1C[C@H]1CB(O)O Amb27448502 [0,0,0,1,0,0|2,0,1]=4 5129 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,0|1,0,0]=2 5130 B8R1.20 C[C@@H]1C[C@H]1NC(N)=O Amb28059830 [0,0,0,1,0,0|2,0,0]=3 5131 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,0|2,0,0]=3 5132 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,0|2,0,0]=3 5133 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,0|2,0,0]=3 5134 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,1,0,0|1,0,1]=3 5135 B8R1.22 BrC1CCCCCC1 Amb3940357 [0,0,0,1,0,0|1,0,1]=3 5136 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,1]=4 5137 B8R1.22 BrC1CCCSCC1 Amb35627432 [0,0,0,1,0,0|2,0,1]=4 5138 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,0,0,1,0,0|2,0,0]=3 5139 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,0,0,1,0,0|2,0,0]=3 5140 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,1,0,0|1,0,2]=4 5141 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,1,0,0|1,0,0]=2 5142 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|1,0,1]=3 5143 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|1,0,1]=3 5144 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|0,0,2]=3 5145 B8R1.22 CC1CCCCNC1 Amb22886304 [0,0,0,1,0,0|2,0,1]=4 5146 B8R1.22 CC1CCCCNC1 Amb27202179 [0,0,0,1,0,0|2,0,1]=4 5147 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,1]=4 5148 B8R1.22 CC1CCCNCC1 Amb9316855 [0,0,0,1,0,0|2,0,1]=4 5149 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,1,0,0|1,0,2]=4 5150 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|2,0,1]=4 5151 B8R1.22 CC1CCNCCN1 Amb8630390 [0,0,0,1,0,0|2,0,1]=4 5152 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,1,0,0|1,0,2]=4 5153 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,1,0,0|1,0,2]=4 5154 B8R1.22 CC1CCNCCS1 Amb33530238 [0,0,0,1,0,0|1,1,1]=4 5155 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|2,0,1]=4 5156 B8R1.22 CC1CCOCCN1 Amb30585116 [0,0,0,1,0,0|2,0,1]=4 5157 B8R1.22 CC1CCSCCN1 Amb28934844 [0,0,0,1,0,0|2,0,1]=4 5158 B8R1.22 CC1CCSCCN1 Amb33540166 [0,0,0,1,0,0|2,0,1]=4 5159 B8R1.22 CC1CNCCCN1 Amb33544983 [0,0,0,1,0,0|2,0,1]=4 5160 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|1,0,2]=4 5161 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,1,0,0|1,0,2]=4 5162 B8R1.22 CC1CNCCCS1 Amb27238313 [0,0,0,1,0,0|1,1,1]=4 5163 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,1]=4 5164 B8R1.22 CC1CSCCCN1 Amb25870575 [0,0,0,1,0,0|2,0,1]=4 5165 B8R1.22 CC1CSCCCN1 Amb30585125 [0,0,0,1,0,0|2,0,1]=4 5166 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|1,0,2]=4 5167 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|2,0,0]=3 5168 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 5169 B8R1.22 CN1CCCNCC1 Amb3939085 [0,0,0,1,0,0|3,0,0]=4 5170 B8R1.22 CN1CCNCCO1 Amb27226764 [0,0,0,1,0,0|2,0,1]=4 5171 B8R1.22 C[C@@H]1CCCCCN1 Amb27391648 [0,0,0,1,0,0|1,0,1]=3 5172 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,1,0,0|1,0,2]=4 5173 B8R1.22 C[C@@H]1CNCCCN1 Amb35825205 [0,0,0,1,0,0|2,0,1]=4 5174 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,1,0,0|2,0,1]=4 5175 B8R1.22 C[C@H]1CNCCCN1 Amb26461498 [0,0,0,1,0,0|2,0,1]=4 5176 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,1,0,0|1,0,2]=4 5177 B8R1.22 ClC1CCCCNC1 Amb28048243 [0,0,0,1,0,0|2,0,1]=4 5178 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,0,0,1,0,0|2,0,1]=4 5179 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,1,0,0|2,0,1]=4 5180 B8R1.22 ClC1CCCSCC1 Amb35650778 [0,0,0,1,0,0|2,0,1]=4 5181 B8R1.22 ClN1CCCOCC1 Amb27217968 [0,0,0,1,0,0|3,0,0]=4 5182 B8R1.22 FC1CCCCCC1 Amb28049012 [0,0,0,1,0,0|1,0,1]=3 5183 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|2,0,1]=4 5184 B8R1.22 FC1CCCCNC1 Amb22886275 [0,0,0,1,0,0|2,0,1]=4 5185 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|2,0,1]=4 5186 B8R1.22 FC1CCCNCC1 Amb27453588 [0,0,0,1,0,0|2,0,1]=4 5187 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,1,0,0|2,0,1]=4 5188 B8R1.22 NC1=NCCCCC1 Amb19514661 [0,0,0,1,0,0|2,0,0]=3 5189 B8R1.22 NC1=NCCCCC1 Amb4451463 [0,0,0,1,0,0|2,0,0]=3 5190 B8R1.22 NC1=NCCCCN1 Amb28119984 [0,0,0,1,0,0|3,0,0]=4 5191 B8R1.22 NC1=NCCCCS1 Amb27592425 [0,0,0,1,0,0|2,1,0]=4 5192 B8R1.22 NC1=NCCCSC1 Amb25688170 [0,0,0,1,0,0|3,0,0]=4 5193 B8R1.22 NC1CCCCCC1 Amb2720336 [0,0,0,1,0,0|1,0,1]=3 5194 B8R1.22 NC1CCCCNC1 Amb2684433 [0,0,0,1,0,0|2,0,1]=4 5195 B8R1.22 NC1CCCCNC1 Amb8631384 [0,0,0,1,0,0|2,0,1]=4 5196 B8R1.22 NC1CCCNCC1 Amb4296999 [0,0,0,1,0,0|2,0,1]=4 5197 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,1,0,0|2,0,1]=4 5198 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,0,1]=4 5199 B8R1.22 NC1CCCSCC1 Amb33328660 [0,0,0,1,0,0|2,0,1]=4 5200 B8R1.22 NN1CCCCCC1 Amb836794 [0,0,0,1,0,0|2,0,0]=3 5201 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|2,0,1]=4 5202 B8R1.22 N[C@H]1CCCCNC1 Amb22744950 [0,0,0,1,0,0|2,0,1]=4 5203 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,0,0,1,0,0|0,0,2]=3 5204 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,1,0,0|1,0,2]=4 5205 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,1,0,0|0,0,2]=3 5206 B8R1.22 O=C1CC=CCCN1 Amb27830230 [0,0,0,1,0,0|1,0,2]=4 5207 B8R1.22 O=C1CC=COCC1 Amb27835241 [0,0,0,1,0,0|1,0,2]=4 5208 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,1,0,0|0,0,2]=3 5209 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,0,0,1,0,0|1,0,2]=4 5210 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,0,0,1,0,0|0,0,0]=1 5211 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,0,0,1,0,0|1,0,0]=2 5212 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,0,0,1,0,0|1,0,0]=2 5213 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,1,0,0|1,0,0]=2 5214 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,1,0,0|1,0,0]=2 5215 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,0,0,1,0,0|1,0,0]=2 5216 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,0,0,1,0,0|1,0,0]=2 5217 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,0,0,1,0,0|1,0,0]=2 5218 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,0,0,1,0,0|1,0,0]=2 5219 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,0,0,1,0,0|1,0,0]=2 5220 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,1,0,0|1,0,0]=2 5221 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,0,0,1,0,0|2,0,0]=3 5222 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,0,0,1,0,0|2,0,0]=3 5223 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,0,0,1,0,0|2,0,0]=3 5224 B8R1.22 O=C1CCNCCN1 Amb483265 [0,0,0,1,0,0|2,0,0]=3 5225 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,0,0,1,0,0|2,0,0]=3 5226 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,0,0,1,0,0|2,0,0]=3 5227 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,0,0,1,0,0|2,0,0]=3 5228 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,0,0,1,0,0|2,0,0]=3 5229 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,1,0,0|2,0,0]=3 5230 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,1,0,0|2,0,0]=3 5231 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,0,0,1,0,0|2,0,0]=3 5232 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,0,0,1,0,0|2,0,0]=3 5233 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,1,0,0|2,0,0]=3 5234 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,1,0,0|2,0,0]=3 5235 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,0,0,1,0,0|2,0,0]=3 5236 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,0,0,1,0,0|2,0,0]=3 5237 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,0,0,1,0,0|2,0,0]=3 5238 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,1,0,0|2,0,0]=3 5239 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,1,0,0|2,0,0]=3 5240 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,0,0,1,0,0|3,0,0]=4 5241 B8R1.22 OC1CCCCCC1 Amb3940358 [0,0,0,1,0,0|0,0,2]=3 5242 B8R1.22 OC1CCCCCO1 Amb4034492 [0,0,0,1,0,0|1,0,2]=4 5243 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|1,0,2]=4 5244 B8R1.22 OC1CCCCNC1 Amb22371121 [0,0,0,1,0,0|1,0,2]=4 5245 B8R1.22 OC1CCCCNC1 Amb22886250 [0,0,0,1,0,0|1,0,2]=4 5246 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,1,0,0|1,0,2]=4 5247 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|1,0,2]=4 5248 B8R1.22 OC1CCCNCC1 Amb2695607 [0,0,0,1,0,0|1,0,2]=4 5249 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|1,0,2]=4 5250 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|1,0,2]=4 5251 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,1,0,0|1,0,2]=4 5252 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,1,0,0|1,0,2]=4 5253 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,1,0,0|1,1,0]=3 5254 B8R1.22 S=C1NCCCCN1 Amb2724259 [0,0,0,1,0,0|2,1,0]=4 5255 B8R1.22 SC1CCCCCC1 Amb9208052 [0,0,0,1,0,0|0,1,1]=3 5256 B8R1.22 SC1CCCNCC1 Amb32788297 [0,0,0,1,0,0|1,1,1]=4 5257 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|1,1,1]=4 5258 B8R1.22 SC1CCCSCC1 Amb32788173 [0,0,0,1,0,0|1,1,1]=4 5259 B8R1.27 CC1(C)CC1CCBr Amb33483054 [0,0,0,1,0,0|2,0,1]=4 5260 B8R1.27 CC1(C)CC1CCCl Amb27468734 [0,0,0,1,0,0|2,0,1]=4 5261 B8R1.27 CC1(C)CC1CCN Amb32666640 [0,0,0,1,0,0|2,0,1]=4 5262 B8R1.27 CC1(C)CC1CCO Amb25051441 [0,0,0,1,0,0|2,0,1]=4 5263 B8R1.27 CC1(O)CC1CCO Amb27588888 [0,0,0,1,0,0|1,0,2]=4 5264 B8R1.27 CCOC1CC1(C)C Amb27622014 [0,0,0,1,0,0|2,0,1]=4 5265 B8R1.27 CNCC1CC1(C)C Amb10608234 [0,0,0,1,0,0|2,0,1]=4 5266 B8R1.27 CNCC1CC1(C)C Amb22587192 [0,0,0,1,0,0|2,0,1]=4 5267 B8R1.27 CNC[C@H]1CC1(C)C Amb32650348 [0,0,0,1,0,0|2,0,1]=4 5268 B8R1.31 C=C(C)C1CCC1=O Amb28383142 [0,0,0,1,0,0|2,0,1]=4 5269 B8R1.31 C=C(C)C1CCC1O Amb25993078 [0,0,0,1,0,0|2,0,0]=3 5270 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,0,0,1,0,0|1,0,2]=4 5271 B8R1.31 CC(=O)C1=C(C)CC1 Amb28316170 [0,0,0,1,0,0|0,0,2]=3 5272 B8R1.31 CC(=O)C1=C(Cl)CC1 Amb28048920 [0,0,0,1,0,0|1,0,2]=4 5273 B8R1.31 CC(=O)C1CCC1=O Amb26910118 [0,0,0,1,0,0|1,0,1]=3 5274 B8R1.31 CC(=O)C1CCC1O Amb33213172 [0,0,0,1,0,0|1,0,0]=2 5275 B8R1.31 CC(=O)N1CCC1C Amb27603227 [0,0,0,1,0,0|1,0,0]=2 5276 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,0,0,1,0,0|0,0,0]=1 5277 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,0,0,1,0,0|0,0,0]=1 5278 B8R1.31 CC(C)C1CCC1O Amb27165224 [0,0,0,1,0,0|2,0,1]=4 5279 B8R1.31 CC(N)C1CCN1C Amb27971091 [0,0,0,1,0,0|2,0,1]=4 5280 B8R1.31 CC(O)C1CCC1F Amb34153521 [0,0,0,1,0,0|1,0,2]=4 5281 B8R1.31 CC1CCC1C(=N)N Amb35745182 [0,0,0,1,0,0|2,0,0]=3 5282 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,1,0,0|1,0,0]=2 5283 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,0,0,1,0,0|2,0,0]=3 5284 B8R1.31 CN(C)C1CCC1O Amb24483060 [0,0,0,1,0,0|3,0,0]=4 5285 B8R1.31 CN(C)[C@@H]1CC[C@H]1N Amb33734264 [0,0,0,1,0,0|3,0,0]=4 5286 B8R1.31 CN(C)[C@@H]1CC[C@H]1N Amb33742712 [0,0,0,1,0,0|3,0,0]=4 5287 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,0,0,1,0,0|2,0,0]=3 5288 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,0,0,1,0,0|2,0,0]=3 5289 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,0,0,1,0,0|2,0,0]=3 5290 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,1,0,0|1,0,0]=2 5291 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,0,0,1,0,0|2,0,0]=3 5292 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,0,0,1,0,0|2,0,0]=3 5293 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,0,0,1,0,0|2,0,0]=3 5294 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,0,0,1,0,0|1,0,0]=2 5295 B8R1.31 NC(=O)C1CCC1F Amb32943793 [0,0,0,1,0,0|2,0,0]=3 5296 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,0,0,1,0,0|2,0,0]=3 5297 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,0,0,1,0,0|2,0,0]=3 5298 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,0,0,1,0,0|2,0,0]=3 5299 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,0,0,1,0,0|3,0,0]=4 5300 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,0,0,1,0,0|3,0,0]=4 5301 B8R1.31 NS(=O)[C@@H]1CC[C@@H]1F Amb32720839 [0,0,0,1,0,0|3,0,0]=4 5302 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,0,0,1,0,0|2,0,0]=3 5303 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,0,0,1,0,0|2,0,0]=3 5304 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,0,0,1,0,0|2,0,0]=3 5305 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,0,0,1,0,0|2,0,0]=3 5306 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,0,0,1,0,0|3,0,0]=4 5307 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,0,0,1,0,0|2,0,0]=3 5308 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,0,0,1,0,0|2,0,0]=3 5309 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,0,0,1,0,0|2,0,0]=3 5310 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,0,0,1,0,0|2,0,0]=3 5311 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,0,0,1,0,0|3,0,0]=4 5312 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,0,0,1,0,0|3,0,0]=4 5313 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,0,0,1,0,0|2,0,0]=3 5314 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,0,0,1,0,0|2,0,0]=3 5315 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,0,0,1,0,0|2,0,0]=3 5316 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,0,0,1,0,0|2,0,0]=3 5317 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,0,0,1,0,0|2,0,0]=3 5318 B8R1.31 O=S(Cl)[C@@H]1CC[C@@H]1F Amb32720881 [0,0,0,1,0,0|3,0,0]=4 5319 B8R1.31 O=S([O-])[C@@H]1CC[C@@H]1F Amb32755401 [0,0,0,1,0,0|3,0,0]=4 5320 B8R1.34 BrC(Br)=CC1CCC1 Amb28070853 [0,0,0,1,0,0|2,0,1]=4 5321 B8R1.34 C=C(C)C=C1CCC1 Amb27751732 [0,0,0,1,0,0|1,0,2]=4 5322 B8R1.34 C=C(C)CC1CNC1 Amb24576858 [0,0,0,1,0,0|2,0,0]=3 5323 B8R1.34 CC(=N)NC1CCC1 Amb28068644 [0,0,0,1,0,0|2,0,0]=3 5324 B8R1.34 CC(=O)C=C1CNC1 Amb34161721 [0,0,0,1,0,0|1,0,2]=4 5325 B8R1.34 CC(=O)C=C1COC1 Amb20671341 [0,0,0,1,0,0|1,0,2]=4 5326 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,0,0,1,0,0|0,0,0]=1 5327 B8R1.34 CC(=O)CC1CNC1 Amb26366652 [0,0,0,1,0,0|1,0,0]=2 5328 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,0,0,1,0,0|1,0,0]=2 5329 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,0,0,1,0,0|2,0,0]=3 5330 B8R1.34 CC(=O)NC1CNC1 Amb8011307 [0,0,0,1,0,0|2,0,0]=3 5331 B8R1.34 CC(=O)NN1CCC1 Amb32674457 [0,0,0,1,0,0|2,0,0]=3 5332 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,0,0,1,0,0|2,0,0]=3 5333 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,0,0,1,0,0|2,0,0]=3 5334 B8R1.34 CC(=O)OC1CNC1 Amb30594705 [0,0,0,1,0,0|2,0,0]=3 5335 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,0,0,1,0,0|2,0,0]=3 5336 B8R1.34 CC(=O)SC1CNC1 Amb26017419 [0,0,0,1,0,0|2,0,0]=3 5337 B8R1.34 CC(=O)SC1CNC1 Amb34154195 [0,0,0,1,0,0|2,0,0]=3 5338 B8R1.34 CC(=O)SC1COC1 Amb28074762 [0,0,0,1,0,0|2,0,0]=3 5339 B8R1.34 CC(Br)CC1CCC1 Amb25335129 [0,0,0,1,0,0|1,0,1]=3 5340 B8R1.34 CC(C)=CN1CCC1 Amb34161867 [0,0,0,1,0,0|2,0,1]=4 5341 B8R1.34 CC(C)CC1CCC1 Amb26550147 [0,0,0,1,0,0|1,0,1]=3 5342 B8R1.34 CC(C)CC1CCN1 Amb27663132 [0,0,0,1,0,0|2,0,1]=4 5343 B8R1.34 CC(C)CC1CCN1 Amb33276517 [0,0,0,1,0,0|2,0,1]=4 5344 B8R1.34 CC(C)CC1CNC1 Amb18960085 [0,0,0,1,0,0|2,0,1]=4 5345 B8R1.34 CC(C)CC1CNC1 Amb33457318 [0,0,0,1,0,0|2,0,1]=4 5346 B8R1.34 CC(C)NC1CCC1 Amb18960945 [0,0,0,1,0,0|2,0,1]=4 5347 B8R1.34 CC(C)NC1CCC1 Amb19374818 [0,0,0,1,0,0|2,0,1]=4 5348 B8R1.34 CC(Cl)CC1CCC1 Amb27262160 [0,0,0,1,0,0|1,0,1]=3 5349 B8R1.34 CC(N)CC1CCC1 Amb25368240 [0,0,0,1,0,0|1,0,1]=3 5350 B8R1.34 CC(N)CC1CCC1 Amb30585105 [0,0,0,1,0,0|1,0,1]=3 5351 B8R1.34 CC(N)CC1CCO1 Amb25351976 [0,0,0,1,0,0|2,0,1]=4 5352 B8R1.34 CC(N)CC1CCS1 Amb27259851 [0,0,0,1,0,0|2,0,1]=4 5353 B8R1.34 CC(N)CC1CNC1 Amb27635046 [0,0,0,1,0,0|2,0,1]=4 5354 B8R1.34 CC(N)CC1CSC1 Amb27209183 [0,0,0,1,0,0|2,0,1]=4 5355 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,0,0,1,0,0|0,0,2]=3 5356 B8R1.34 CC(O)CC1CNC1 Amb35622518 [0,0,0,1,0,0|1,0,2]=4 5357 B8R1.34 CC(O)CN1CCC1 Amb28048933 [0,0,0,1,0,0|1,0,2]=4 5358 B8R1.34 CC(S)CC1CCC1 Amb24421800 [0,0,0,1,0,0|0,1,1]=3 5359 B8R1.34 CN(C)CC1CCC1 Amb1779269 [0,0,0,1,0,0|2,0,0]=3 5360 B8R1.34 CN(C)CC1CNC1 Amb21960867 [0,0,0,1,0,0|3,0,0]=4 5361 B8R1.34 CN(C)CC1CNC1 Amb22227647 [0,0,0,1,0,0|3,0,0]=4 5362 B8R1.34 CN(C)CC1CNC1 Amb28364280 [0,0,0,1,0,0|3,0,0]=4 5363 B8R1.34 CN(C)C[C@@H]1CCN1 Amb24459816 [0,0,0,1,0,0|3,0,0]=4 5364 B8R1.34 CN(C)C[C@H]1CCN1 Amb24482986 [0,0,0,1,0,0|3,0,0]=4 5365 B8R1.34 CN(C)NC1CCC1 Amb28315743 [0,0,0,1,0,0|3,0,0]=4 5366 B8R1.34 CN(O)CC1CCC1 Amb33195459 [0,0,0,1,0,0|1,0,1]=3 5367 B8R1.34 CS(=O)CC1CNC1 Amb26615132 [0,0,0,1,0,0|2,0,0]=3 5368 B8R1.34 CS(=O)CC1CNC1 Amb35752883 [0,0,0,1,0,0|2,0,0]=3 5369 B8R1.34 CS(=O)N=C1CCC1 Amb29849337 [0,0,0,1,0,0|2,0,1]=4 5370 B8R1.34 C[C@@H](N)CC1CCC1 Amb25873412 [0,0,0,1,0,0|1,0,1]=3 5371 B8R1.34 C[C@@H](N)CC1CCO1 Amb33744616 [0,0,0,1,0,0|2,0,1]=4 5372 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,0,0,1,0,0|0,0,2]=3 5373 B8R1.34 C[C@H](N)CC1CCC1 Amb24483051 [0,0,0,1,0,0|1,0,1]=3 5374 B8R1.34 C[C@H](N)CC1CCO1 Amb33731442 [0,0,0,1,0,0|2,0,1]=4 5375 B8R1.34 C[C@H](N)CN1CCC1 Amb27757398 [0,0,0,1,0,0|2,0,1]=4 5376 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,0,0,1,0,0|0,0,2]=3 5377 B8R1.34 N=C(N)CC1CCC1 Amb25693457 [0,0,0,1,0,0|2,0,0]=3 5378 B8R1.34 N=C(N)CC1CCC1 Amb28934881 [0,0,0,1,0,0|2,0,0]=3 5379 B8R1.34 N=C(N)CN1CCC1 Amb27650462 [0,0,0,1,0,0|3,0,0]=4 5380 B8R1.34 N=C(N)NC1CCC1 Amb24433597 [0,0,0,1,0,0|3,0,0]=4 5381 B8R1.34 N=C(N)NC1CCC1 Amb33338855 [0,0,0,1,0,0|3,0,0]=4 5382 B8R1.34 NC(=O)CC1CNC1 Amb25890059 [0,0,0,1,0,0|2,0,0]=3 5383 B8R1.34 NC(=O)CC1CNC1 Amb28819957 [0,0,0,1,0,0|2,0,0]=3 5384 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,0,0,1,0,0|2,0,0]=3 5385 B8R1.34 NC(=O)NC1CNC1 Amb27624358 [0,0,0,1,0,0|3,0,0]=4 5386 B8R1.34 NC(=O)NC1CNC1 Amb35745883 [0,0,0,1,0,0|3,0,0]=4 5387 B8R1.34 NC(=O)OC1CCC1 Amb27976028 [0,0,0,1,0,0|2,0,0]=3 5388 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,0,0,1,0,0|3,0,0]=4 5389 B8R1.34 NC(=O)OC1CNC1 Amb33329462 [0,0,0,1,0,0|3,0,0]=4 5390 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,0,0,1,0,0|3,0,0]=4 5391 B8R1.34 NC(=S)CC1CCC1 Amb28456182 [0,0,0,1,0,0|1,1,0]=3 5392 B8R1.34 NC(=S)NC1CCC1 Amb33530393 [0,0,0,1,0,0|2,1,0]=4 5393 B8R1.34 NC(N)=NC1CCC1 Amb33551765 [0,0,0,1,0,0|3,0,0]=4 5394 B8R1.34 NS(=O)CC1CCC1 Amb32720398 [0,0,0,1,0,0|2,0,0]=3 5395 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,0,0,1,0,0|1,0,0]=2 5396 B8R1.34 O=C(Cl)NC1CCC1 Amb35625531 [0,0,0,1,0,0|2,0,0]=3 5397 B8R1.34 O=C(Cl)OC1CCC1 Amb33532032 [0,0,0,1,0,0|2,0,0]=3 5398 B8R1.34 O=C(Cl)OC1COC1 Amb28048913 [0,0,0,1,0,0|3,0,0]=4 5399 B8R1.34 O=C(O)C=C1CCC1 Amb20667794 [0,0,0,1,0,0|1,0,2]=4 5400 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [0,0,0,1,0,0|1,0,0]=2 5401 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [0,0,0,1,0,0|2,0,0]=3 5402 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [0,0,0,1,0,0|2,0,0]=3 5403 B8R1.34 O=C(O)CC1CNC1 Amb21856240 [0,0,0,1,0,0|2,0,0]=3 5404 B8R1.34 O=C(O)CC1CNC1 Amb22057370 [0,0,0,1,0,0|2,0,0]=3 5405 B8R1.34 O=C(O)CC1CNC1 Amb22739043 [0,0,0,1,0,0|2,0,0]=3 5406 B8R1.34 O=C(O)CC1COC1 Amb18199145 [0,0,0,1,0,0|2,0,0]=3 5407 B8R1.34 O=C(O)CC1CSC1 Amb26049907 [0,0,0,1,0,0|2,0,0]=3 5408 B8R1.34 O=C(O)CN1CCC1 Amb28934892 [0,0,0,1,0,0|2,0,0]=3 5409 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [0,0,0,1,0,0|2,0,0]=3 5410 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [0,0,0,1,0,0|2,0,0]=3 5411 B8R1.34 O=C([O-])CC1COC1 Amb32664987 [0,0,0,1,0,0|2,0,0]=3 5412 B8R1.34 O=S(Cl)CC1CCC1 Amb27266105 [0,0,0,1,0,0|2,0,0]=3 5413 B8R1.34 O=S(O)CC1CCC1 Amb27426399 [0,0,0,1,0,0|2,0,0]=3 5414 B8R1.34 O=S([O-])CC1CCC1 Amb28194022 [0,0,0,1,0,0|2,0,0]=3 5415 B8R1.34 O=S([O-])CC1CNC1 Amb32755470 [0,0,0,1,0,0|3,0,0]=4 5416 B8R1.34 O=[N+]([O-])CC1CCC1 Amb33195476 [0,0,0,1,0,0|2,0,0]=3 5417 B8R1.34 O=[N+]([O-])CC1COC1 Amb21961002 [0,0,0,1,0,0|3,0,0]=4 5418 B8R1.34 O=[N+]([O-])CC1CSC1 Amb27836157 [0,0,0,1,0,0|3,0,0]=4 5419 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,0,0,1,0,0|2,0,1]=4 5420 B8R1.35 C=C(C)CNC1CC1 Amb17317871 [0,0,0,1,0,0|2,0,0]=3 5421 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,0,0,1,0,0|2,0,1]=4 5422 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|0,0,0]=1 5423 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [0,0,0,1,0,0|1,0,0]=2 5424 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,0,0,1,0,0|1,0,0]=2 5425 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,0,0,1,0,0|1,0,0]=2 5426 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,0|2,0,0]=3 5427 B8R1.35 CC(=O)NC[C@@H]1CO1 Amb27871512 [0,0,0,1,0,0|2,0,0]=3 5428 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,0|2,0,0]=3 5429 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,0|2,0,0]=3 5430 B8R1.35 CC(=O)OC[C@@H]1CO1 Amb27391694 [0,0,0,1,0,0|2,0,0]=3 5431 B8R1.35 CC(=O)\C=C\C1CC1 Amb32955627 [0,0,0,1,0,0|0,0,2]=3 5432 B8R1.35 CC(Br)CCC1CC1 Amb25067290 [0,0,0,1,0,0|1,0,1]=3 5433 B8R1.35 CC(Br)CNC1CC1 Amb29849358 [0,0,0,1,0,0|2,0,1]=4 5434 B8R1.35 CC(C)=NNC1CC1 Amb27956386 [0,0,0,1,0,0|3,0,0]=4 5435 B8R1.35 CC(C)CCC1CO1 Amb26899468 [0,0,0,1,0,0|2,0,1]=4 5436 B8R1.35 CC(C)CNC1CC1 Amb1117785 [0,0,0,1,0,0|2,0,1]=4 5437 B8R1.35 CC(C)CNC1CC1 Amb6239360 [0,0,0,1,0,0|2,0,1]=4 5438 B8R1.35 CC(C)NCC1CC1 Amb6686815 [0,0,0,1,0,0|2,0,1]=4 5439 B8R1.35 CC(C)NCC1CC1 Amb7969536 [0,0,0,1,0,0|2,0,1]=4 5440 B8R1.35 CC(C)OCC1CC1 Amb27641247 [0,0,0,1,0,0|2,0,1]=4 5441 B8R1.35 CC(C)SCC1CC1 Amb27197439 [0,0,0,1,0,0|2,0,1]=4 5442 B8R1.35 CC(Cl)CNC1CC1 Amb35693290 [0,0,0,1,0,0|2,0,1]=4 5443 B8R1.35 CC(Cl)OCC1CC1 Amb32715979 [0,0,0,1,0,0|2,0,1]=4 5444 B8R1.35 CC(F)CNC1CC1 Amb27633339 [0,0,0,1,0,0|2,0,1]=4 5445 B8R1.35 CC(N)CCC1CC1 Amb18203368 [0,0,0,1,0,0|1,0,1]=3 5446 B8R1.35 CC(N)CSC1CC1 Amb28120342 [0,0,0,1,0,0|2,0,1]=4 5447 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,0,0,1,0,0|0,0,2]=3 5448 B8R1.35 CC(O)CNC1CC1 Amb17138364 [0,0,0,1,0,0|1,0,2]=4 5449 B8R1.35 CN(C)CCC1CO1 Amb24482563 [0,0,0,1,0,0|3,0,0]=4 5450 B8R1.35 CN(C)CC[C@@H]1CO1 Amb33271611 [0,0,0,1,0,0|3,0,0]=4 5451 B8R1.35 CN(C)CC[C@H]1CO1 Amb33271612 [0,0,0,1,0,0|3,0,0]=4 5452 B8R1.35 CN(O)CCC1CC1 Amb33361504 [0,0,0,1,0,0|1,0,1]=3 5453 B8R1.35 CS(=O)CCC1CO1 Amb27837563 [0,0,0,1,0,0|2,0,0]=3 5454 B8R1.35 CS(=O)\N=C\C1CC1 Amb35685198 [0,0,0,1,0,0|2,0,1]=4 5455 B8R1.35 C[C@@H](N)CCC1CC1 Amb25745640 [0,0,0,1,0,0|1,0,1]=3 5456 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,0,0,1,0,0|0,0,2]=3 5457 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,0,0,1,0,0|1,0,2]=4 5458 B8R1.35 C[C@H](N)CCC1CC1 Amb26075601 [0,0,0,1,0,0|1,0,1]=3 5459 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,0,0,1,0,0|0,0,2]=3 5460 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,0,0,1,0,0|1,0,2]=4 5461 B8R1.35 N=C(N)CCC1CC1 Amb26607260 [0,0,0,1,0,0|2,0,0]=3 5462 B8R1.35 N=C(N)NCC1CC1 Amb19748557 [0,0,0,1,0,0|3,0,0]=4 5463 B8R1.35 N=C(N)OCC1CC1 Amb27430108 [0,0,0,1,0,0|3,0,0]=4 5464 B8R1.35 N=C(N)SCC1CC1 Amb24364813 [0,0,0,1,0,0|3,0,0]=4 5465 B8R1.35 N=C(N)SCC1CC1 Amb3428823 [0,0,0,1,0,0|3,0,0]=4 5466 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,0,0,1,0,0|1,0,0]=2 5467 B8R1.35 NC(=O)CCC1CO1 Amb28252693 [0,0,0,1,0,0|2,0,0]=3 5468 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,0]=3 5469 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,0,0,1,0,0|2,0,0]=3 5470 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,0|2,0,0]=3 5471 B8R1.35 NC(=O)OCC1CC1 Amb27668381 [0,0,0,1,0,0|2,0,0]=3 5472 B8R1.35 NC(=O)\C=C/C1CC1 Amb27422387 [0,0,0,1,0,0|1,0,2]=4 5473 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,0,0,1,0,0|1,1,0]=3 5474 B8R1.35 NC(=S)NCC1CC1 Amb2725385 [0,0,0,1,0,0|2,1,0]=4 5475 B8R1.35 NS(=O)CCC1CC1 Amb32720477 [0,0,0,1,0,0|2,0,0]=3 5476 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,0]=2 5477 B8R1.35 O=C(Cl)NCC1CC1 Amb27410108 [0,0,0,1,0,0|2,0,0]=3 5478 B8R1.35 O=C(Cl)OCC1CC1 Amb33528888 [0,0,0,1,0,0|2,0,0]=3 5479 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|1,0,2]=4 5480 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,0,0,1,0,0|1,0,2]=4 5481 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,0,0,1,0,0|1,0,0]=2 5482 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,0,0,1,0,0|2,0,0]=3 5483 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,0,0,1,0,0|2,0,0]=3 5484 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,0,0,1,0,0|2,0,0]=3 5485 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,0,0,1,0,0|2,0,0]=3 5486 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,0,0,1,0,0|2,0,0]=3 5487 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,0,0,1,0,0|1,0,2]=4 5488 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|1,0,2]=4 5489 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,0,0,1,0,0|1,0,2]=4 5490 B8R1.35 O=S(Cl)CCC1CC1 Amb26910502 [0,0,0,1,0,0|2,0,0]=3 5491 B8R1.35 O=S([O-])CCC1CC1 Amb25212503 [0,0,0,1,0,0|2,0,0]=3 5492 B8R1.35 O=[N+]([O-])CCC1CC1 Amb33429105 [0,0,0,1,0,0|2,0,0]=3 5493 B8R1.35 OB(O)CCC1CC1 Amb26515786 [0,0,0,1,0,0|2,0,1]=4 5494 B8R1.36 BrCCCCC1CC1 Amb27220703 [0,0,0,1,0,0|2,0,1]=4 5495 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|1,0,2]=4 5496 B8R1.36 CCCCCC1CC1 Amb27203905 [0,0,0,1,0,0|1,0,1]=3 5497 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|0,0,2]=3 5498 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,0,0,1,0,0|0,0,2]=3 5499 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,1]=4 5500 B8R1.36 CCCCNC1CC1 Amb6892806 [0,0,0,1,0,0|2,0,1]=4 5501 B8R1.36 CCCNCC1CC1 Amb3939845 [0,0,0,1,0,0|2,0,1]=4 5502 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|2,0,1]=4 5503 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|1,0,2]=4 5504 B8R1.36 CCSCCC1CO1 Amb26575735 [0,0,0,1,0,0|1,0,2]=4 5505 B8R1.36 CNCCCC1CC1 Amb26658568 [0,0,0,1,0,0|2,0,1]=4 5506 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|1,0,2]=4 5507 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|1,0,2]=4 5508 B8R1.36 ClCCCCC1CC1 Amb27422896 [0,0,0,1,0,0|2,0,1]=4 5509 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|1,0,2]=4 5510 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|2,0,1]=4 5511 B8R1.36 OCCCC=C1CC1 Amb28400996 [0,0,0,1,0,0|2,0,1]=4 5512 B8R1.36 OCCCCC1CC1 Amb26059385 [0,0,0,1,0,0|2,0,1]=4 5513 B8R1.36 OCCCCC1CO1 Amb28410478 [0,0,0,1,0,0|1,0,2]=4 5514 B8R1.36 OCCCC[C@H]1CO1 Amb28206206 [0,0,0,1,0,0|1,0,2]=4 5515 B8R1.36 SCCCCC1CC1 Amb32788277 [0,0,0,1,0,0|2,0,1]=4 5516 B8R1.43 C#CC1CC1C(=O)O Amb27398329 [0,0,0,1,0,0|1,0,2]=4 5517 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O Amb24076488 [0,0,0,1,0,0|1,0,2]=4 5518 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O Amb28073511 [0,0,0,1,0,0|1,0,2]=4 5519 B8R1.43 C=C(C)C1CC1CN Amb33199508 [0,0,0,1,0,0|2,0,0]=3 5520 B8R1.43 C=C(C)C1CC1CO Amb27197103 [0,0,0,1,0,0|2,0,0]=3 5521 B8R1.43 C=C(C)[C@@H]1C[C@H]1CN Amb33199509 [0,0,0,1,0,0|2,0,0]=3 5522 B8R1.43 C=C(C)[C@H]1C[C@@H]1CO Amb28065860 [0,0,0,1,0,0|2,0,0]=3 5523 B8R1.43 C=CC1CC1C(C)=O Amb28075229 [0,0,0,1,0,0|0,0,2]=3 5524 B8R1.43 C=CC1OC1C(C)=O Amb28133068 [0,0,0,1,0,0|1,0,2]=4 5525 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [0,0,0,1,0,0|1,0,2]=4 5526 B8R1.43 C=C[C@@H]1C[C@H]1C(C)=O Amb27420181 [0,0,0,1,0,0|0,0,2]=3 5527 B8R1.43 CC(=O)C1CC1C=O Amb27809942 [0,0,0,1,0,0|1,0,1]=3 5528 B8R1.43 CC(=O)C1CC1CN Amb33132446 [0,0,0,1,0,0|1,0,0]=2 5529 B8R1.43 CC(=O)C1OC1C=O Amb27429116 [0,0,0,1,0,0|2,0,1]=4 5530 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CN Amb33132469 [0,0,0,1,0,0|1,0,0]=2 5531 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CO Amb28074697 [0,0,0,1,0,0|1,0,0]=2 5532 B8R1.43 CC(=O)[C@@H]1C[C@H]1C#N Amb28062975 [0,0,0,1,0,0|1,0,1]=3 5533 B8R1.43 CC(=O)[C@@H]1C[C@H]1CCl Amb27447264 [0,0,0,1,0,0|1,0,0]=2 5534 B8R1.43 CC(=O)[C@@H]1C[C@H]1CO Amb26561383 [0,0,0,1,0,0|1,0,0]=2 5535 B8R1.43 CC(=O)[C@H]1C[C@H]1C=O Amb27186674 [0,0,0,1,0,0|1,0,1]=3 5536 B8R1.43 CC(C)C1CC1CBr Amb27833214 [0,0,0,1,0,0|2,0,1]=4 5537 B8R1.43 CC(C)C1CC1CN Amb18963621 [0,0,0,1,0,0|2,0,1]=4 5538 B8R1.43 CC(C)C1CC1CN Amb28934813 [0,0,0,1,0,0|2,0,1]=4 5539 B8R1.43 CC(C)C1CC1CO Amb28284489 [0,0,0,1,0,0|2,0,1]=4 5540 B8R1.43 CC(C)[C@@H]1C[C@@H]1CO Amb28400767 [0,0,0,1,0,0|2,0,1]=4 5541 B8R1.43 CC(C)[C@@H]1C[C@H]1CN Amb25233598 [0,0,0,1,0,0|2,0,1]=4 5542 B8R1.43 CC(C)[C@@H]1C[C@H]1CN Amb31148560 [0,0,0,1,0,0|2,0,1]=4 5543 B8R1.43 CC(C)[C@@H]1C[C@H]1CO Amb27211621 [0,0,0,1,0,0|2,0,1]=4 5544 B8R1.43 CC(C)[C@H]1C[C@H]1CN Amb34916253 [0,0,0,1,0,0|2,0,1]=4 5545 B8R1.43 CC(O)C1CC1CO Amb27763793 [0,0,0,1,0,0|1,0,2]=4 5546 B8R1.43 CC(O)[C@@H]1C[C@@H]1CO Amb27215056 [0,0,0,1,0,0|1,0,2]=4 5547 B8R1.43 CCC1CC1C(=O)Cl Amb27778180 [0,0,0,1,0,0|1,0,0]=2 5548 B8R1.43 CCC1CC1C(=O)O Amb18961272 [0,0,0,1,0,0|1,0,0]=2 5549 B8R1.43 CCC1CC1[C@@H](C)O Amb28065226 [0,0,0,1,0,0|0,0,2]=3 5550 B8R1.43 CCC1OC1C(C)=O Amb27206899 [0,0,0,1,0,0|1,0,0]=2 5551 B8R1.43 CCC1OC1C(N)=O Amb27461385 [0,0,0,1,0,0|2,0,0]=3 5552 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [0,0,0,1,0,0|1,0,0]=2 5553 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [0,0,0,1,0,0|2,0,0]=3 5554 B8R1.43 CC[C@@H]1O[C@@H]1C(C)=O Amb27854614 [0,0,0,1,0,0|1,0,0]=2 5555 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [0,0,0,1,0,0|1,0,0]=2 5556 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [0,0,0,1,0,0|2,0,0]=3 5557 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [0,0,0,1,0,0|2,0,0]=3 5558 B8R1.43 CN(C)C1CC1CO Amb27191948 [0,0,0,1,0,0|3,0,0]=4 5559 B8R1.43 COC1CC1C(=O)Cl Amb35717346 [0,0,0,1,0,0|2,0,0]=3 5560 B8R1.43 COC1CC1C(C)N Amb35732192 [0,0,0,1,0,0|2,0,1]=4 5561 B8R1.43 COC1CC1C(N)=O Amb35671242 [0,0,0,1,0,0|2,0,0]=3 5562 B8R1.43 CO[C@@H]1C[C@H]1C(=O)O Amb24514838 [0,0,0,1,0,0|2,0,0]=3 5563 B8R1.43 CO[C@@H]1C[C@H]1C(C)=O Amb27407296 [0,0,0,1,0,0|1,0,0]=2 5564 B8R1.43 CO[C@@H]1C[C@H]1C(C)O Amb27184522 [0,0,0,1,0,0|1,0,2]=4 5565 B8R1.43 C[C@@H](O)[C@H]1C[C@H]1CO Amb27213970 [0,0,0,1,0,0|1,0,2]=4 5566 B8R1.43 N#CC1CC1C(=O)O Amb24183452 [0,0,0,1,0,0|2,0,1]=4 5567 B8R1.43 N#C[C@@H]1C[C@@H]1C(=O)O Amb24183522 [0,0,0,1,0,0|2,0,1]=4 5568 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O Amb24183456 [0,0,0,1,0,0|2,0,1]=4 5569 B8R1.43 N#C[C@H]1C[C@@H]1C(=O)O Amb33805321 [0,0,0,1,0,0|2,0,1]=4 5570 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O Amb25168974 [0,0,0,1,0,0|2,0,1]=4 5571 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,0,0,1,0,0|2,0,0]=3 5572 B8R1.43 NCC1CC1C(=O)O Amb2694938 [0,0,0,1,0,0|2,0,0]=3 5573 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [0,0,0,1,0,0|2,0,0]=3 5574 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [0,0,0,1,0,0|2,0,0]=3 5575 B8R1.43 NC[C@@H]1C[C@@H]1C(N)=O Amb33042252 [0,0,0,1,0,0|2,0,0]=3 5576 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [0,0,0,1,0,0|2,0,0]=3 5577 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [0,0,0,1,0,0|2,0,0]=3 5578 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [0,0,0,1,0,0|2,0,0]=3 5579 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,0,0,1,0,0|3,0,0]=4 5580 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [0,0,0,1,0,0|2,0,0]=3 5581 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [0,0,0,1,0,0|2,0,0]=3 5582 B8R1.43 O=C(O)C1CC1CO Amb25173469 [0,0,0,1,0,0|2,0,0]=3 5583 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [0,0,0,1,0,0|2,0,0]=3 5584 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [0,0,0,1,0,0|2,0,0]=3 5585 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [0,0,0,1,0,0|2,0,0]=3 5586 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [0,0,0,1,0,0|2,0,0]=3 5587 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [0,0,0,1,0,0|2,0,0]=3 5588 B8R1.43 O=C([O-])C1CC1CO Amb33534503 [0,0,0,1,0,0|2,0,0]=3 5589 B8R1.43 O=C([O-])[C@@H]1C[C@H]1CO Amb35789135 [0,0,0,1,0,0|2,0,0]=3 5590 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [0,0,0,1,0,0|2,0,1]=4 5591 B8R1.43 O=[N+]([O-])C1CC1CBr Amb32416244 [0,0,0,1,0,0|3,0,0]=4 5592 B8R1.48 CC1(C)CCC1CN Amb26932779 [0,0,0,1,0,0|2,0,1]=4 5593 B8R1.48 CC1(C)CCC1CO Amb24534050 [0,0,0,1,0,0|2,0,1]=4 5594 B8R1.48 CNC1CCC1(C)C Amb28283753 [0,0,0,1,0,0|2,0,1]=4 5595 B8R1.48 NCC1CCS1(=O)=O Amb28249163 [0,0,0,1,0,0|3,0,0]=4 5596 B8R1.48 NCC1CCS1(=O)=O Amb33329372 [0,0,0,1,0,0|3,0,0]=4 5597 B8R1.48 O=S1(=O)CCC1CO Amb25178802 [0,0,0,1,0,0|3,0,0]=4 5598 B8R1.72 BrC1(Br)CCCCC1 Amb24667698 [0,0,0,1,0,0|2,0,1]=4 5599 B8R1.72 CC1(Br)CCCCC1 Amb24481540 [0,0,0,1,0,0|1,0,1]=3 5600 B8R1.72 CC1(Br)CCOCC1 Amb33333851 [0,0,0,1,0,0|2,0,1]=4 5601 B8R1.72 CC1(C)CCCCC1 Amb8513430 [0,0,0,1,0,0|1,0,1]=3 5602 B8R1.72 CC1(C)CCCCN1 Amb16231536 [0,0,0,1,0,0|2,0,1]=4 5603 B8R1.72 CC1(C)CCCCN1 Amb22754140 [0,0,0,1,0,0|2,0,1]=4 5604 B8R1.72 CC1(C)CCCCO1 Amb28048681 [0,0,0,1,0,0|2,0,1]=4 5605 B8R1.72 CC1(C)CCCNC1 Amb10982554 [0,0,0,1,0,0|2,0,1]=4 5606 B8R1.72 CC1(C)CCCNC1 Amb2785984 [0,0,0,1,0,0|2,0,1]=4 5607 B8R1.72 CC1(C)CCNCC1 Amb13952767 [0,0,0,1,0,0|2,0,1]=4 5608 B8R1.72 CC1(C)CCNCC1 Amb2613006 [0,0,0,1,0,0|2,0,1]=4 5609 B8R1.72 CC1(Cl)CCCCC1 Amb2778969 [0,0,0,1,0,0|1,0,1]=3 5610 B8R1.72 CC1(Cl)CCOCC1 Amb28351883 [0,0,0,1,0,0|2,0,1]=4 5611 B8R1.72 CC1(F)CCCNC1 Amb22886322 [0,0,0,1,0,0|2,0,1]=4 5612 B8R1.72 CC1(F)CCCNC1 Amb23597499 [0,0,0,1,0,0|2,0,1]=4 5613 B8R1.72 CC1(F)CCNCC1 Amb22735452 [0,0,0,1,0,0|2,0,1]=4 5614 B8R1.72 CC1(F)CCNCC1 Amb23597817 [0,0,0,1,0,0|2,0,1]=4 5615 B8R1.72 CC1(I)CCCCC1 Amb27789629 [0,0,0,1,0,0|1,0,1]=3 5616 B8R1.72 CC1(N)CCCCC1 Amb10609050 [0,0,0,1,0,0|1,0,1]=3 5617 B8R1.72 CC1(N)CCCCC1 Amb6740264 [0,0,0,1,0,0|1,0,1]=3 5618 B8R1.72 CC1(N)CCCOC1 Amb18833019 [0,0,0,1,0,0|2,0,1]=4 5619 B8R1.72 CC1(N)CCCOC1 Amb30585103 [0,0,0,1,0,0|2,0,1]=4 5620 B8R1.72 CC1(N)CCNCC1 Amb21856985 [0,0,0,1,0,0|2,0,1]=4 5621 B8R1.72 CC1(N)CCNCC1 Amb21857713 [0,0,0,1,0,0|2,0,1]=4 5622 B8R1.72 CC1(N)CCOCC1 Amb18833018 [0,0,0,1,0,0|2,0,1]=4 5623 B8R1.72 CC1(N)CCOCC1 Amb19958199 [0,0,0,1,0,0|2,0,1]=4 5624 B8R1.72 CC1(N)CCSCC1 Amb18199761 [0,0,0,1,0,0|2,0,1]=4 5625 B8R1.72 CC1(O)CCCCC1 Amb8513249 [0,0,0,1,0,0|0,0,2]=3 5626 B8R1.72 CC1(O)CCCNC1 Amb10607739 [0,0,0,1,0,0|1,0,2]=4 5627 B8R1.72 CC1(O)CCCNC1 Amb22491963 [0,0,0,1,0,0|1,0,2]=4 5628 B8R1.72 CC1(O)CCCOC1 Amb20668932 [0,0,0,1,0,0|1,0,2]=4 5629 B8R1.72 CC1(O)CCCSC1 Amb29857705 [0,0,0,1,0,0|1,0,2]=4 5630 B8R1.72 CC1(O)CCNCC1 Amb18943983 [0,0,0,1,0,0|1,0,2]=4 5631 B8R1.72 CC1(O)CCNCC1 Amb19515938 [0,0,0,1,0,0|1,0,2]=4 5632 B8R1.72 CC1(O)CCOCC1 Amb19957780 [0,0,0,1,0,0|1,0,2]=4 5633 B8R1.72 CC1(O)CCSCC1 Amb24672466 [0,0,0,1,0,0|1,0,2]=4 5634 B8R1.72 CC1(S)CCCCC1 Amb33417901 [0,0,0,1,0,0|0,1,1]=3 5635 B8R1.72 CC1(S)CCOCC1 Amb33415125 [0,0,0,1,0,0|1,1,1]=4 5636 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,0,0,1,0,0|2,0,0]=3 5637 B8R1.72 CP1(=O)CCNCC1 Amb32675162 [0,0,0,1,0,0|2,0,0]=3 5638 B8R1.72 C[C@]1(O)CCCNC1 Amb27470163 [0,0,0,1,0,0|1,0,2]=4 5639 B8R1.72 C[N+]1(C)CCCCC1 Amb15692276 [0,0,0,1,0,0|2,0,0]=3 5640 B8R1.72 C[N+]1(C)CCNCC1 Amb1625919 [0,0,0,1,0,0|3,0,0]=4 5641 B8R1.72 C[N+]1(C)CCOCC1 Amb24117820 [0,0,0,1,0,0|3,0,0]=4 5642 B8R1.72 C[N+]1([O-])CCCCC1 Amb27966763 [0,0,0,1,0,0|1,0,1]=3 5643 B8R1.72 C[N+]1([O-])CCOCC1 Amb2778780 [0,0,0,1,0,0|2,0,1]=4 5644 B8R1.72 C[N+]1([O-])CCOCC1 Amb6298789 [0,0,0,1,0,0|2,0,1]=4 5645 B8R1.72 C[Si]1(C)CCCCC1 Amb19893758 [0,0,0,1,0,0|1,1,0]=3 5646 B8R1.72 C[Si]1(C)CCCNC1 Amb27771975 [0,0,0,1,0,0|2,1,0]=4 5647 B8R1.72 C[Si]1(C)CCCNC1 Amb33803733 [0,0,0,1,0,0|2,1,0]=4 5648 B8R1.72 C[Si]1(C)CCNCC1 Amb24117322 [0,0,0,1,0,0|2,1,0]=4 5649 B8R1.72 C[Si]1(C)CCNCC1 Amb24183363 [0,0,0,1,0,0|2,1,0]=4 5650 B8R1.72 C[Si]1(Cl)CCCCC1 Amb28253147 [0,0,0,1,0,0|1,1,0]=3 5651 B8R1.72 Cl[Si]1(Cl)CCCCC1 Amb22730764 [0,0,0,1,0,0|2,1,0]=4 5652 B8R1.72 FC1(Cl)CCCCC1 Amb28288375 [0,0,0,1,0,0|2,0,1]=4 5653 B8R1.72 FC1(F)CCCCC1 Amb10838339 [0,0,0,1,0,0|2,0,1]=4 5654 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,0,0,1,0,0|2,0,0]=3 5655 B8R1.72 N=S1(=O)CCNCC1 Amb27652837 [0,0,0,1,0,0|3,0,0]=4 5656 B8R1.72 N=S1(=O)CCNCC1 Amb31308374 [0,0,0,1,0,0|3,0,0]=4 5657 B8R1.72 N=S1(=O)CCOCC1 Amb33543895 [0,0,0,1,0,0|3,0,0]=4 5658 B8R1.72 NC1(F)CCCCC1 Amb27478657 [0,0,0,1,0,0|2,0,1]=4 5659 B8R1.72 O=P1(O)CCNCC1 Amb28398023 [0,0,0,1,0,0|3,0,0]=4 5660 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,0,0,1,0,0|3,0,0]=4 5661 B8R1.72 O=S1(=O)CCCCO1 Amb6608747 [0,0,0,1,0,0|3,0,0]=4 5662 B8R1.72 O=S1(=O)CCCNC1 Amb27838312 [0,0,0,1,0,0|3,0,0]=4 5663 B8R1.72 O=S1(=O)CCCNC1 Amb32670599 [0,0,0,1,0,0|3,0,0]=4 5664 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,0,0,1,0,0|3,0,0]=4 5665 B8R1.72 O=S1(=O)CCNCC1 Amb6307180 [0,0,0,1,0,0|3,0,0]=4 5666 B8R1.72 O=S1(=O)CCOCC1 Amb2779436 [0,0,0,1,0,0|3,0,0]=4 5667 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|2,0,0]=4 5668 B5R0.1 C=C(C)CCBr Amb21857866 [2,0,0,0,0,0|2,0,0]=4 5669 B5R0.1 C=C(C)CCC Amb8513259 [2,0,0,0,0,0|1,0,0]=3 5670 B5R0.1 C=C(C)CCCl Amb27810807 [2,0,0,0,0,0|2,0,0]=4 5671 B5R0.1 C=C(C)CCI Amb26649317 [2,0,0,0,0,0|2,0,0]=4 5672 B5R0.1 C=C(C)CCN Amb17673481 [2,0,0,0,0,0|2,0,0]=4 5673 B5R0.1 C=C(C)CCN Amb33543001 [2,0,0,0,0,0|2,0,0]=4 5674 B5R0.1 C=C(C)CCO Amb34916534 [2,0,0,0,0,0|2,0,0]=4 5675 B5R0.1 C=C(C)CCO Amb8513522 [2,0,0,0,0,0|2,0,0]=4 5676 B5R0.1 C=C(C)CCS Amb25887673 [2,0,0,0,0,0|2,0,0]=4 5677 B5R0.1 C=C(C)CNC Amb30625043 [2,0,0,0,0,0|2,0,0]=4 5678 B5R0.1 C=C(C)CNC Amb3941317 [2,0,0,0,0,0|2,0,0]=4 5679 B5R0.1 C=C(C)COC Amb26589016 [2,0,0,0,0,0|2,0,0]=4 5680 B5R0.1 C=C(C)CSC Amb20671946 [2,0,0,0,0,0|2,0,0]=4 5681 B5R0.1 C=C(C)OCC Amb8393241 [2,0,0,0,0,0|2,0,0]=4 5682 B5R0.1 C=CCC(C)=O Amb8396482 [2,0,0,0,0,0|0,0,2]=4 5683 B5R0.1 CC#CC(C)=O Amb17593016 [2,0,0,0,0,0|0,0,2]=4 5684 B5R0.1 CC(=O)CC#N Amb1102132 [2,0,0,0,0,0|1,0,1]=4 5685 B5R0.1 CC(=O)CC=N Amb28285098 [2,0,0,0,0,0|1,0,1]=4 5686 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|1,0,0]=3 5687 B5R0.1 CC(=O)CCCl Amb2720823 [2,0,0,0,0,0|1,0,0]=3 5688 B5R0.1 CC(=O)CCF Amb26427773 [2,0,0,0,0,0|1,0,0]=3 5689 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|1,0,0]=3 5690 B5R0.1 CC(=O)CCN Amb33544540 [2,0,0,0,0,0|1,0,0]=3 5691 B5R0.1 CC(=O)CCO Amb836357 [2,0,0,0,0,0|1,0,0]=3 5692 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [2,0,0,0,0,0|1,0,0]=3 5693 B5R0.1 CC(=O)CNO Amb28049954 [2,0,0,0,0,0|2,0,0]=4 5694 B5R0.1 CC(=O)CSN Amb28430346 [2,0,0,0,0,0|2,0,0]=4 5695 B5R0.1 CC(=O)NCO Amb8516057 [2,0,0,0,0,0|2,0,0]=4 5696 B5R0.1 CC(=O)OCBr Amb3941481 [2,0,0,0,0,0|2,0,0]=4 5697 B5R0.1 CC(=O)OCCl Amb33542858 [2,0,0,0,0,0|2,0,0]=4 5698 B5R0.1 CC(=O)OCI Amb25226851 [2,0,0,0,0,0|2,0,0]=4 5699 B5R0.1 CC(=O)SCBr Amb25349900 [2,0,0,0,0,0|2,0,0]=4 5700 B5R0.1 CC(=O)SCI Amb33339258 [2,0,0,0,0,0|2,0,0]=4 5701 B5R0.1 CC(=O)SCO Amb27255261 [2,0,0,0,0,0|2,0,0]=4 5702 B5R0.1 CCC=C(C)C Amb22336412 [2,0,0,0,0,0|1,0,1]=4 5703 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 5704 B5R0.1 CCCC(=N)N Amb2695914 [2,0,0,0,0,0|2,0,0]=4 5705 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 5706 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,0]=3 5707 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|1,0,0]=3 5708 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|1,0,0]=3 5709 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 5710 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|0,0,0]=2 5711 B5R0.1 CCCC(C)Br Amb3940201 [2,0,0,0,0,0|1,0,1]=4 5712 B5R0.1 CCCC(C)Cl Amb4018346 [2,0,0,0,0,0|1,0,1]=4 5713 B5R0.1 CCCC(C)I Amb17939400 [2,0,0,0,0,0|1,0,1]=4 5714 B5R0.1 CCCC(C)N Amb10609075 [2,0,0,0,0,0|1,0,1]=4 5715 B5R0.1 CCCC(C)N Amb3941259 [2,0,0,0,0,0|1,0,1]=4 5716 B5R0.1 CCCC(C)O Amb4605839 [2,0,0,0,0,0|0,0,2]=4 5717 B5R0.1 CCCC(C)S Amb7784731 [2,0,0,0,0,0|0,1,1]=4 5718 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,0]=3 5719 B5R0.1 CCCC(N)=S Amb6245403 [2,0,0,0,0,0|1,1,0]=4 5720 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [2,0,0,0,0,0|2,0,0]=4 5721 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|1,0,1]=4 5722 B5R0.1 CCCN(C)C Amb22733186 [2,0,0,0,0,0|2,0,0]=4 5723 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|1,0,1]=4 5724 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 5725 B5R0.1 CCCS(=O)[O-] Amb19929119 [2,0,0,0,0,0|2,0,0]=4 5726 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 5727 B5R0.1 CCC[C@@H](C)N Amb22898992 [2,0,0,0,0,0|1,0,1]=4 5728 B5R0.1 CCC[C@@H](C)N Amb23439500 [2,0,0,0,0,0|1,0,1]=4 5729 B5R0.1 CCC[C@@H](C)O Amb8628178 [2,0,0,0,0,0|0,0,2]=4 5730 B5R0.1 CCC[C@H](C)Br Amb27650565 [2,0,0,0,0,0|1,0,1]=4 5731 B5R0.1 CCC[C@H](C)N Amb21618754 [2,0,0,0,0,0|1,0,1]=4 5732 B5R0.1 CCC[C@H](C)N Amb31204590 [2,0,0,0,0,0|1,0,1]=4 5733 B5R0.1 CCC[C@H](C)O Amb8389338 [2,0,0,0,0,0|0,0,2]=4 5734 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [2,0,0,0,0,0|2,0,0]=4 5735 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 5736 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|1,0,0]=3 5737 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|2,0,0]=4 5738 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 5739 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|2,0,0]=4 5740 B5R0.1 CCOC(C)=N Amb8394853 [2,0,0,0,0,0|2,0,0]=4 5741 B5R0.1 CCOC(C)=N Amb8514666 [2,0,0,0,0,0|2,0,0]=4 5742 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|1,0,0]=3 5743 B5R0.1 CCOC(C)=S Amb22047276 [2,0,0,0,0,0|1,1,0]=4 5744 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 5745 B5R0.1 CCSC(=O)Cl Amb8516064 [2,0,0,0,0,0|2,0,0]=4 5746 B5R0.1 CCSC(C)=S Amb8394854 [2,0,0,0,0,0|1,1,0]=4 5747 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|2,0,0]=4 5748 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|2,0,0]=4 5749 B5R0.1 CNCC(=O)[O-] Amb20246714 [2,0,0,0,0,0|2,0,0]=4 5750 B5R0.1 CNCC(C)=O Amb17621974 [2,0,0,0,0,0|1,0,0]=3 5751 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|1,0,0]=3 5752 B5R0.1 CNCC(N)=O Amb19134307 [2,0,0,0,0,0|2,0,0]=4 5753 B5R0.1 CNCC(N)=O Amb3940074 [2,0,0,0,0,0|2,0,0]=4 5754 B5R0.1 CNCC(N)=O Amb9151172 [2,0,0,0,0,0|2,0,0]=4 5755 B5R0.1 COCC(=O)Cl Amb3939326 [2,0,0,0,0,0|2,0,0]=4 5756 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|2,0,0]=4 5757 B5R0.1 COCC(C)=O Amb8513767 [2,0,0,0,0,0|1,0,0]=3 5758 B5R0.1 COCC(N)=O Amb1153776 [2,0,0,0,0,0|2,0,0]=4 5759 B5R0.1 CONC(C)=O Amb25046114 [2,0,0,0,0,0|2,0,0]=4 5760 B5R0.1 CS(=O)CCBr Amb28049280 [2,0,0,0,0,0|2,0,0]=4 5761 B5R0.1 CS(=O)CCCl Amb24116979 [2,0,0,0,0,0|2,0,0]=4 5762 B5R0.1 CS(=O)CCI Amb27752977 [2,0,0,0,0,0|2,0,0]=4 5763 B5R0.1 CS(=O)CCN Amb2786559 [2,0,0,0,0,0|2,0,0]=4 5764 B5R0.1 CS(=O)CCN Amb33543191 [2,0,0,0,0,0|2,0,0]=4 5765 B5R0.1 CS(=O)CCO Amb28075364 [2,0,0,0,0,0|2,0,0]=4 5766 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 5767 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|2,0,0]=4 5768 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|1,0,0]=3 5769 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 5770 B5R0.1 CSCS(C)=O Amb22045140 [2,0,0,0,0,0|2,0,0]=4 5771 B5R0.1 CSNC(C)=O Amb22500292 [2,0,0,0,0,0|2,0,0]=4 5772 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [2,0,0,0,0,0|2,0,0]=4 5773 B5R0.1 C\C=C/C(C)=O Amb28351405 [2,0,0,0,0,0|0,0,2]=4 5774 B5R0.1 C\C=C\C(C)=O Amb33941980 [2,0,0,0,0,0|0,0,2]=4 5775 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 5776 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 5777 B5R0.1 NC(=O)CCF Amb28289353 [2,0,0,0,0,0|2,0,0]=4 5778 B5R0.1 NC(=O)CCI Amb27966778 [2,0,0,0,0,0|2,0,0]=4 5779 B5R0.1 NC(=O)CCO Amb9421407 [2,0,0,0,0,0|2,0,0]=4 5780 B5R0.1 NC(=O)CCS Amb27154802 [2,0,0,0,0,0|2,0,0]=4 5781 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 5782 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|2,0,0]=4 5783 B5R0.1 NCCC(=O)[O-] Amb28991330 [2,0,0,0,0,0|2,0,0]=4 5784 B5R0.1 NCCC(N)=O Amb1137251 [2,0,0,0,0,0|2,0,0]=4 5785 B5R0.1 NCCC(N)=O Amb9147573 [2,0,0,0,0,0|2,0,0]=4 5786 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 5787 B5R0.1 O=C(Cl)CCBr Amb3941484 [2,0,0,0,0,0|2,0,0]=4 5788 B5R0.1 O=C(Cl)CCCl Amb3939313 [2,0,0,0,0,0|2,0,0]=4 5789 B5R0.1 O=C(Cl)CCF Amb27148631 [2,0,0,0,0,0|2,0,0]=4 5790 B5R0.1 O=C(Cl)CCI Amb28454579 [2,0,0,0,0,0|2,0,0]=4 5791 B5R0.1 O=C(Cl)CCO Amb27270014 [2,0,0,0,0,0|2,0,0]=4 5792 B5R0.1 O=C(F)CCCl Amb27257545 [2,0,0,0,0,0|2,0,0]=4 5793 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|2,0,0]=4 5794 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|2,0,0]=4 5795 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|2,0,0]=4 5796 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|2,0,0]=4 5797 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|2,0,0]=4 5798 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|2,0,0]=4 5799 B5R0.1 O=C(S)CCCl Amb27461454 [2,0,0,0,0,0|2,0,0]=4 5800 B5R0.1 O=C([O-])CCO Amb22055495 [2,0,0,0,0,0|2,0,0]=4 5801 B5R0.2 BrCCCCBr Amb2686718 [2,0,0,0,0,0|2,0,0]=4 5802 B5R0.2 BrCCCCI Amb25861429 [2,0,0,0,0,0|2,0,0]=4 5803 B5R0.2 C#CCCC=O Amb28049678 [2,0,0,0,0,0|0,0,2]=4 5804 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|0,0,2]=4 5805 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|1,0,1]=4 5806 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|0,0,2]=4 5807 B5R0.2 C=CCCCBr Amb3940219 [2,0,0,0,0,0|1,0,1]=4 5808 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|0,0,1]=3 5809 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|1,0,1]=4 5810 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|1,0,1]=4 5811 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|1,0,1]=4 5812 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|1,0,1]=4 5813 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|1,0,1]=4 5814 B5R0.2 C=CCCCO Amb8513439 [2,0,0,0,0,0|1,0,1]=4 5815 B5R0.2 C=CCCC[CH2-] Amb32644015 [2,0,0,0,0,0|0,0,2]=4 5816 B5R0.2 C=CCCNC Amb18993048 [2,0,0,0,0,0|1,0,1]=4 5817 B5R0.2 C=CCCNC Amb33553635 [2,0,0,0,0,0|1,0,1]=4 5818 B5R0.2 C=CCCOC Amb28065418 [2,0,0,0,0,0|1,0,1]=4 5819 B5R0.2 C=CCCSC Amb24431590 [2,0,0,0,0,0|1,0,1]=4 5820 B5R0.2 C=CCNCC Amb13951161 [2,0,0,0,0,0|1,0,1]=4 5821 B5R0.2 C=CCNCC Amb6683951 [2,0,0,0,0,0|1,0,1]=4 5822 B5R0.2 C=CCOCC Amb2684299 [2,0,0,0,0,0|1,0,1]=4 5823 B5R0.2 C=CCSCC Amb6366495 [2,0,0,0,0,0|1,0,1]=4 5824 B5R0.2 C=CNCCC Amb27461242 [2,0,0,0,0,0|1,0,1]=4 5825 B5R0.2 C=COCCC Amb17940706 [2,0,0,0,0,0|1,0,1]=4 5826 B5R0.2 C=NCCCCl Amb28346586 [2,0,0,0,0,0|2,0,0]=4 5827 B5R0.2 CC#CCC=O Amb27850282 [2,0,0,0,0,0|0,0,2]=4 5828 B5R0.2 CC#CCCC Amb8515369 [2,0,0,0,0,0|0,0,2]=4 5829 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 5830 B5R0.2 CCC#CCC Amb8515372 [2,0,0,0,0,0|0,0,2]=4 5831 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 5832 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,0]=2 5833 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,0]=3 5834 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 5835 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,0]=3 5836 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 5837 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,0]=3 5838 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,0]=3 5839 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|0,0,1]=3 5840 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|0,1,0]=3 5841 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 5842 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|1,0,0]=3 5843 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 5844 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 5845 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 5846 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,1]=4 5847 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|1,0,1]=4 5848 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 5849 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|2,0,0]=4 5850 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|1,0,0]=3 5851 B5R0.2 CCCN=C=O Amb3939331 [2,0,0,0,0,0|1,0,1]=4 5852 B5R0.2 CCCNC=S Amb27754027 [2,0,0,0,0,0|1,1,0]=4 5853 B5R0.2 CCCNCC Amb3939843 [2,0,0,0,0,0|1,0,0]=3 5854 B5R0.2 CCCNNC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 5855 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|2,0,0]=4 5856 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|1,0,0]=3 5857 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|2,0,0]=4 5858 B5R0.2 CCCSCC Amb22168047 [2,0,0,0,0,0|1,0,0]=3 5859 B5R0.2 CCCSCCl Amb28146719 [2,0,0,0,0,0|2,0,0]=4 5860 B5R0.2 CCC\C=C\Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 5861 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 5862 B5R0.2 CCC\C=C\N Amb27217273 [2,0,0,0,0,0|1,0,1]=4 5863 B5R0.2 CCNCCBr Amb27950012 [2,0,0,0,0,0|2,0,0]=4 5864 B5R0.2 CCNCCCl Amb17334050 [2,0,0,0,0,0|2,0,0]=4 5865 B5R0.2 CCNCCCl Amb33869917 [2,0,0,0,0,0|2,0,0]=4 5866 B5R0.2 CCNCCF Amb27858242 [2,0,0,0,0,0|2,0,0]=4 5867 B5R0.2 CCNCCI Amb27856942 [2,0,0,0,0,0|2,0,0]=4 5868 B5R0.2 CCNCCN Amb6297789 [2,0,0,0,0,0|2,0,0]=4 5869 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 5870 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|1,0,1]=4 5871 B5R0.2 CCNCCP Amb27188285 [2,0,0,0,0,0|2,0,0]=4 5872 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 5873 B5R0.2 CCNOCC Amb26852166 [2,0,0,0,0,0|2,0,0]=4 5874 B5R0.2 CCNOCC Amb32655926 [2,0,0,0,0,0|2,0,0]=4 5875 B5R0.2 CCOCCBr Amb1158671 [2,0,0,0,0,0|2,0,0]=4 5876 B5R0.2 CCOCCCl Amb8390350 [2,0,0,0,0,0|2,0,0]=4 5877 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|2,0,0]=4 5878 B5R0.2 CCOCCN Amb1130918 [2,0,0,0,0,0|2,0,0]=4 5879 B5R0.2 CCOCCN Amb29844456 [2,0,0,0,0,0|2,0,0]=4 5880 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|1,0,1]=4 5881 B5R0.2 CCOCCS Amb9316644 [2,0,0,0,0,0|1,1,0]=4 5882 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 5883 B5R0.2 CCSCCBr Amb2685158 [2,0,0,0,0,0|2,0,0]=4 5884 B5R0.2 CCSCCCl Amb3940261 [2,0,0,0,0,0|2,0,0]=4 5885 B5R0.2 CCSCCN Amb2687948 [2,0,0,0,0,0|2,0,0]=4 5886 B5R0.2 CCSCCN Amb9825826 [2,0,0,0,0,0|2,0,0]=4 5887 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|1,0,1]=4 5888 B5R0.2 CCSCCS Amb27167723 [2,0,0,0,0,0|1,1,0]=4 5889 B5R0.2 CCSSCC Amb8516624 [2,0,0,0,0,0|2,0,0]=4 5890 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|2,0,0]=4 5891 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|0,0,2]=4 5892 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,2]=4 5893 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|0,0,2]=4 5894 B5R0.2 CC\N=N/CC Amb27851864 [2,0,0,0,0,0|2,0,0]=4 5895 B5R0.2 CC\N=N\CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 5896 B5R0.2 CNCCCBr Amb28291325 [2,0,0,0,0,0|2,0,0]=4 5897 B5R0.2 CNCCCBr Amb33473632 [2,0,0,0,0,0|2,0,0]=4 5898 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 5899 B5R0.2 CNCCCCl Amb3941419 [2,0,0,0,0,0|2,0,0]=4 5900 B5R0.2 CNCCCF Amb27405698 [2,0,0,0,0,0|2,0,0]=4 5901 B5R0.2 CNCCCN Amb2698065 [2,0,0,0,0,0|2,0,0]=4 5902 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|1,0,1]=4 5903 B5R0.2 CNCCNC Amb4037059 [2,0,0,0,0,0|2,0,0]=4 5904 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|2,0,0]=4 5905 B5R0.2 CNCCOC Amb2689126 [2,0,0,0,0,0|2,0,0]=4 5906 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|2,0,0]=4 5907 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|2,0,0]=4 5908 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 5909 B5R0.2 COCCCBr Amb8828205 [2,0,0,0,0,0|2,0,0]=4 5910 B5R0.2 COCCCCl Amb6255994 [2,0,0,0,0,0|2,0,0]=4 5911 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|2,0,0]=4 5912 B5R0.2 COCCCI Amb33546474 [2,0,0,0,0,0|2,0,0]=4 5913 B5R0.2 COCCCN Amb3939346 [2,0,0,0,0,0|2,0,0]=4 5914 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|1,0,1]=4 5915 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,1,0]=4 5916 B5R0.2 COCCOC Amb6741456 [2,0,0,0,0,0|2,0,0]=4 5917 B5R0.2 COCCSC Amb4020919 [2,0,0,0,0,0|2,0,0]=4 5918 B5R0.2 COCNC=O Amb28049834 [2,0,0,0,0,0|2,0,0]=4 5919 B5R0.2 CSCCC=O Amb3939952 [2,0,0,0,0,0|1,0,0]=3 5920 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|2,0,0]=4 5921 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|2,0,0]=4 5922 B5R0.2 CSCCCN Amb33801570 [2,0,0,0,0,0|2,0,0]=4 5923 B5R0.2 CSCCCN Amb6718923 [2,0,0,0,0,0|2,0,0]=4 5924 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|1,0,1]=4 5925 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 5926 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|2,0,0]=4 5927 B5R0.2 C[SiH2]CCCN Amb28049027 [2,0,0,0,0,0|1,1,0]=4 5928 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|0,0,1]=3 5929 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|1,0,1]=4 5930 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,2]=4 5931 B5R0.2 C\C=C\CCBr Amb32667161 [2,0,0,0,0,0|1,0,1]=4 5932 B5R0.2 C\C=C\CCCl Amb26978891 [2,0,0,0,0,0|1,0,1]=4 5933 B5R0.2 C\C=C\CCN Amb19374038 [2,0,0,0,0,0|1,0,1]=4 5934 B5R0.2 C\C=C\CCN Amb33038294 [2,0,0,0,0,0|1,0,1]=4 5935 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|1,0,1]=4 5936 B5R0.2 C\C=C\CNC Amb28049814 [2,0,0,0,0,0|1,0,1]=4 5937 B5R0.2 C\C=C\OCC Amb8516635 [2,0,0,0,0,0|1,0,1]=4 5938 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|1,0,0]=3 5939 B5R0.2 C\C=N\CCN Amb27837883 [2,0,0,0,0,0|2,0,0]=4 5940 B5R0.2 ClCCCCBr Amb8391065 [2,0,0,0,0,0|2,0,0]=4 5941 B5R0.2 ClCCCCCl Amb6608890 [2,0,0,0,0,0|2,0,0]=4 5942 B5R0.2 ClCCCCI Amb8517518 [2,0,0,0,0,0|2,0,0]=4 5943 B5R0.2 FCCCCBr Amb2685210 [2,0,0,0,0,0|2,0,0]=4 5944 B5R0.2 FCCCCCl Amb27655616 [2,0,0,0,0,0|2,0,0]=4 5945 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 5946 B5R0.2 FCCCCI Amb28283837 [2,0,0,0,0,0|2,0,0]=4 5947 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 5948 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 5949 B5R0.2 N#CCCC=O Amb3941009 [2,0,0,0,0,0|1,0,1]=4 5950 B5R0.2 NCCCC=O Amb26851044 [2,0,0,0,0,0|1,0,0]=3 5951 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 5952 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 5953 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 5954 B5R0.2 NCCCCF Amb26017241 [2,0,0,0,0,0|2,0,0]=4 5955 B5R0.2 NCCCCF Amb28555328 [2,0,0,0,0,0|2,0,0]=4 5956 B5R0.2 NCCCCI Amb27837961 [2,0,0,0,0,0|2,0,0]=4 5957 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 5958 B5R0.2 NCCCCN Amb6608640 [2,0,0,0,0,0|2,0,0]=4 5959 B5R0.2 NCCCCN Amb8514498 [2,0,0,0,0,0|2,0,0]=4 5960 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|1,0,1]=4 5961 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 5962 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 5963 B5R0.2 NCCCN=O Amb28049442 [2,0,0,0,0,0|2,0,0]=4 5964 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 5965 B5R0.2 O=CCCC=O Amb8395090 [2,0,0,0,0,0|1,0,1]=4 5966 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 5967 B5R0.2 O=CCCCCl Amb8395190 [2,0,0,0,0,0|1,0,0]=3 5968 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 5969 B5R0.2 O=CCCCI Amb27249641 [2,0,0,0,0,0|1,0,0]=3 5970 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,0]=3 5971 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 5972 B5R0.2 O=CNCCF Amb28205988 [2,0,0,0,0,0|2,0,0]=4 5973 B5R0.2 O=COCCBr Amb27816149 [2,0,0,0,0,0|2,0,0]=4 5974 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|2,0,0]=4 5975 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|1,0,1]=4 5976 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 5977 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 5978 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|1,0,1]=4 5979 B5R0.2 SCCCCS Amb8513069 [2,0,0,0,0,0|1,1,0]=4 5980 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 5981 B7R0.2 C=C(C)CC(=O)CC Amb27600284 [1,1,0,0,0,0|1,0,1]=4 5982 B7R0.2 C=C(C)CC(C)CBr Amb32688065 [1,1,0,0,0,0|2,0,0]=4 5983 B7R0.2 C=C(C)CC(C)CC Amb22228340 [1,1,0,0,0,0|1,0,0]=3 5984 B7R0.2 C=C(C)CC(C)CCl Amb32688064 [1,1,0,0,0,0|2,0,0]=4 5985 B7R0.2 C=C(C)CC(F)CO Amb28079110 [1,1,0,0,0,0|2,0,0]=4 5986 B7R0.2 C=C(C)CC(N)CO Amb24665584 [1,1,0,0,0,0|2,0,0]=4 5987 B7R0.2 C=C(C)CC(O)CN Amb33199504 [1,1,0,0,0,0|2,0,0]=4 5988 B7R0.2 C=C(C)C[C@H](N)CO Amb27633094 [1,1,0,0,0,0|2,0,0]=4 5989 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|1,0,1]=4 5990 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [1,1,0,0,0,0|1,0,1]=4 5991 B7R0.2 C=C(CC)OC(C)=O Amb25202254 [1,1,0,0,0,0|1,0,1]=4 5992 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [1,1,0,0,0,0|0,0,2]=4 5993 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [1,1,0,0,0,0|1,0,1]=4 5994 B7R0.2 CC(=O)CC(C)C#N Amb18124227 [1,1,0,0,0,0|1,0,1]=4 5995 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [1,1,0,0,0,0|1,0,0]=3 5996 B7R0.2 CC(=O)CC(C)CN Amb18251072 [1,1,0,0,0,0|1,0,0]=3 5997 B7R0.2 CC(=O)CC(N)CO Amb27240210 [1,1,0,0,0,0|1,0,0]=3 5998 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [1,1,0,0,0,0|1,0,0]=3 5999 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,1,0,0,0,0|1,0,1]=4 6000 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [1,1,0,0,0,0|1,0,0]=3 6001 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 6002 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [1,1,0,0,0,0|1,0,0]=3 6003 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [1,1,0,0,0,0|2,0,0]=4 6004 B7R0.2 CC(=O)NC(C)CO Amb9276356 [1,1,0,0,0,0|2,0,0]=4 6005 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [1,1,0,0,0,0|2,0,0]=4 6006 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [1,1,0,0,0,0|2,0,0]=4 6007 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [1,1,0,0,0,0|2,0,0]=4 6008 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [1,1,0,0,0,0|2,0,0]=4 6009 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [1,1,0,0,0,0|2,0,0]=4 6010 B7R0.2 CC(=O)OC(C)CN Amb27838841 [1,1,0,0,0,0|2,0,0]=4 6011 B7R0.2 CC(=O)OC(F)CBr Amb28239801 [1,1,0,0,0,0|2,0,0]=4 6012 B7R0.2 CC(=O)OC(F)CCl Amb27473993 [1,1,0,0,0,0|2,0,0]=4 6013 B7R0.2 CC(=O)OC(O)CN Amb27839430 [1,1,0,0,0,0|2,0,0]=4 6014 B7R0.2 CC(=O)SC(C)CBr Amb27983834 [1,1,0,0,0,0|2,0,0]=4 6015 B7R0.2 CC(=O)SC(C)CCl Amb27253145 [1,1,0,0,0,0|2,0,0]=4 6016 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [1,1,0,0,0,0|2,0,0]=4 6017 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,1,0,0,0,0|2,0,0]=4 6018 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,1,0,0,0,0|2,0,0]=4 6019 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,1,0,0,0,0|2,0,0]=4 6020 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,1,0,0,0,0|2,0,0]=4 6021 B7R0.2 CC(CN)CC(N)=O Amb18641899 [1,1,0,0,0,0|2,0,0]=4 6022 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,1,0,0,0,0|2,0,0]=4 6023 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [1,1,0,0,0,0|2,0,0]=4 6024 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|1,0,1]=4 6025 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [1,1,0,0,0,0|0,0,1]=3 6026 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [1,1,0,0,0,0|1,0,1]=4 6027 B7R0.2 CCC(=O)CS(C)=O Amb27464042 [1,1,0,0,0,0|1,0,1]=4 6028 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [1,1,0,0,0,0|1,0,1]=4 6029 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [1,1,0,0,0,0|1,0,1]=4 6030 B7R0.2 CCC(Br)C=C(C)C Amb27831341 [1,1,0,0,0,0|1,0,1]=4 6031 B7R0.2 CCC(C)CC(=N)N Amb10607625 [1,1,0,0,0,0|2,0,0]=4 6032 B7R0.2 CCC(C)CC(=N)N Amb19890168 [1,1,0,0,0,0|2,0,0]=4 6033 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|1,0,0]=3 6034 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|1,0,0]=3 6035 B7R0.2 CCC(C)CC(C)=O Amb10608208 [1,1,0,0,0,0|0,0,0]=2 6036 B7R0.2 CCC(C)CC(C)Br Amb24757470 [1,1,0,0,0,0|1,0,1]=4 6037 B7R0.2 CCC(C)CC(C)C Amb22228298 [1,1,0,0,0,0|1,0,1]=4 6038 B7R0.2 CCC(C)CC(C)Cl Amb27639190 [1,1,0,0,0,0|1,0,1]=4 6039 B7R0.2 CCC(C)CC(C)N Amb10069423 [1,1,0,0,0,0|1,0,1]=4 6040 B7R0.2 CCC(C)CC(C)N Amb3940647 [1,1,0,0,0,0|1,0,1]=4 6041 B7R0.2 CCC(C)CC(C)O Amb4035421 [1,1,0,0,0,0|0,0,2]=4 6042 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|1,0,0]=3 6043 B7R0.2 CCC(C)CC(N)=S Amb26989527 [1,1,0,0,0,0|1,1,0]=4 6044 B7R0.2 CCC(C)CN(C)O Amb33373890 [1,1,0,0,0,0|1,0,1]=4 6045 B7R0.2 CCC(C)CS(=O)Cl Amb32720505 [1,1,0,0,0,0|2,0,0]=4 6046 B7R0.2 CCC(C)CS(=O)[O-] Amb27408549 [1,1,0,0,0,0|2,0,0]=4 6047 B7R0.2 CCC(C)CS(C)=O Amb27837877 [1,1,0,0,0,0|1,0,0]=3 6048 B7R0.2 CCC(C)CS(N)=O Amb32720506 [1,1,0,0,0,0|2,0,0]=4 6049 B7R0.2 CCC(C)C[C@@H](C)N Amb29854163 [1,1,0,0,0,0|1,0,1]=4 6050 B7R0.2 CCC(C)C[C@@H](C)O Amb33318318 [1,1,0,0,0,0|0,0,2]=4 6051 B7R0.2 CCC(C)C[C@H](C)N Amb29854162 [1,1,0,0,0,0|1,0,1]=4 6052 B7R0.2 CCC(C)C[C@H](C)O Amb33318389 [1,1,0,0,0,0|0,0,2]=4 6053 B7R0.2 CCC(C)C[N+](=O)[O-] Amb25075983 [1,1,0,0,0,0|2,0,0]=4 6054 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [1,1,0,0,0,0|2,0,0]=4 6055 B7R0.2 CCC(C)NC(C)=O Amb3358085 [1,1,0,0,0,0|1,0,0]=3 6056 B7R0.2 CCC(C)NC(N)=O Amb9702507 [1,1,0,0,0,0|2,0,0]=4 6057 B7R0.2 CCC(C)NS(C)=O Amb27245049 [1,1,0,0,0,0|2,0,0]=4 6058 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 6059 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [1,1,0,0,0,0|2,0,0]=4 6060 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [1,1,0,0,0,0|0,0,0]=2 6061 B7R0.2 CCC(Cl)CC(C)C Amb28399717 [1,1,0,0,0,0|1,0,1]=4 6062 B7R0.2 CCC(Cl)CC(C)Cl Amb28076666 [1,1,0,0,0,0|1,0,1]=4 6063 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [1,1,0,0,0,0|1,0,0]=3 6064 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [1,1,0,0,0,0|2,0,0]=4 6065 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [1,1,0,0,0,0|1,0,0]=3 6066 B7R0.2 CCC(N)C=C(C)C Amb27450297 [1,1,0,0,0,0|1,0,1]=4 6067 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|1,0,0]=3 6068 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|1,0,0]=3 6069 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|0,0,0]=2 6070 B7R0.2 CCC(N)CC(C)=O Amb26895708 [1,1,0,0,0,0|0,0,0]=2 6071 B7R0.2 CCC(N)CC(C)C Amb18523780 [1,1,0,0,0,0|1,0,1]=4 6072 B7R0.2 CCC(N)CC(C)O Amb27604743 [1,1,0,0,0,0|0,0,2]=4 6073 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|1,0,0]=3 6074 B7R0.2 CCC(N)CC(N)=S Amb28078345 [1,1,0,0,0,0|1,1,0]=4 6075 B7R0.2 CCC(N)CN(C)C Amb9763888 [1,1,0,0,0,0|2,0,0]=4 6076 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|1,0,0]=3 6077 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|0,0,0]=2 6078 B7R0.2 CCC(O)CC(C)N Amb35591053 [1,1,0,0,0,0|1,0,1]=4 6079 B7R0.2 CCC(O)CC(C)O Amb26515705 [1,1,0,0,0,0|0,0,2]=4 6080 B7R0.2 CCC(O)CC(C)S Amb27766599 [1,1,0,0,0,0|0,1,1]=4 6081 B7R0.2 CCC(O)CN(C)C Amb9787532 [1,1,0,0,0,0|2,0,0]=4 6082 B7R0.2 CCC(O)CN(C)N Amb27472509 [1,1,0,0,0,0|2,0,0]=4 6083 B7R0.2 CCC(O)CS(C)=O Amb28457838 [1,1,0,0,0,0|1,0,0]=3 6084 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [1,1,0,0,0,0|2,0,0]=4 6085 B7R0.2 CCC(O)OC(C)=O Amb28256771 [1,1,0,0,0,0|1,0,0]=3 6086 B7R0.2 CCC(S)CN(C)C Amb26512113 [1,1,0,0,0,0|2,0,0]=4 6087 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|2,0,0]=4 6088 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|2,0,0]=4 6089 B7R0.2 CCN(C)CC(C)=O Amb8427987 [1,1,0,0,0,0|1,0,0]=3 6090 B7R0.2 CCN(C)CC(C)=O Amb9173327 [1,1,0,0,0,0|1,0,0]=3 6091 B7R0.2 CCN(C)CC(N)=O Amb27639873 [1,1,0,0,0,0|2,0,0]=4 6092 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|2,0,0]=4 6093 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|2,0,0]=4 6094 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [1,1,0,0,0,0|1,0,0]=3 6095 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [1,1,0,0,0,0|2,0,0]=4 6096 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|1,0,0]=3 6097 B7R0.2 CC[C@@H](C)NC(C)=S Amb28119994 [1,1,0,0,0,0|1,1,0]=4 6098 B7R0.2 CC[C@@H](Cl)C[C@@H](C)Cl Amb27984838 [1,1,0,0,0,0|1,0,1]=4 6099 B7R0.2 CC[C@@H](Cl)C[C@H](C)Cl Amb28118942 [1,1,0,0,0,0|1,0,1]=4 6100 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|1,0,0]=3 6101 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|1,0,0]=3 6102 B7R0.2 CC[C@@H](N)CN(C)C Amb22587558 [1,1,0,0,0,0|2,0,0]=4 6103 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|1,0,0]=3 6104 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|0,0,0]=2 6105 B7R0.2 CC[C@@H](O)CC(C)C Amb27603599 [1,1,0,0,0,0|1,0,1]=4 6106 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [1,1,0,0,0,0|0,0,2]=4 6107 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [1,1,0,0,0,0|0,0,2]=4 6108 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|1,0,0]=3 6109 B7R0.2 CC[C@H](C)CC(C)O Amb27437194 [1,1,0,0,0,0|0,0,2]=4 6110 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|1,0,0]=3 6111 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|1,0,0]=3 6112 B7R0.2 CC[C@H](N)CN(C)C Amb22587381 [1,1,0,0,0,0|2,0,0]=4 6113 B7R0.2 CC[C@H](N)CN(C)C Amb23385277 [1,1,0,0,0,0|2,0,0]=4 6114 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|1,0,0]=3 6115 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [1,1,0,0,0,0|0,0,0]=2 6116 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [1,1,0,0,0,0|0,0,2]=4 6117 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [1,1,0,0,0,0|0,0,2]=4 6118 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [1,1,0,0,0,0|0,0,2]=4 6119 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [1,1,0,0,0,0|1,0,1]=4 6120 B7R0.2 CC\C(S)=C\C(C)=O Amb27775797 [1,1,0,0,0,0|0,0,2]=4 6121 B7R0.2 CC\C([O-])=C\C(C)=O Amb19960031 [1,1,0,0,0,0|0,0,2]=4 6122 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [1,1,0,0,0,0|1,0,1]=4 6123 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [1,1,0,0,0,0|1,0,1]=4 6124 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|2,0,0]=4 6125 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|2,0,0]=4 6126 B7R0.2 CNC(C)CC(N)=O Amb17231826 [1,1,0,0,0,0|2,0,0]=4 6127 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 6128 B7R0.2 CNC(C)CS(C)=O Amb24410768 [1,1,0,0,0,0|2,0,0]=4 6129 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|2,0,0]=4 6130 B7R0.2 COC(=O)CC(C)=O Amb6608655 [1,1,0,0,0,0|1,0,1]=4 6131 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|2,0,0]=4 6132 B7R0.2 COC(C)CC(C)=O Amb26512071 [1,1,0,0,0,0|1,0,0]=3 6133 B7R0.2 COC(C)CC(N)=O Amb27838372 [1,1,0,0,0,0|2,0,0]=4 6134 B7R0.2 COC(C)NC(C)=O Amb27839138 [1,1,0,0,0,0|2,0,0]=4 6135 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|2,0,0]=4 6136 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [1,1,0,0,0,0|1,0,0]=3 6137 B7R0.2 CS(=O)CC(O)CN Amb24482487 [1,1,0,0,0,0|2,0,0]=4 6138 B7R0.2 CS(=O)CC(O)CN Amb32683521 [1,1,0,0,0,0|2,0,0]=4 6139 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|2,0,0]=4 6140 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|1,0,0]=3 6141 B7R0.2 CSC(C)CC(N)=O Amb27838848 [1,1,0,0,0,0|2,0,0]=4 6142 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|2,0,0]=4 6143 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [1,1,0,0,0,0|2,0,0]=4 6144 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,1,0,0,0,0|2,0,0]=4 6145 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,1,0,0,0,0|2,0,0]=4 6146 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,1,0,0,0,0|2,0,0]=4 6147 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,1,0,0,0,0|2,0,0]=4 6148 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,1,0,0,0,0|2,0,0]=4 6149 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [1,1,0,0,0,0|0,0,2]=4 6150 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [1,1,0,0,0,0|0,0,2]=4 6151 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [1,1,0,0,0,0|2,0,0]=4 6152 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [1,1,0,0,0,0|2,0,0]=4 6153 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|2,0,0]=4 6154 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [1,1,0,0,0,0|2,0,0]=4 6155 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [1,1,0,0,0,0|2,0,0]=4 6156 B7R0.2 NC(CF)CC(=O)O Amb24428065 [1,1,0,0,0,0|2,0,0]=4 6157 B7R0.2 NC(CS)CC(=O)O Amb25090412 [1,1,0,0,0,0|2,0,0]=4 6158 B7R0.2 NCC(N)CC(=O)O Amb19515145 [1,1,0,0,0,0|2,0,0]=4 6159 B7R0.2 NCC(N)CC(=O)O Amb21858324 [1,1,0,0,0,0|2,0,0]=4 6160 B7R0.2 NCC(N)CC(N)=O Amb27603845 [1,1,0,0,0,0|2,0,0]=4 6161 B7R0.2 NCC(O)CC(=O)O Amb32663899 [1,1,0,0,0,0|2,0,0]=4 6162 B7R0.2 NCC(O)CC(=O)O Amb33544754 [1,1,0,0,0,0|2,0,0]=4 6163 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [1,1,0,0,0,0|2,0,0]=4 6164 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [1,1,0,0,0,0|2,0,0]=4 6165 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [1,1,0,0,0,0|2,0,0]=4 6166 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [1,1,0,0,0,0|2,0,0]=4 6167 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [1,1,0,0,0,0|2,0,0]=4 6168 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [1,1,0,0,0,0|2,0,0]=4 6169 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [1,1,0,0,0,0|2,0,0]=4 6170 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [1,1,0,0,0,0|2,0,0]=4 6171 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [1,1,0,0,0,0|2,0,0]=4 6172 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [1,1,0,0,0,0|2,0,0]=4 6173 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [1,1,0,0,0,0|2,0,0]=4 6174 B7R0.2 O=C(O)CC(O)CF Amb26557587 [1,1,0,0,0,0|2,0,0]=4 6175 B7R0.2 O=C(O)CC(O)CO Amb28120003 [1,1,0,0,0,0|2,0,0]=4 6176 B7R0.2 O=C(O)CC(O)CS Amb27244674 [1,1,0,0,0,0|2,0,0]=4 6177 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [1,1,0,0,0,0|2,0,0]=4 6178 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [1,1,0,0,0,0|2,0,0]=4 6179 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [1,1,0,0,0,0|2,0,0]=4 6180 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [1,1,0,0,0,0|2,0,0]=4 6181 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [1,1,0,0,0,0|2,0,0]=4 6182 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [1,1,0,0,0,0|2,0,0]=4 6183 B7R0.3 C#CC(=O)CCCC Amb28128200 [1,1,0,0,0,0|0,0,1]=3 6184 B7R0.3 C#CC(=O)CCCCl Amb27669507 [1,1,0,0,0,0|1,0,1]=4 6185 B7R0.3 C#CC(=O)CCCN Amb27631285 [1,1,0,0,0,0|1,0,1]=4 6186 B7R0.3 C#CC(=O)CCCO Amb27593195 [1,1,0,0,0,0|1,0,1]=4 6187 B7R0.3 C#CC(=O)OCCC Amb27761363 [1,1,0,0,0,0|1,0,1]=4 6188 B7R0.3 C#CC(C)CCCC Amb33169085 [1,1,0,0,0,0|1,0,1]=4 6189 B7R0.3 C#CCCC(=O)OC Amb18115985 [1,1,0,0,0,0|0,0,2]=4 6190 B7R0.3 C=C(C=O)CCCC Amb4025817 [1,1,0,0,0,0|0,0,1]=3 6191 B7R0.3 C=C(C=O)CCCO Amb28128165 [1,1,0,0,0,0|1,0,1]=4 6192 B7R0.3 C=C(C=O)CCOC Amb27948778 [1,1,0,0,0,0|1,0,1]=4 6193 B7R0.3 C=C(CBr)CCCC Amb25249105 [1,1,0,0,0,0|1,0,0]=3 6194 B7R0.3 C=C(CBr)CCCCl Amb27865558 [1,1,0,0,0,0|2,0,0]=4 6195 B7R0.3 C=C(CBr)CCOC Amb33387059 [1,1,0,0,0,0|2,0,0]=4 6196 B7R0.3 C=C(CBr)CCSC Amb33334988 [1,1,0,0,0,0|2,0,0]=4 6197 B7R0.3 C=C(CBr)CSCC Amb33435749 [1,1,0,0,0,0|2,0,0]=4 6198 B7R0.3 C=C(CC)CCCBr Amb27491082 [1,1,0,0,0,0|2,0,0]=4 6199 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|1,0,0]=3 6200 B7R0.3 C=C(CC)CCCCl Amb28397002 [1,1,0,0,0,0|2,0,0]=4 6201 B7R0.3 C=C(CC)CCCN Amb27631266 [1,1,0,0,0,0|2,0,0]=4 6202 B7R0.3 C=C(CC)CCCO Amb26032857 [1,1,0,0,0,0|2,0,0]=4 6203 B7R0.3 C=C(CC)CCNC Amb28325353 [1,1,0,0,0,0|2,0,0]=4 6204 B7R0.3 C=C(CC)CSCC Amb28291726 [1,1,0,0,0,0|2,0,0]=4 6205 B7R0.3 C=C(CCl)CCCC Amb25889368 [1,1,0,0,0,0|1,0,0]=3 6206 B7R0.3 C=C(CCl)CCOC Amb33220591 [1,1,0,0,0,0|2,0,0]=4 6207 B7R0.3 C=C(CCl)CCSC Amb33259848 [1,1,0,0,0,0|2,0,0]=4 6208 B7R0.3 C=C(CCl)CSCC Amb24529097 [1,1,0,0,0,0|2,0,0]=4 6209 B7R0.3 C=C(CN)CCCC Amb27630595 [1,1,0,0,0,0|1,0,0]=3 6210 B7R0.3 C=C(CN)CCOC Amb33377483 [1,1,0,0,0,0|2,0,0]=4 6211 B7R0.3 C=C(CN)CCSC Amb33198280 [1,1,0,0,0,0|2,0,0]=4 6212 B7R0.3 C=C(CN)CSCC Amb27805084 [1,1,0,0,0,0|2,0,0]=4 6213 B7R0.3 C=C=C(C)CCCBr Amb27876055 [1,1,0,0,0,0|2,0,0]=4 6214 B7R0.3 C=C=C(C)CCCN Amb27839400 [1,1,0,0,0,0|2,0,0]=4 6215 B7R0.3 C=C=C(C)CCCO Amb28321385 [1,1,0,0,0,0|2,0,0]=4 6216 B7R0.3 C=CC(=O)CCCC Amb25062494 [1,1,0,0,0,0|0,0,1]=3 6217 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,1,0,0,0,0|1,0,1]=4 6218 B7R0.3 C=CC(=O)CCOC Amb24744935 [1,1,0,0,0,0|1,0,1]=4 6219 B7R0.3 C=CC(=O)CCSC Amb25334636 [1,1,0,0,0,0|1,0,1]=4 6220 B7R0.3 C=CC(=O)COCC Amb27248148 [1,1,0,0,0,0|1,0,1]=4 6221 B7R0.3 C=CC(=O)CSCC Amb25865187 [1,1,0,0,0,0|1,0,1]=4 6222 B7R0.3 C=CC(=O)NCCC Amb9480391 [1,1,0,0,0,0|1,0,1]=4 6223 B7R0.3 C=CC(=O)OCCC Amb22045218 [1,1,0,0,0,0|1,0,1]=4 6224 B7R0.3 C=CC(C)CCCC Amb22641469 [1,1,0,0,0,0|1,0,1]=4 6225 B7R0.3 C=CCCC(=O)CBr Amb22059627 [1,1,0,0,0,0|0,0,2]=4 6226 B7R0.3 C=CCCC(=O)CC Amb9031676 [1,1,0,0,0,0|0,0,2]=4 6227 B7R0.3 C=CCCC(=O)CCl Amb22059504 [1,1,0,0,0,0|0,0,2]=4 6228 B7R0.3 C=CCCC(=O)CF Amb28074643 [1,1,0,0,0,0|0,0,2]=4 6229 B7R0.3 C=CCCC(=O)NC Amb25041195 [1,1,0,0,0,0|0,0,2]=4 6230 B7R0.3 C=CCCC(=O)OC Amb2369959 [1,1,0,0,0,0|0,0,2]=4 6231 B7R0.3 CC#CCC(=O)OC Amb6336504 [1,1,0,0,0,0|0,0,2]=4 6232 B7R0.3 CC(C=O)CCCBr Amb26526795 [1,1,0,0,0,0|1,0,1]=4 6233 B7R0.3 CCC#CC(=O)OC Amb27838321 [1,1,0,0,0,0|0,0,2]=4 6234 B7R0.3 CCC(=O)CCC#N Amb25321503 [1,1,0,0,0,0|1,0,1]=4 6235 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,0]=3 6236 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,1,0,0,0,0|1,0,0]=3 6237 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,0]=3 6238 B7R0.3 CCC(=O)CCNC Amb27963044 [1,1,0,0,0,0|1,0,0]=3 6239 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|1,0,0]=3 6240 B7R0.3 CCC(=O)NCCCl Amb17103188 [1,1,0,0,0,0|2,0,0]=4 6241 B7R0.3 CCC(=O)NCCF Amb27972779 [1,1,0,0,0,0|2,0,0]=4 6242 B7R0.3 CCC(=O)NCCN Amb1137732 [1,1,0,0,0,0|2,0,0]=4 6243 B7R0.3 CCC(=O)NCCN Amb32434788 [1,1,0,0,0,0|2,0,0]=4 6244 B7R0.3 CCC(=O)NCCN Amb33741516 [1,1,0,0,0,0|2,0,0]=4 6245 B7R0.3 CCC(=O)NCCO Amb5797470 [1,1,0,0,0,0|2,0,0]=4 6246 B7R0.3 CCC(=O)NCCS Amb24505089 [1,1,0,0,0,0|2,0,0]=4 6247 B7R0.3 CCC(=O)OCCBr Amb27424669 [1,1,0,0,0,0|2,0,0]=4 6248 B7R0.3 CCC(=O)OCCF Amb27981291 [1,1,0,0,0,0|2,0,0]=4 6249 B7R0.3 CCC(=O)OCCO Amb27217859 [1,1,0,0,0,0|2,0,0]=4 6250 B7R0.3 CCC(=O)SCCBr Amb27865550 [1,1,0,0,0,0|2,0,0]=4 6251 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|1,0,0]=3 6252 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|1,0,0]=3 6253 B7R0.3 CCCCC(=O)C#N Amb22729179 [1,1,0,0,0,0|0,0,1]=3 6254 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|0,0,0]=2 6255 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|0,0,0]=2 6256 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|0,0,0]=2 6257 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|0,0,0]=2 6258 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,0]=2 6259 B7R0.3 CCCCC(=O)NC Amb5797766 [1,1,0,0,0,0|0,0,0]=2 6260 B7R0.3 CCCCC(=O)NN Amb534136 [1,1,0,0,0,0|1,0,0]=3 6261 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|1,0,0]=3 6262 B7R0.3 CCCCC(=S)NC Amb27838397 [1,1,0,0,0,0|0,1,0]=3 6263 B7R0.3 CCCCC(Br)C=O Amb17594581 [1,1,0,0,0,0|1,0,1]=4 6264 B7R0.3 CCCCC(Br)CBr Amb8517633 [1,1,0,0,0,0|1,0,1]=4 6265 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|1,0,1]=4 6266 B7R0.3 CCCCC(Br)CF Amb28410717 [1,1,0,0,0,0|1,0,1]=4 6267 B7R0.3 CCCCC(C)C#N Amb18641663 [1,1,0,0,0,0|1,0,1]=4 6268 B7R0.3 CCCCC(C)C=O Amb17593191 [1,1,0,0,0,0|0,0,1]=3 6269 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,1]=4 6270 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|1,0,1]=4 6271 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,1]=4 6272 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,1]=4 6273 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|0,0,2]=4 6274 B7R0.3 CCCCC(C)NC Amb9620956 [1,1,0,0,0,0|1,0,1]=4 6275 B7R0.3 CCCCC(C)ON Amb33428411 [1,1,0,0,0,0|0,0,2]=4 6276 B7R0.3 CCCCC(Cl)CBr Amb27490970 [1,1,0,0,0,0|1,0,1]=4 6277 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|1,0,1]=4 6278 B7R0.3 CCCCC(Cl)CCl Amb9787250 [1,1,0,0,0,0|1,0,1]=4 6279 B7R0.3 CCCCC(Cl)CN Amb31030967 [1,1,0,0,0,0|1,0,1]=4 6280 B7R0.3 CCCCC(F)C=O Amb27838938 [1,1,0,0,0,0|1,0,1]=4 6281 B7R0.3 CCCCC(F)CBr Amb27758689 [1,1,0,0,0,0|1,0,1]=4 6282 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,1]=4 6283 B7R0.3 CCCCC(N)C=O Amb28422291 [1,1,0,0,0,0|1,0,1]=4 6284 B7R0.3 CCCCC(N)CC Amb33527796 [1,1,0,0,0,0|1,0,1]=4 6285 B7R0.3 CCCCC(N)CC Amb9031866 [1,1,0,0,0,0|1,0,1]=4 6286 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,1]=4 6287 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|1,0,1]=4 6288 B7R0.3 CCCCC(N)CS Amb27961155 [1,1,0,0,0,0|1,0,1]=4 6289 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|0,0,2]=4 6290 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|0,0,2]=4 6291 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|0,0,2]=4 6292 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|0,0,2]=4 6293 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|0,0,2]=4 6294 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|0,0,2]=4 6295 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|0,1,1]=4 6296 B7R0.3 CCCCC(S)CN Amb27643759 [1,1,0,0,0,0|0,1,1]=4 6297 B7R0.3 CCCCN(C)C#N Amb28048925 [1,1,0,0,0,0|2,0,0]=4 6298 B7R0.3 CCCCN(C)C=O Amb26967032 [1,1,0,0,0,0|1,0,0]=3 6299 B7R0.3 CCCCN(C)N=O Amb22231185 [1,1,0,0,0,0|1,0,0]=3 6300 B7R0.3 CCCCN(N)CC Amb17593206 [1,1,0,0,0,0|2,0,0]=4 6301 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|1,0,1]=4 6302 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|1,0,1]=4 6303 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|1,0,1]=4 6304 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|0,0,2]=4 6305 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|1,0,1]=4 6306 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,1,0,0,0,0|1,0,1]=4 6307 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|1,0,1]=4 6308 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|0,0,2]=4 6309 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,1,0,0,0,0|0,0,1]=3 6310 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|1,0,1]=4 6311 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|0,0,2]=4 6312 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|1,0,1]=4 6313 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|1,0,1]=4 6314 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|0,0,2]=4 6315 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|0,0,2]=4 6316 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|0,1,1]=4 6317 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [1,1,0,0,0,0|1,0,1]=4 6318 B7R0.3 CCCC\C(C)=N\N Amb27883272 [1,1,0,0,0,0|1,0,0]=3 6319 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [1,1,0,0,0,0|1,0,1]=4 6320 B7R0.3 CCCC\C(N)=N/O Amb2696577 [1,1,0,0,0,0|1,0,1]=4 6321 B7R0.3 CCCC\C(N)=N\O Amb8391665 [1,1,0,0,0,0|1,0,1]=4 6322 B7R0.3 CCCNC(=N)NC Amb28128375 [1,1,0,0,0,0|2,0,0]=4 6323 B7R0.3 CCCNC(=N)SC Amb27839564 [1,1,0,0,0,0|2,0,0]=4 6324 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|1,0,0]=3 6325 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|1,0,0]=3 6326 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|1,0,0]=3 6327 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|1,0,0]=3 6328 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|1,0,0]=3 6329 B7R0.3 CCCNC(=O)CN Amb426858 [1,1,0,0,0,0|1,0,0]=3 6330 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|1,0,0]=3 6331 B7R0.3 CCCNC(=O)NCl Amb28057729 [1,1,0,0,0,0|2,0,0]=4 6332 B7R0.3 CCCNC(=O)NN Amb8854021 [1,1,0,0,0,0|2,0,0]=4 6333 B7R0.3 CCCNC(=S)NC Amb4016503 [1,1,0,0,0,0|1,1,0]=4 6334 B7R0.3 CCCN\C(C)=N\O Amb27234636 [1,1,0,0,0,0|1,0,1]=4 6335 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,1,0,0,0,0|1,0,1]=4 6336 B7R0.3 CCCOC(=O)CCl Amb9787444 [1,1,0,0,0,0|1,0,0]=3 6337 B7R0.3 CCCOC(=O)CN Amb9826861 [1,1,0,0,0,0|1,0,0]=3 6338 B7R0.3 CCCOC(=O)CO Amb25964379 [1,1,0,0,0,0|1,0,0]=3 6339 B7R0.3 CCCOC(=O)OC Amb27153532 [1,1,0,0,0,0|1,0,0]=3 6340 B7R0.3 CCCOS(=O)CCl Amb27391160 [1,1,0,0,0,0|2,0,0]=4 6341 B7R0.3 CCCSC(=O)CBr Amb28385643 [1,1,0,0,0,0|1,0,0]=3 6342 B7R0.3 CCCSC(=O)CC Amb25882938 [1,1,0,0,0,0|1,0,0]=3 6343 B7R0.3 CCCSC(=O)NC Amb27788550 [1,1,0,0,0,0|1,0,0]=3 6344 B7R0.3 CCCSC(=O)NN Amb27769595 [1,1,0,0,0,0|2,0,0]=4 6345 B7R0.3 CCCSC(C)C=O Amb18124367 [1,1,0,0,0,0|1,0,1]=4 6346 B7R0.3 CCC\C=C(/C)CC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 6347 B7R0.3 CCC\C=C(/C)CCl Amb27803634 [1,1,0,0,0,0|1,0,1]=4 6348 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [1,1,0,0,0,0|1,0,1]=4 6349 B7R0.3 CCC\C=C(\C)CBr Amb27984757 [1,1,0,0,0,0|1,0,1]=4 6350 B7R0.3 CCC\C=C(\C)CN Amb27953132 [1,1,0,0,0,0|1,0,1]=4 6351 B7R0.3 CCC\C=C(\Cl)CCl Amb27656326 [1,1,0,0,0,0|1,0,1]=4 6352 B7R0.3 CCNCC(=O)NC Amb32680747 [1,1,0,0,0,0|1,0,0]=3 6353 B7R0.3 CCNCC(=O)NC Amb6251820 [1,1,0,0,0,0|1,0,0]=3 6354 B7R0.3 CCNCC(=O)NO Amb27755137 [1,1,0,0,0,0|2,0,0]=4 6355 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,0]=3 6356 B7R0.3 CCNCC(=O)OC Amb6687125 [1,1,0,0,0,0|1,0,0]=3 6357 B7R0.3 CCOCC(=O)CC Amb27406475 [1,1,0,0,0,0|1,0,0]=3 6358 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|1,0,0]=3 6359 B7R0.3 CCOCC(=O)CF Amb28316133 [1,1,0,0,0,0|1,0,0]=3 6360 B7R0.3 CCOCC(=O)CN Amb27453616 [1,1,0,0,0,0|1,0,0]=3 6361 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,0]=3 6362 B7R0.3 CCOCC(=O)NN Amb2111918 [1,1,0,0,0,0|2,0,0]=4 6363 B7R0.3 CCOCC(=O)NN Amb6744505 [1,1,0,0,0,0|2,0,0]=4 6364 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,0]=3 6365 B7R0.3 CCOC\C(C)=C/Cl Amb27201335 [1,1,0,0,0,0|2,0,0]=4 6366 B7R0.3 CCOC\C(C)=N\O Amb28049034 [1,1,0,0,0,0|1,0,1]=4 6367 B7R0.3 CCONC(=O)CN Amb24445788 [1,1,0,0,0,0|2,0,0]=4 6368 B7R0.3 CCONC(=O)CN Amb32664914 [1,1,0,0,0,0|2,0,0]=4 6369 B7R0.3 CCONC(=O)CO Amb27762105 [1,1,0,0,0,0|2,0,0]=4 6370 B7R0.3 CCONC(=O)NC Amb27805073 [1,1,0,0,0,0|2,0,0]=4 6371 B7R0.3 CCO\C=C(/C)C=O Amb8514481 [1,1,0,0,0,0|1,0,1]=4 6372 B7R0.3 CCO\C=C(\C)C=O Amb18641771 [1,1,0,0,0,0|1,0,1]=4 6373 B7R0.3 CCS(=O)CCCCl Amb27188737 [1,1,0,0,0,0|2,0,0]=4 6374 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|2,0,0]=4 6375 B7R0.3 CCS(=O)CCNC Amb21984659 [1,1,0,0,0,0|2,0,0]=4 6376 B7R0.3 CCS(=O)CCOC Amb27838120 [1,1,0,0,0,0|2,0,0]=4 6377 B7R0.3 CCSCC(=O)CCl Amb24545960 [1,1,0,0,0,0|1,0,0]=3 6378 B7R0.3 CCSCC(=O)CN Amb33324079 [1,1,0,0,0,0|1,0,0]=3 6379 B7R0.3 CCSCC(=O)NN Amb2610654 [1,1,0,0,0,0|2,0,0]=4 6380 B7R0.3 CCSCC(=O)OC Amb7753193 [1,1,0,0,0,0|1,0,0]=3 6381 B7R0.3 CCSCC(C)C=O Amb27592961 [1,1,0,0,0,0|1,0,1]=4 6382 B7R0.3 CCSCS(=O)CC Amb4014439 [1,1,0,0,0,0|2,0,0]=4 6383 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [1,1,0,0,0,0|0,0,2]=4 6384 B7R0.3 CC\C=C\C(=O)CC Amb25283354 [1,1,0,0,0,0|0,0,2]=4 6385 B7R0.3 CC\C=C\C(=O)CCl Amb33057661 [1,1,0,0,0,0|0,0,2]=4 6386 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [1,1,0,0,0,0|0,0,2]=4 6387 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [1,1,0,0,0,0|0,0,2]=4 6388 B7R0.3 CN(C=O)CCCCl Amb24589375 [1,1,0,0,0,0|2,0,0]=4 6389 B7R0.3 CN(C=O)CCCO Amb17593211 [1,1,0,0,0,0|2,0,0]=4 6390 B7R0.3 CN(CCCO)N=O Amb25934136 [1,1,0,0,0,0|2,0,0]=4 6391 B7R0.3 CNC(=N)CCOC Amb24526950 [1,1,0,0,0,0|2,0,0]=4 6392 B7R0.3 CNC(=N)CCOC Amb30585093 [1,1,0,0,0,0|2,0,0]=4 6393 B7R0.3 CNC(=N)CCSC Amb35595278 [1,1,0,0,0,0|2,0,0]=4 6394 B7R0.3 CNC(=O)CCC#N Amb17334052 [1,1,0,0,0,0|1,0,1]=4 6395 B7R0.3 CNC(=O)CCCCl Amb1137464 [1,1,0,0,0,0|1,0,0]=3 6396 B7R0.3 CNC(=O)CCCI Amb27625606 [1,1,0,0,0,0|1,0,0]=3 6397 B7R0.3 CNC(=O)CCCN Amb6263864 [1,1,0,0,0,0|1,0,0]=3 6398 B7R0.3 CNC(=O)CCCN Amb9176288 [1,1,0,0,0,0|1,0,0]=3 6399 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,0]=3 6400 B7R0.3 CNC(=O)CCCS Amb27259921 [1,1,0,0,0,0|1,0,0]=3 6401 B7R0.3 CNC(=O)CCNN Amb26936043 [1,1,0,0,0,0|2,0,0]=4 6402 B7R0.3 CNC(=O)CCOC Amb27655430 [1,1,0,0,0,0|1,0,0]=3 6403 B7R0.3 CNC(=O)NCCCl Amb27148870 [1,1,0,0,0,0|2,0,0]=4 6404 B7R0.3 CNC(=O)NCCN Amb17231831 [1,1,0,0,0,0|2,0,0]=4 6405 B7R0.3 CNC(=O)NCCN Amb28934877 [1,1,0,0,0,0|2,0,0]=4 6406 B7R0.3 CNC(=O)NCCN Amb32663759 [1,1,0,0,0,0|2,0,0]=4 6407 B7R0.3 CNC(=O)NCCO Amb24376074 [1,1,0,0,0,0|2,0,0]=4 6408 B7R0.3 CNC(=O)NCCS Amb28350549 [1,1,0,0,0,0|2,0,0]=4 6409 B7R0.3 CNC(=O)OCCCl Amb22363563 [1,1,0,0,0,0|2,0,0]=4 6410 B7R0.3 CNC(=O)OCCF Amb28071923 [1,1,0,0,0,0|2,0,0]=4 6411 B7R0.3 CNC(=O)OCCO Amb3939460 [1,1,0,0,0,0|2,0,0]=4 6412 B7R0.3 CNCCC(=N)OC Amb28411188 [1,1,0,0,0,0|2,0,0]=4 6413 B7R0.3 CNCCC(=O)NC Amb19959924 [1,1,0,0,0,0|1,0,0]=3 6414 B7R0.3 CNCCC(=O)NC Amb8428200 [1,1,0,0,0,0|1,0,0]=3 6415 B7R0.3 CNCCC(=O)NN Amb28143068 [1,1,0,0,0,0|2,0,0]=4 6416 B7R0.3 CNCCC(=O)NO Amb27763537 [1,1,0,0,0,0|2,0,0]=4 6417 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|1,0,0]=3 6418 B7R0.3 CNCCC(=O)OC Amb7969878 [1,1,0,0,0,0|1,0,0]=3 6419 B7R0.3 CNCC\C(C)=C\Cl Amb27594199 [1,1,0,0,0,0|2,0,0]=4 6420 B7R0.3 CNOCC(=O)OC Amb32662920 [1,1,0,0,0,0|2,0,0]=4 6421 B7R0.3 CNOCC(=O)OC Amb33067971 [1,1,0,0,0,0|2,0,0]=4 6422 B7R0.3 COC(=N)CCCCl Amb16231406 [1,1,0,0,0,0|2,0,0]=4 6423 B7R0.3 COC(=N)CCCCl Amb27631457 [1,1,0,0,0,0|2,0,0]=4 6424 B7R0.3 COC(=N)CCCS Amb27628992 [1,1,0,0,0,0|2,0,0]=4 6425 B7R0.3 COC(=O)CCC#N Amb2689406 [1,1,0,0,0,0|1,0,1]=4 6426 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 6427 B7R0.3 COC(=O)CCCBr Amb8516943 [1,1,0,0,0,0|1,0,0]=3 6428 B7R0.3 COC(=O)CCCCl Amb3940271 [1,1,0,0,0,0|1,0,0]=3 6429 B7R0.3 COC(=O)CCCI Amb3941711 [1,1,0,0,0,0|1,0,0]=3 6430 B7R0.3 COC(=O)CCCN Amb402626 [1,1,0,0,0,0|1,0,0]=3 6431 B7R0.3 COC(=O)CCCS Amb19373761 [1,1,0,0,0,0|1,0,0]=3 6432 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [1,1,0,0,0,0|1,0,0]=3 6433 B7R0.3 COC(=O)CCON Amb29848091 [1,1,0,0,0,0|2,0,0]=4 6434 B7R0.3 COC(=O)CCSC Amb8393179 [1,1,0,0,0,0|1,0,0]=3 6435 B7R0.3 COC(=O)CSCBr Amb28458464 [1,1,0,0,0,0|2,0,0]=4 6436 B7R0.3 COC(=O)NCCN Amb18970459 [1,1,0,0,0,0|2,0,0]=4 6437 B7R0.3 COC(=O)NCCN Amb28934803 [1,1,0,0,0,0|2,0,0]=4 6438 B7R0.3 COC(=O)NCCO Amb9285601 [1,1,0,0,0,0|2,0,0]=4 6439 B7R0.3 COC(=O)NCSC Amb28398191 [1,1,0,0,0,0|2,0,0]=4 6440 B7R0.3 COC(=O)OCCBr Amb27228663 [1,1,0,0,0,0|2,0,0]=4 6441 B7R0.3 COC(=O)SCCCl Amb27640237 [1,1,0,0,0,0|2,0,0]=4 6442 B7R0.3 COCCC(=O)CCl Amb20622320 [1,1,0,0,0,0|1,0,0]=3 6443 B7R0.3 COCCC(=O)CN Amb26515688 [1,1,0,0,0,0|1,0,0]=3 6444 B7R0.3 COCCC(=O)NN Amb2689273 [1,1,0,0,0,0|2,0,0]=4 6445 B7R0.3 COCCC(=O)OC Amb6296150 [1,1,0,0,0,0|1,0,0]=3 6446 B7R0.3 COCCC(C)C=O Amb26896518 [1,1,0,0,0,0|1,0,1]=4 6447 B7R0.3 COCCN(C)N=O Amb26370374 [1,1,0,0,0,0|2,0,0]=4 6448 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [1,1,0,0,0,0|1,0,1]=4 6449 B7R0.3 COCNC(=O)CF Amb28045827 [1,1,0,0,0,0|2,0,0]=4 6450 B7R0.3 COCNC(=O)OC Amb27253203 [1,1,0,0,0,0|2,0,0]=4 6451 B7R0.3 COCOC(=O)CCl Amb27952135 [1,1,0,0,0,0|2,0,0]=4 6452 B7R0.3 CSC(=O)CCCCl Amb27249585 [1,1,0,0,0,0|1,0,0]=3 6453 B7R0.3 CSCCC(=O)CCl Amb25910902 [1,1,0,0,0,0|1,0,0]=3 6454 B7R0.3 CSCCC(=O)CF Amb28316167 [1,1,0,0,0,0|1,0,0]=3 6455 B7R0.3 CSCCC(=O)CN Amb33199125 [1,1,0,0,0,0|1,0,0]=3 6456 B7R0.3 CSCCC(C)C=O Amb26624792 [1,1,0,0,0,0|1,0,1]=4 6457 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,1,0,0,0,0|1,0,1]=4 6458 B7R0.3 C\C(CCCO)=N/O Amb28207168 [1,1,0,0,0,0|1,0,1]=4 6459 B7R0.3 C\C=C(/C)CCCC Amb22229367 [1,1,0,0,0,0|1,0,0]=3 6460 B7R0.3 C\C=C(/C)NCCC Amb27881221 [1,1,0,0,0,0|2,0,0]=4 6461 B7R0.3 C\C=C(/Cl)CCCCl Amb27832144 [1,1,0,0,0,0|2,0,0]=4 6462 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [1,1,0,0,0,0|2,0,0]=4 6463 B7R0.3 C\C=C(\C)CCCN Amb27412873 [1,1,0,0,0,0|2,0,0]=4 6464 B7R0.3 C\C=C(\Cl)CCCCl Amb27421928 [1,1,0,0,0,0|2,0,0]=4 6465 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [1,1,0,0,0,0|0,0,2]=4 6466 B7R0.3 N#CC(=O)CCCCl Amb28410737 [1,1,0,0,0,0|1,0,1]=4 6467 B7R0.3 N#CCCC(=O)CN Amb27240440 [1,1,0,0,0,0|1,0,1]=4 6468 B7R0.3 NCC(=O)NCCF Amb27659897 [1,1,0,0,0,0|2,0,0]=4 6469 B7R0.3 NCC(=O)NCCF Amb33473629 [1,1,0,0,0,0|2,0,0]=4 6470 B7R0.3 NCC(=O)NCCO Amb9023087 [1,1,0,0,0,0|2,0,0]=4 6471 B7R0.3 NCC(=O)OCCCl Amb4244115 [1,1,0,0,0,0|2,0,0]=4 6472 B7R0.3 NCC(=O)OCCF Amb27964557 [1,1,0,0,0,0|2,0,0]=4 6473 B7R0.3 NCCCC(=O)NN Amb18061734 [1,1,0,0,0,0|2,0,0]=4 6474 B7R0.3 NCCNC(=O)CS Amb27413124 [1,1,0,0,0,0|2,0,0]=4 6475 B7R0.3 NCCSC(=O)CCl Amb28284347 [1,1,0,0,0,0|2,0,0]=4 6476 B7R0.3 NNC(=O)CCCCl Amb9818914 [1,1,0,0,0,0|2,0,0]=4 6477 B7R0.3 NNC(=O)CCCO Amb535400 [1,1,0,0,0,0|2,0,0]=4 6478 B7R0.3 O=C(CBr)CCCBr Amb27153779 [1,1,0,0,0,0|1,0,0]=3 6479 B7R0.3 O=C(CBr)CCCCl Amb27875989 [1,1,0,0,0,0|1,0,0]=3 6480 B7R0.3 O=C(CBr)NCCBr Amb24104073 [1,1,0,0,0,0|2,0,0]=4 6481 B7R0.3 O=C(CBr)NCCCl Amb29848056 [1,1,0,0,0,0|2,0,0]=4 6482 B7R0.3 O=C(CCCCl)NO Amb28061167 [1,1,0,0,0,0|2,0,0]=4 6483 B7R0.3 O=C(CCCF)NO Amb28185008 [1,1,0,0,0,0|2,0,0]=4 6484 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,1,0,0,0,0|1,0,0]=3 6485 B7R0.3 O=C(CCl)CCCCl Amb22395285 [1,1,0,0,0,0|1,0,0]=3 6486 B7R0.3 O=C(CCl)NCCBr Amb26055016 [1,1,0,0,0,0|2,0,0]=4 6487 B7R0.3 O=C(CCl)NCCCl Amb22261518 [1,1,0,0,0,0|2,0,0]=4 6488 B7R0.3 O=C(CCl)NCCF Amb28048272 [1,1,0,0,0,0|2,0,0]=4 6489 B7R0.3 O=C(CCl)NCCO Amb5716292 [1,1,0,0,0,0|2,0,0]=4 6490 B7R0.3 O=C(CCl)NCCS Amb25350349 [1,1,0,0,0,0|2,0,0]=4 6491 B7R0.3 O=C(CCl)SCCCl Amb28396574 [1,1,0,0,0,0|2,0,0]=4 6492 B7R0.3 O=C(CF)OCCCl Amb25112007 [1,1,0,0,0,0|2,0,0]=4 6493 B7R0.3 O=C(CO)CCCO Amb27227084 [1,1,0,0,0,0|1,0,0]=3 6494 B7R0.3 O=C(CO)NCCO Amb5798091 [1,1,0,0,0,0|2,0,0]=4 6495 B7R0.3 O=C(CO)OCCF Amb28049311 [1,1,0,0,0,0|2,0,0]=4 6496 B7R0.3 O=C(CS)NCCF Amb28204076 [1,1,0,0,0,0|2,0,0]=4 6497 B7R0.3 O=C(CS)OCCO Amb26476359 [1,1,0,0,0,0|2,0,0]=4 6498 B7R0.3 O=CC(=O)CCCO Amb27751348 [1,1,0,0,0,0|1,0,1]=4 6499 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,1,0,0,0,0|1,0,1]=4 6500 B7R0.3 [C-]#[N+]C(C)CCCC Amb3973080 [1,1,0,0,0,0|1,0,1]=4 6501 B7R0.3 [C-]#[N+]CCC(=O)OC Amb2689499 [1,1,0,0,0,0|1,0,1]=4 6502 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [1,1,0,0,0,0|0,0,2]=4 6503 B7R0.5 C#CCC(F)C(C)=O Amb28249962 [1,1,0,0,0,0|0,0,2]=4 6504 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [1,1,0,0,0,0|0,0,2]=4 6505 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [1,1,0,0,0,0|0,0,2]=4 6506 B7R0.5 C=C(C)C(=O)CCC Amb25862437 [1,1,0,0,0,0|1,0,1]=4 6507 B7R0.5 C=C(C)C(C)CCN Amb33199933 [1,1,0,0,0,0|2,0,0]=4 6508 B7R0.5 C=C(C)C(C)CCO Amb27766618 [1,1,0,0,0,0|2,0,0]=4 6509 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [1,1,0,0,0,0|1,0,0]=3 6510 B7R0.5 C=C(C)C(F)CCN Amb28401279 [1,1,0,0,0,0|2,0,0]=4 6511 B7R0.5 C=C(C)C(N)CCO Amb27391185 [1,1,0,0,0,0|2,0,0]=4 6512 B7R0.5 C=C(C)C(O)CCN Amb25929797 [1,1,0,0,0,0|2,0,0]=4 6513 B7R0.5 C=C(C)C(O)CNC Amb24716760 [1,1,0,0,0,0|2,0,0]=4 6514 B7R0.5 C=C(C)C(O)COC Amb27662970 [1,1,0,0,0,0|2,0,0]=4 6515 B7R0.5 C=C(C)C(O)CSC Amb27795952 [1,1,0,0,0,0|2,0,0]=4 6516 B7R0.5 C=C(C)[C@@H](O)CCN Amb33199602 [1,1,0,0,0,0|2,0,0]=4 6517 B7R0.5 C=C(C)[C@H](O)CCN Amb33199603 [1,1,0,0,0,0|2,0,0]=4 6518 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,1,0,0,0,0|1,0,1]=4 6519 B7R0.5 C=C(F)C(O)CCC Amb27833609 [1,1,0,0,0,0|1,0,1]=4 6520 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [1,1,0,0,0,0|0,0,2]=4 6521 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [1,1,0,0,0,0|0,0,2]=4 6522 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [1,1,0,0,0,0|0,0,2]=4 6523 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [1,1,0,0,0,0|0,0,2]=4 6524 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [1,1,0,0,0,0|0,0,2]=4 6525 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [1,1,0,0,0,0|0,0,2]=4 6526 B7R0.5 CC#CC(O)C(C)=O Amb25950589 [1,1,0,0,0,0|0,0,2]=4 6527 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [1,1,0,0,0,0|1,0,1]=4 6528 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,1,0,0,0,0|1,0,1]=4 6529 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [1,1,0,0,0,0|1,0,0]=3 6530 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,1,0,0,0,0|1,0,0]=3 6531 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [1,1,0,0,0,0|1,0,1]=4 6532 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [1,1,0,0,0,0|1,0,0]=3 6533 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [1,1,0,0,0,0|1,0,0]=3 6534 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,1,0,0,0,0|1,0,0]=3 6535 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 6536 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [1,1,0,0,0,0|1,0,0]=3 6537 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|1,0,0]=3 6538 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,1,0,0,0,0|1,0,0]=3 6539 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [1,1,0,0,0,0|1,0,0]=3 6540 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [1,1,0,0,0,0|1,0,0]=3 6541 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|1,0,0]=3 6542 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|1,0,0]=3 6543 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [1,1,0,0,0,0|2,0,0]=4 6544 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [1,1,0,0,0,0|2,0,0]=4 6545 B7R0.5 CC(=O)N(C)CCN Amb17046786 [1,1,0,0,0,0|2,0,0]=4 6546 B7R0.5 CC(=O)N(C)CCN Amb34137491 [1,1,0,0,0,0|2,0,0]=4 6547 B7R0.5 CC(=O)N(C)CCO Amb5797447 [1,1,0,0,0,0|2,0,0]=4 6548 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [1,1,0,0,0,0|1,0,1]=4 6549 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,1,0,0,0,0|1,0,0]=3 6550 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [1,1,0,0,0,0|1,0,1]=4 6551 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [1,1,0,0,0,0|2,0,0]=4 6552 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,1,0,0,0,0|2,0,0]=4 6553 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 6554 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,1,0,0,0,0|2,0,0]=4 6555 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,1,0,0,0,0|2,0,0]=4 6556 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,1,0,0,0,0|2,0,0]=4 6557 B7R0.5 CC(CCN)S(C)=O Amb20668090 [1,1,0,0,0,0|2,0,0]=4 6558 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,1,0,0,0,0|2,0,0]=4 6559 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,1,0,0,0,0|2,0,0]=4 6560 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,1,0,0,0,0|2,0,0]=4 6561 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,1,0,0,0,0|1,0,1]=4 6562 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [1,1,0,0,0,0|0,0,1]=3 6563 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [1,1,0,0,0,0|1,0,0]=3 6564 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|1,0,0]=3 6565 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [1,1,0,0,0,0|0,0,0]=2 6566 B7R0.5 CCCC(Br)C(C)Br Amb22732685 [1,1,0,0,0,0|1,0,1]=4 6567 B7R0.5 CCCC(Br)C(C)N Amb27614467 [1,1,0,0,0,0|1,0,1]=4 6568 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [1,1,0,0,0,0|1,0,0]=3 6569 B7R0.5 CCCC(C)=C(C)C Amb4019545 [1,1,0,0,0,0|1,0,1]=4 6570 B7R0.5 CCCC(C)C(=N)N Amb27810844 [1,1,0,0,0,0|2,0,0]=4 6571 B7R0.5 CCCC(C)C(=N)N Amb33212650 [1,1,0,0,0,0|2,0,0]=4 6572 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [1,1,0,0,0,0|1,0,0]=3 6573 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|1,0,0]=3 6574 B7R0.5 CCCC(C)C(C)=O Amb4034597 [1,1,0,0,0,0|0,0,0]=2 6575 B7R0.5 CCCC(C)C(C)C Amb4019539 [1,1,0,0,0,0|1,0,1]=4 6576 B7R0.5 CCCC(C)C(C)N Amb18289572 [1,1,0,0,0,0|1,0,1]=4 6577 B7R0.5 CCCC(C)C(C)N Amb29083224 [1,1,0,0,0,0|1,0,1]=4 6578 B7R0.5 CCCC(C)C(C)O Amb4036337 [1,1,0,0,0,0|0,0,2]=4 6579 B7R0.5 CCCC(C)C(N)=O Amb3886535 [1,1,0,0,0,0|1,0,0]=3 6580 B7R0.5 CCCC(C)C(N)=S Amb25138492 [1,1,0,0,0,0|1,1,0]=4 6581 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [1,1,0,0,0,0|2,0,0]=4 6582 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [1,1,0,0,0,0|2,0,0]=4 6583 B7R0.5 CCCC(C)S(N)=O Amb32720511 [1,1,0,0,0,0|2,0,0]=4 6584 B7R0.5 CCCC(C)[C@@H](C)N Amb33322349 [1,1,0,0,0,0|1,0,1]=4 6585 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [1,1,0,0,0,0|0,0,2]=4 6586 B7R0.5 CCCC(C)[C@H](C)N Amb33322348 [1,1,0,0,0,0|1,0,1]=4 6587 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [1,1,0,0,0,0|0,0,2]=4 6588 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|1,0,0]=3 6589 B7R0.5 CCCC(Cl)C(C)Cl Amb25889191 [1,1,0,0,0,0|1,0,1]=4 6590 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|1,0,0]=3 6591 B7R0.5 CCCC(F)C(C)=O Amb28316211 [1,1,0,0,0,0|0,0,0]=2 6592 B7R0.5 CCCC(F)C(N)=O Amb28127390 [1,1,0,0,0,0|1,0,0]=3 6593 B7R0.5 CCCC(N)C(=N)N Amb27222841 [1,1,0,0,0,0|2,0,0]=4 6594 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|1,0,0]=3 6595 B7R0.5 CCCC(N)C(C)=O Amb27838289 [1,1,0,0,0,0|0,0,0]=2 6596 B7R0.5 CCCC(N)C(C)C Amb9031899 [1,1,0,0,0,0|1,0,1]=4 6597 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 6598 B7R0.5 CCCC(N)C(N)=O Amb9514970 [1,1,0,0,0,0|1,0,0]=3 6599 B7R0.5 CCCC(N)C(N)=S Amb28121515 [1,1,0,0,0,0|1,1,0]=4 6600 B7R0.5 CCCC(O)C(=N)N Amb27881736 [1,1,0,0,0,0|2,0,0]=4 6601 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|1,0,0]=3 6602 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|0,0,0]=2 6603 B7R0.5 CCCC(O)C(C)Br Amb27781536 [1,1,0,0,0,0|1,0,1]=4 6604 B7R0.5 CCCC(O)C(C)C Amb8513256 [1,1,0,0,0,0|1,0,1]=4 6605 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|1,0,0]=3 6606 B7R0.5 CCCC(O)N(C)C Amb28400462 [1,1,0,0,0,0|2,0,0]=4 6607 B7R0.5 CCCC(O)[C@@H](C)N Amb35618098 [1,1,0,0,0,0|1,0,1]=4 6608 B7R0.5 CCCC(O)[C@H](C)N Amb35737168 [1,1,0,0,0,0|1,0,1]=4 6609 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|1,0,0]=3 6610 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [1,1,0,0,0,0|2,0,0]=4 6611 B7R0.5 CCCN(C)C(N)=O Amb8898960 [1,1,0,0,0,0|2,0,0]=4 6612 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,1,0,0,0,0|1,0,0]=3 6613 B7R0.5 CCCN(O)C(N)=O Amb28347092 [1,1,0,0,0,0|2,0,0]=4 6614 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|1,0,0]=3 6615 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [1,1,0,0,0,0|0,0,2]=4 6616 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [1,1,0,0,0,0|0,0,2]=4 6617 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|1,0,0]=3 6618 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [1,1,0,0,0,0|0,0,2]=4 6619 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|1,0,0]=3 6620 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [1,1,0,0,0,0|0,0,0]=2 6621 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [1,1,0,0,0,0|0,0,2]=4 6622 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 6623 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 6624 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|1,0,0]=3 6625 B7R0.5 CCC[C@@H](O)[C@@H](C)N Amb28198280 [1,1,0,0,0,0|1,0,1]=4 6626 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [1,1,0,0,0,0|0,0,2]=4 6627 B7R0.5 CCC[C@@H](O)[C@H](C)N Amb27392138 [1,1,0,0,0,0|1,0,1]=4 6628 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|1,0,0]=3 6629 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|1,0,0]=3 6630 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [1,1,0,0,0,0|0,0,0]=2 6631 B7R0.5 CCC[C@H](C)[C@@H](C)N Amb27839498 [1,1,0,0,0,0|1,0,1]=4 6632 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [1,1,0,0,0,0|0,0,2]=4 6633 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|1,0,0]=3 6634 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|1,0,0]=3 6635 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|1,0,0]=3 6636 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [1,1,0,0,0,0|0,0,0]=2 6637 B7R0.5 CCC[C@H](N)C(C)C Amb27229389 [1,1,0,0,0,0|1,0,1]=4 6638 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [1,1,0,0,0,0|0,0,2]=4 6639 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [1,1,0,0,0,0|1,0,0]=3 6640 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [1,1,0,0,0,0|1,0,0]=3 6641 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [1,1,0,0,0,0|0,0,2]=4 6642 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|1,0,0]=3 6643 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|0,0,0]=2 6644 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|1,0,0]=3 6645 B7R0.5 CCC\[N+](N)=C(/C)N Amb27207661 [1,1,0,0,0,0|2,0,0]=4 6646 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [1,1,0,0,0,0|1,0,1]=4 6647 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|2,0,0]=4 6648 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|2,0,0]=4 6649 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 6650 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,1,0,0,0,0|2,0,0]=4 6651 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|2,0,0]=4 6652 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|2,0,0]=4 6653 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|2,0,0]=4 6654 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [1,1,0,0,0,0|1,0,1]=4 6655 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|2,0,0]=4 6656 B7R0.5 CCOC(C)C(C)=O Amb9666103 [1,1,0,0,0,0|1,0,0]=3 6657 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 6658 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [1,1,0,0,0,0|2,0,0]=4 6659 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [1,1,0,0,0,0|2,0,0]=4 6660 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|2,0,0]=4 6661 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [1,1,0,0,0,0|1,0,1]=4 6662 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|2,0,0]=4 6663 B7R0.5 CCSC(C)C(N)=O Amb27830179 [1,1,0,0,0,0|2,0,0]=4 6664 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [1,1,0,0,0,0|1,0,0]=3 6665 B7R0.5 CC\C=C(/Cl)C(C)=O Amb27199134 [1,1,0,0,0,0|0,0,2]=4 6666 B7R0.5 CC\C=C(\Cl)C(C)=O Amb27486079 [1,1,0,0,0,0|0,0,2]=4 6667 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|2,0,0]=4 6668 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|2,0,0]=4 6669 B7R0.5 CNCC(C)C(N)=O Amb8943991 [1,1,0,0,0,0|2,0,0]=4 6670 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|2,0,0]=4 6671 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|2,0,0]=4 6672 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|2,0,0]=4 6673 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|2,0,0]=4 6674 B7R0.5 COCC(=O)C(C)=O Amb24694271 [1,1,0,0,0,0|1,0,1]=4 6675 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [1,1,0,0,0,0|2,0,0]=4 6676 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|2,0,0]=4 6677 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|2,0,0]=4 6678 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|1,0,0]=3 6679 B7R0.5 COCC(C)C(N)=O Amb27401584 [1,1,0,0,0,0|2,0,0]=4 6680 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|2,0,0]=4 6681 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|2,0,0]=4 6682 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|2,0,0]=4 6683 B7R0.5 COCC(N)C(C)=O Amb27468401 [1,1,0,0,0,0|1,0,0]=3 6684 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|2,0,0]=4 6685 B7R0.5 COCC(N)C(N)=O Amb32693410 [1,1,0,0,0,0|2,0,0]=4 6686 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|2,0,0]=4 6687 B7R0.5 COCC(O)C(N)=O Amb28069186 [1,1,0,0,0,0|2,0,0]=4 6688 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|2,0,0]=4 6689 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|2,0,0]=4 6690 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|2,0,0]=4 6691 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|2,0,0]=4 6692 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|2,0,0]=4 6693 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|2,0,0]=4 6694 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|2,0,0]=4 6695 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|2,0,0]=4 6696 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|2,0,0]=4 6697 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [1,1,0,0,0,0|2,0,0]=4 6698 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|2,0,0]=4 6699 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|2,0,0]=4 6700 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|2,0,0]=4 6701 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|2,0,0]=4 6702 B7R0.5 CSCC(O)C(C)=O Amb25983211 [1,1,0,0,0,0|1,0,0]=3 6703 B7R0.5 CSCC(O)C(N)=O Amb27168145 [1,1,0,0,0,0|2,0,0]=4 6704 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|2,0,0]=4 6705 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|2,0,0]=4 6706 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|2,0,0]=4 6707 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [1,1,0,0,0,0|2,0,0]=4 6708 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,1,0,0,0,0|2,0,0]=4 6709 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,1,0,0,0,0|2,0,0]=4 6710 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,1,0,0,0,0|2,0,0]=4 6711 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|2,0,0]=4 6712 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|2,0,0]=4 6713 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [1,1,0,0,0,0|0,0,2]=4 6714 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [1,1,0,0,0,0|0,0,2]=4 6715 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [1,1,0,0,0,0|2,0,0]=4 6716 B7R0.5 NC(=O)C(N)CCF Amb24391278 [1,1,0,0,0,0|2,0,0]=4 6717 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,1,0,0,0,0|2,0,0]=4 6718 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,1,0,0,0,0|2,0,0]=4 6719 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,1,0,0,0,0|2,0,0]=4 6720 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,1,0,0,0,0|2,0,0]=4 6721 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,1,0,0,0,0|2,0,0]=4 6722 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,1,0,0,0,0|2,0,0]=4 6723 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,1,0,0,0,0|2,0,0]=4 6724 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,1,0,0,0,0|2,0,0]=4 6725 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,1,0,0,0,0|2,0,0]=4 6726 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,1,0,0,0,0|2,0,0]=4 6727 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,1,0,0,0,0|2,0,0]=4 6728 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,1,0,0,0,0|2,0,0]=4 6729 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,1,0,0,0,0|2,0,0]=4 6730 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,1,0,0,0,0|2,0,0]=4 6731 B7R0.5 NCCC(O)C(N)=O Amb28121985 [1,1,0,0,0,0|2,0,0]=4 6732 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,1,0,0,0,0|2,0,0]=4 6733 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,1,0,0,0,0|2,0,0]=4 6734 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,1,0,0,0,0|2,0,0]=4 6735 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,1,0,0,0,0|2,0,0]=4 6736 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [1,1,0,0,0,0|2,0,0]=4 6737 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,1,0,0,0,0|2,0,0]=4 6738 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,1,0,0,0,0|2,0,0]=4 6739 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,1,0,0,0,0|2,0,0]=4 6740 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,1,0,0,0,0|2,0,0]=4 6741 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,1,0,0,0,0|2,0,0]=4 6742 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,1,0,0,0,0|2,0,0]=4 6743 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,1,0,0,0,0|2,0,0]=4 6744 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [1,1,0,0,0,0|2,0,0]=4 6745 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,1,0,0,0,0|2,0,0]=4 6746 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,1,0,0,0,0|2,0,0]=4 6747 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,1,0,0,0,0|2,0,0]=4 6748 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,1,0,0,0,0|2,0,0]=4 6749 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,1,0,0,0,0|2,0,0]=4 6750 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,1,0,0,0,0|2,0,0]=4 6751 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,1,0,0,0,0|2,0,0]=4 6752 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,1,0,0,0,0|2,0,0]=4 6753 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 6754 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [1,1,0,0,0,0|2,0,0]=4 6755 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|2,0,0]=4 6756 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,1,0,0,0,0|2,0,0]=4 6757 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|2,0,0]=4 6758 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,1,0,0,0,0|2,0,0]=4 6759 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,1,0,0,0,0|2,0,0]=4 6760 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,1,0,0,0,0|2,0,0]=4 6761 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,1,0,0,0,0|2,0,0]=4 6762 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,1,0,0,0,0|2,0,0]=4 6763 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [1,1,0,0,0,0|2,0,0]=4 6764 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [1,1,0,0,0,0|1,0,1]=4 6765 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [1,1,0,0,0,0|0,0,1]=3 6766 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [1,1,0,0,0,0|1,0,0]=3 6767 B7R0.6 C=C(C)CCC(C)N Amb18641752 [1,1,0,0,0,0|1,0,0]=3 6768 B7R0.6 C=C(C)CCC(C)O Amb24062974 [1,1,0,0,0,0|1,0,0]=3 6769 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [1,1,0,0,0,0|1,0,1]=4 6770 B7R0.6 C=C(C)CCN(C)C Amb28187650 [1,1,0,0,0,0|2,0,0]=4 6771 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [1,1,0,0,0,0|1,0,0]=3 6772 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [1,1,0,0,0,0|1,0,0]=3 6773 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [1,1,0,0,0,0|1,0,0]=3 6774 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [1,1,0,0,0,0|1,0,0]=3 6775 B7R0.6 C=C(C)COC(C)=O Amb16187121 [1,1,0,0,0,0|1,0,1]=4 6776 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [1,1,0,0,0,0|1,0,1]=4 6777 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [1,1,0,0,0,0|0,0,2]=4 6778 B7R0.6 CC(=N)NCC(C)C Amb27865850 [1,1,0,0,0,0|2,0,0]=4 6779 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [1,1,0,0,0,0|0,0,2]=4 6780 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [1,1,0,0,0,0|0,0,2]=4 6781 B7R0.6 CC(=O)CCB(O)O Amb25095502 [1,1,0,0,0,0|2,0,0]=4 6782 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,1,0,0,0,0|1,0,1]=4 6783 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [1,1,0,0,0,0|1,0,1]=4 6784 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [1,1,0,0,0,0|0,0,1]=3 6785 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [1,1,0,0,0,0|0,0,1]=3 6786 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [1,1,0,0,0,0|0,0,0]=2 6787 B7R0.6 CC(=O)CCC(C)C Amb4605991 [1,1,0,0,0,0|0,0,0]=2 6788 B7R0.6 CC(=O)CCC(C)O Amb25829594 [1,1,0,0,0,0|0,0,0]=2 6789 B7R0.6 CC(=O)CCC(F)F Amb27413848 [1,1,0,0,0,0|1,0,0]=3 6790 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [1,1,0,0,0,0|1,0,1]=4 6791 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [1,1,0,0,0,0|1,0,1]=4 6792 B7R0.6 CC(=O)CCN(C)C Amb1129203 [1,1,0,0,0,0|1,0,0]=3 6793 B7R0.6 CC(=O)CCN(C)C Amb343601 [1,1,0,0,0,0|1,0,0]=3 6794 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [1,1,0,0,0,0|0,0,0]=2 6795 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [1,1,0,0,0,0|2,0,0]=4 6796 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [1,1,0,0,0,0|1,0,1]=4 6797 B7R0.6 CC(=O)CNC(C)C Amb28126943 [1,1,0,0,0,0|1,0,0]=3 6798 B7R0.6 CC(=O)CNC(C)C Amb32661638 [1,1,0,0,0,0|1,0,0]=3 6799 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [1,1,0,0,0,0|2,0,0]=4 6800 B7R0.6 CC(=O)COC(C)=O Amb8517567 [1,1,0,0,0,0|1,0,1]=4 6801 B7R0.6 CC(=O)COC(C)C Amb9665256 [1,1,0,0,0,0|1,0,0]=3 6802 B7R0.6 CC(=O)COC(F)F Amb27636211 [1,1,0,0,0,0|2,0,0]=4 6803 B7R0.6 CC(=O)CSC(C)C Amb22549127 [1,1,0,0,0,0|1,0,0]=3 6804 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [1,1,0,0,0,0|0,0,2]=4 6805 B7R0.6 CC(=O)NCC(C)C Amb3364211 [1,1,0,0,0,0|1,0,0]=3 6806 B7R0.6 CC(=O)NCC(C)N Amb18631377 [1,1,0,0,0,0|1,0,0]=3 6807 B7R0.6 CC(=O)NCC(C)O Amb9276316 [1,1,0,0,0,0|1,0,0]=3 6808 B7R0.6 CC(=O)NCC(Cl)Cl Amb27978268 [1,1,0,0,0,0|2,0,0]=4 6809 B7R0.6 CC(=O)NCC(F)F Amb27961410 [1,1,0,0,0,0|2,0,0]=4 6810 B7R0.6 CC(=O)NCN(C)C Amb27838840 [1,1,0,0,0,0|2,0,0]=4 6811 B7R0.6 CC(=O)NNC(C)C Amb22233621 [1,1,0,0,0,0|2,0,0]=4 6812 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [1,1,0,0,0,0|1,0,0]=3 6813 B7R0.6 CC(=O)OCC(C)O Amb24056158 [1,1,0,0,0,0|1,0,0]=3 6814 B7R0.6 CC(=O)OCC(F)F Amb10839327 [1,1,0,0,0,0|2,0,0]=4 6815 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [1,1,0,0,0,0|1,0,0]=3 6816 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [1,1,0,0,0,0|1,0,0]=3 6817 B7R0.6 CC(=O)SCC(C)O Amb27801534 [1,1,0,0,0,0|1,0,0]=3 6818 B7R0.6 CC(=O)SCC(Cl)Cl Amb4012737 [1,1,0,0,0,0|2,0,0]=4 6819 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [1,1,0,0,0,0|0,0,2]=4 6820 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [1,1,0,0,0,0|0,0,2]=4 6821 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [1,1,0,0,0,0|1,0,1]=4 6822 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,1,0,0,0,0|1,0,0]=3 6823 B7R0.6 CC(Br)CCN(C)C Amb28122888 [1,1,0,0,0,0|2,0,0]=4 6824 B7R0.6 CC(C)=CCC(C)C Amb22731329 [1,1,0,0,0,0|1,0,1]=4 6825 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [1,1,0,0,0,0|1,0,1]=4 6826 B7R0.6 CC(C)=CCC(C)N Amb27391176 [1,1,0,0,0,0|1,0,1]=4 6827 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [1,1,0,0,0,0|1,0,1]=4 6828 B7R0.6 CC(C)CCC(=N)N Amb19890005 [1,1,0,0,0,0|2,0,0]=4 6829 B7R0.6 CC(C)CCC(=N)N Amb6266403 [1,1,0,0,0,0|2,0,0]=4 6830 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [1,1,0,0,0,0|1,0,0]=3 6831 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,1,0,0,0,0|1,0,0]=3 6832 B7R0.6 CC(C)CCC(C)Br Amb8835419 [1,1,0,0,0,0|1,0,1]=4 6833 B7R0.6 CC(C)CCC(C)C Amb8513431 [1,1,0,0,0,0|1,0,1]=4 6834 B7R0.6 CC(C)CCC(C)N Amb32405136 [1,1,0,0,0,0|1,0,1]=4 6835 B7R0.6 CC(C)CCC(C)N Amb9703135 [1,1,0,0,0,0|1,0,1]=4 6836 B7R0.6 CC(C)CCC(C)O Amb9748244 [1,1,0,0,0,0|0,0,2]=4 6837 B7R0.6 CC(C)CCC(C)S Amb7784741 [1,1,0,0,0,0|0,1,1]=4 6838 B7R0.6 CC(C)CCC(N)=O Amb8997711 [1,1,0,0,0,0|1,0,0]=3 6839 B7R0.6 CC(C)CCC(N)=S Amb6248593 [1,1,0,0,0,0|1,1,0]=4 6840 B7R0.6 CC(C)CCN(C)O Amb33361677 [1,1,0,0,0,0|1,0,1]=4 6841 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [1,1,0,0,0,0|2,0,0]=4 6842 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [1,1,0,0,0,0|2,0,0]=4 6843 B7R0.6 CC(C)CCS(N)=O Amb32720359 [1,1,0,0,0,0|2,0,0]=4 6844 B7R0.6 CC(C)CC[C@@H](C)N Amb26479301 [1,1,0,0,0,0|1,0,1]=4 6845 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [1,1,0,0,0,0|0,0,2]=4 6846 B7R0.6 CC(C)CC[C@H](C)N Amb3941458 [1,1,0,0,0,0|1,0,1]=4 6847 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [1,1,0,0,0,0|0,0,2]=4 6848 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [1,1,0,0,0,0|2,0,0]=4 6849 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [1,1,0,0,0,0|2,0,0]=4 6850 B7R0.6 CC(C)CNC(N)=O Amb1151241 [1,1,0,0,0,0|2,0,0]=4 6851 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [1,1,0,0,0,0|2,0,0]=4 6852 B7R0.6 CC(C)COC(N)=O Amb4020010 [1,1,0,0,0,0|2,0,0]=4 6853 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,1,0,0,0,0|2,0,0]=4 6854 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [1,1,0,0,0,0|2,0,0]=4 6855 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,1,0,0,0,0|2,0,0]=4 6856 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,1,0,0,0,0|2,0,0]=4 6857 B7R0.6 CC(C)NCC(N)=O Amb2370772 [1,1,0,0,0,0|2,0,0]=4 6858 B7R0.6 CC(C)NCC(N)=O Amb399843 [1,1,0,0,0,0|2,0,0]=4 6859 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [1,1,0,0,0,0|2,0,0]=4 6860 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,1,0,0,0,0|2,0,0]=4 6861 B7R0.6 CC(C)OCC(N)=O Amb26515707 [1,1,0,0,0,0|2,0,0]=4 6862 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,1,0,0,0,0|2,0,0]=4 6863 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,1,0,0,0,0|1,0,0]=3 6864 B7R0.6 CC(Cl)CCC(C)Cl Amb27263593 [1,1,0,0,0,0|1,0,1]=4 6865 B7R0.6 CC(Cl)CCS(=O)Cl Amb32720414 [1,1,0,0,0,0|2,0,0]=4 6866 B7R0.6 CC(Cl)CCS(=O)[O-] Amb32755731 [1,1,0,0,0,0|2,0,0]=4 6867 B7R0.6 CC(Cl)CCS(N)=O Amb32720415 [1,1,0,0,0,0|2,0,0]=4 6868 B7R0.6 CC(F)CCS(=O)Cl Amb32720694 [1,1,0,0,0,0|2,0,0]=4 6869 B7R0.6 CC(F)CCS(=O)[O-] Amb32754854 [1,1,0,0,0,0|2,0,0]=4 6870 B7R0.6 CC(F)CCS(N)=O Amb32720695 [1,1,0,0,0,0|2,0,0]=4 6871 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,1,0,0,0,0|1,0,0]=3 6872 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,1,0,0,0,0|1,0,0]=3 6873 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,1,0,0,0,0|1,0,0]=3 6874 B7R0.6 CC(N)CCC(C)N Amb27251969 [1,1,0,0,0,0|1,0,1]=4 6875 B7R0.6 CC(N)CCC(C)O Amb18641930 [1,1,0,0,0,0|0,0,2]=4 6876 B7R0.6 CC(N)CCN(C)C Amb7969829 [1,1,0,0,0,0|2,0,0]=4 6877 B7R0.6 CC(N)CCN(C)C Amb9711596 [1,1,0,0,0,0|2,0,0]=4 6878 B7R0.6 CC(N)CCS(=O)O Amb27839082 [1,1,0,0,0,0|2,0,0]=4 6879 B7R0.6 CC(N)CCS(C)=O Amb19337158 [1,1,0,0,0,0|1,0,0]=3 6880 B7R0.6 CC(N)CCS(C)=O Amb22059582 [1,1,0,0,0,0|1,0,0]=3 6881 B7R0.6 CC(N)CC[N+](=O)[O-] Amb33745572 [1,1,0,0,0,0|2,0,0]=4 6882 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [1,1,0,0,0,0|2,0,0]=4 6883 B7R0.6 CC(N)CNC(N)=O Amb18202688 [1,1,0,0,0,0|2,0,0]=4 6884 B7R0.6 CC(N)COC(N)=O Amb29849466 [1,1,0,0,0,0|2,0,0]=4 6885 B7R0.6 CC(N)SCC(=O)O Amb27401691 [1,1,0,0,0,0|2,0,0]=4 6886 B7R0.6 CC(O)CCC(=N)N Amb29849256 [1,1,0,0,0,0|2,0,0]=4 6887 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,1,0,0,0,0|1,0,0]=3 6888 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [1,1,0,0,0,0|1,0,0]=3 6889 B7R0.6 CC(O)CCC(C)O Amb2688714 [1,1,0,0,0,0|0,0,2]=4 6890 B7R0.6 CC(O)CCC(N)=S Amb28078352 [1,1,0,0,0,0|1,1,0]=4 6891 B7R0.6 CC(O)CCN(C)C Amb26489582 [1,1,0,0,0,0|2,0,0]=4 6892 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [1,1,0,0,0,0|2,0,0]=4 6893 B7R0.6 CC(O)COC(N)=O Amb26359577 [1,1,0,0,0,0|2,0,0]=4 6894 B7R0.6 CC(O)COS(C)=O Amb27982299 [1,1,0,0,0,0|2,0,0]=4 6895 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,1,0,0,0,0|1,0,0]=3 6896 B7R0.6 CC(S)CCC(N)=O Amb28399630 [1,1,0,0,0,0|1,0,0]=3 6897 B7R0.6 CC(S)CCN(C)C Amb32788207 [1,1,0,0,0,0|2,0,0]=4 6898 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [1,1,0,0,0,0|2,0,0]=4 6899 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [1,1,0,0,0,0|2,0,0]=4 6900 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,1,0,0,0,0|2,0,0]=4 6901 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,1,0,0,0,0|2,0,0]=4 6902 B7R0.6 CN(C)CCC(N)=O Amb17231825 [1,1,0,0,0,0|2,0,0]=4 6903 B7R0.6 CN(C)CCS(C)=O Amb27811384 [1,1,0,0,0,0|2,0,0]=4 6904 B7R0.6 CN(N)CCC(=O)O Amb2698078 [1,1,0,0,0,0|2,0,0]=4 6905 B7R0.6 CN(O)CCC(N)=O Amb27390605 [1,1,0,0,0,0|2,0,0]=4 6906 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [1,1,0,0,0,0|2,0,0]=4 6907 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [1,1,0,0,0,0|2,0,0]=4 6908 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,1,0,0,0,0|1,0,0]=3 6909 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,1,0,0,0,0|1,0,0]=3 6910 B7R0.6 C[C@@H](N)CCN(C)C Amb28126846 [1,1,0,0,0,0|2,0,0]=4 6911 B7R0.6 C[C@@H](N)CC[N+](=O)[O-] Amb33731289 [1,1,0,0,0,0|2,0,0]=4 6912 B7R0.6 C[C@@H](O)CCN(C)C Amb33272289 [1,1,0,0,0,0|2,0,0]=4 6913 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [1,1,0,0,0,0|0,0,2]=4 6914 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [1,1,0,0,0,0|2,0,0]=4 6915 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,1,0,0,0,0|1,0,0]=3 6916 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,1,0,0,0,0|1,0,0]=3 6917 B7R0.6 C[C@H](N)CCN(C)C Amb26640371 [1,1,0,0,0,0|2,0,0]=4 6918 B7R0.6 C[C@H](N)CC[C@H](C)N Amb27838291 [1,1,0,0,0,0|1,0,1]=4 6919 B7R0.6 C[C@H](N)CC[N+](=O)[O-] Amb33729333 [1,1,0,0,0,0|2,0,0]=4 6920 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,1,0,0,0,0|1,0,0]=3 6921 B7R0.6 C[C@H](O)CCN(C)C Amb33272277 [1,1,0,0,0,0|2,0,0]=4 6922 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [1,1,0,0,0,0|0,0,2]=4 6923 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [1,1,0,0,0,0|0,0,2]=4 6924 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,1,0,0,0,0|1,0,0]=3 6925 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,1,0,0,0,0|2,0,0]=4 6926 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [1,1,0,0,0,0|2,0,0]=4 6927 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [1,1,0,0,0,0|2,0,0]=4 6928 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [1,1,0,0,0,0|2,0,0]=4 6929 B7R0.6 NC(=O)CCC(O)O Amb27254204 [1,1,0,0,0,0|2,0,0]=4 6930 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [1,1,0,0,0,0|2,0,0]=4 6931 B7R0.6 O=C(O)CCC(F)F Amb20623135 [1,1,0,0,0,0|2,0,0]=4 6932 B7R0.8 CCCCC(C)(Br)Br Amb15692624 [1,1,0,0,0,0|1,0,1]=4 6933 B7R0.8 CCCCC(C)(C)Br Amb24401418 [1,1,0,0,0,0|1,0,1]=4 6934 B7R0.8 CCCCC(C)(C)C Amb22228234 [1,1,0,0,0,0|1,0,1]=4 6935 B7R0.8 CCCCC(C)(C)N Amb18993512 [1,1,0,0,0,0|1,0,1]=4 6936 B7R0.8 CCCCC(C)(C)O Amb8513443 [1,1,0,0,0,0|0,0,2]=4 6937 B7R0.8 CCCCC(C)(C)S Amb27397079 [1,1,0,0,0,0|0,1,1]=4 6938 B7R0.8 CCCCP(=O)(Cl)Cl Amb8515452 [1,1,0,0,0,0|2,0,0]=4 6939 B7R0.8 CCCCP(=O)(O)O Amb22053921 [1,1,0,0,0,0|2,0,0]=4 6940 B7R0.8 CCCCS(=O)(=O)Cl Amb3939750 [1,1,0,0,0,0|2,0,0]=4 6941 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [1,1,0,0,0,0|2,0,0]=4 6942 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [1,1,0,0,0,0|2,0,0]=4 6943 B7R0.8 CCCCS(=O)(=O)[O-] Amb8514323 [1,1,0,0,0,0|2,0,0]=4 6944 B7R0.8 CCCCS(=O)(=O)[O-] Amb9871422 [1,1,0,0,0,0|2,0,0]=4 6945 B7R0.8 CCCCS(N)(=O)=O Amb1132715 [1,1,0,0,0,0|2,0,0]=4 6946 B7R0.8 CCCC[N+](C)(C)C Amb8384382 [1,1,0,0,0,0|2,0,0]=4 6947 B7R0.8 CCCC[Si](C)(C)C Amb22360219 [1,1,0,0,0,0|1,1,0]=4 6948 B7R0.8 CCCC[Si](C)(C)Cl Amb2685633 [1,1,0,0,0,0|1,1,0]=4 6949 B7R0.8 CCCC[Si](C)(Cl)Cl Amb19893670 [1,1,0,0,0,0|1,1,0]=4 6950 B7R0.8 CCCNS(C)(=N)=O Amb35687835 [1,1,0,0,0,0|2,0,0]=4 6951 B7R0.8 CCCNS(C)(=N)=O Amb35789640 [1,1,0,0,0,0|2,0,0]=4 6952 B7R0.8 CCCOP(C)(=O)O Amb24553958 [1,1,0,0,0,0|2,0,0]=4 6953 B7R0.8 CCCOS(C)(=O)=O Amb22388704 [1,1,0,0,0,0|2,0,0]=4 6954 B7R0.8 CCCSS(C)(=O)=O Amb17619610 [1,1,0,0,0,0|2,0,0]=4 6955 B7R0.8 CNCCS(C)(=O)=O Amb33535362 [1,1,0,0,0,0|2,0,0]=4 6956 B7R0.8 CNCCS(C)(=O)=O Amb33801511 [1,1,0,0,0,0|2,0,0]=4 6957 B7R0.8 COCCS(C)(=N)=O Amb33457324 [1,1,0,0,0,0|2,0,0]=4 6958 B7R0.8 COCCS(C)(=N)=O Amb33483244 [1,1,0,0,0,0|2,0,0]=4 6959 B7R0.8 COCC[S@](C)(=N)=O Amb33744012 [1,1,0,0,0,0|2,0,0]=4 6960 B7R0.8 CP(=O)(O)CCCN Amb634789 [1,1,0,0,0,0|2,0,0]=4 6961 B7R0.8 CP(C)(=O)CCCCl Amb27947970 [1,1,0,0,0,0|2,0,0]=4 6962 B7R0.8 CP(C)(=O)CCCN Amb24481153 [1,1,0,0,0,0|2,0,0]=4 6963 B7R0.8 CP(C)(=O)CCCN Amb33620909 [1,1,0,0,0,0|2,0,0]=4 6964 B7R0.8 CS(=N)(=O)CCCO Amb35788140 [1,1,0,0,0,0|2,0,0]=4 6965 B7R0.8 CS(=O)(=O)CCCBr Amb18320185 [1,1,0,0,0,0|2,0,0]=4 6966 B7R0.8 CS(=O)(=O)CCCCl Amb18034011 [1,1,0,0,0,0|2,0,0]=4 6967 B7R0.8 CS(=O)(=O)CCCI Amb20623053 [1,1,0,0,0,0|2,0,0]=4 6968 B7R0.8 CS(=O)(=O)CCCN Amb10609368 [1,1,0,0,0,0|2,0,0]=4 6969 B7R0.8 CS(=O)(=O)CCCN Amb6718802 [1,1,0,0,0,0|2,0,0]=4 6970 B7R0.8 CS(=O)(=O)CCCO Amb10608209 [1,1,0,0,0,0|2,0,0]=4 6971 B7R0.8 CS(=O)(=O)CCCS Amb25092985 [1,1,0,0,0,0|2,0,0]=4 6972 B7R0.8 CS(=O)(=O)CCC[NH3+] Amb13883038 [1,1,0,0,0,0|2,0,0]=4 6973 B7R0.8 CSCCS(C)(=O)=O Amb28049319 [1,1,0,0,0,0|2,0,0]=4 6974 B7R0.1 BrCCCCCCBr Amb2686735 [1,1,0,0,0,0|1,0,1]=4 6975 B7R0.1 C#CCCCCC=C Amb22367006 [1,1,0,0,0,0|0,0,2]=4 6976 B7R0.1 C#CCCCCCBr Amb26620641 [1,1,0,0,0,0|0,0,2]=4 6977 B7R0.1 C#CCCCCCC Amb3940499 [1,1,0,0,0,0|0,0,2]=4 6978 B7R0.1 C#CCCCCCCl Amb24586504 [1,1,0,0,0,0|0,0,2]=4 6979 B7R0.1 C#CCCCCCF Amb24538507 [1,1,0,0,0,0|0,0,2]=4 6980 B7R0.1 C#CCCCCCN Amb33544857 [1,1,0,0,0,0|0,0,2]=4 6981 B7R0.1 C#CCCCCCO Amb10603074 [1,1,0,0,0,0|0,0,2]=4 6982 B7R0.1 C#CCCCCOC Amb25191860 [1,1,0,0,0,0|0,0,2]=4 6983 B7R0.1 C#CCCCCSC Amb33197631 [1,1,0,0,0,0|0,0,2]=4 6984 B7R0.1 C#CCCCNC=O Amb27838352 [1,1,0,0,0,0|0,0,2]=4 6985 B7R0.1 C#CCCCSCC Amb25960035 [1,1,0,0,0,0|0,0,2]=4 6986 B7R0.1 C#CCCSCCC Amb27410296 [1,1,0,0,0,0|0,0,2]=4 6987 B7R0.1 C#CCOCCC=O Amb27877538 [1,1,0,0,0,0|0,0,2]=4 6988 B7R0.1 C#CCSCCCC Amb26066454 [1,1,0,0,0,0|0,0,2]=4 6989 B7R0.1 C=C=CCCCC=O Amb28144035 [1,1,0,0,0,0|0,0,2]=4 6990 B7R0.1 C=C=CCCCCCl Amb27986085 [1,1,0,0,0,0|1,0,1]=4 6991 B7R0.1 C=C=CCCCCO Amb17593159 [1,1,0,0,0,0|1,0,1]=4 6992 B7R0.1 C=CC#CCCCC Amb17673844 [1,1,0,0,0,0|0,0,2]=4 6993 B7R0.1 C=CCCCC#CC Amb28048990 [1,1,0,0,0,0|0,0,2]=4 6994 B7R0.1 C=CCCCCC=O Amb9785164 [1,1,0,0,0,0|0,0,1]=3 6995 B7R0.1 C=CCCCCCBr Amb16234121 [1,1,0,0,0,0|0,0,1]=3 6996 B7R0.1 C=CCCCCCC Amb3940500 [1,1,0,0,0,0|0,0,1]=3 6997 B7R0.1 C=CCCCCCCl Amb6298878 [1,1,0,0,0,0|0,0,1]=3 6998 B7R0.1 C=CCCCCCI Amb24483139 [1,1,0,0,0,0|0,0,1]=3 6999 B7R0.1 C=CCCCCCN Amb18641754 [1,1,0,0,0,0|0,0,1]=3 7000 B7R0.1 C=CCCCCCO Amb4017321 [1,1,0,0,0,0|0,0,1]=3 7001 B7R0.1 C=CCCCCNC Amb19886674 [1,1,0,0,0,0|0,0,1]=3 7002 B7R0.1 C=CCCCCNC Amb22495849 [1,1,0,0,0,0|0,0,1]=3 7003 B7R0.1 C=CCCCNCC Amb28461005 [1,1,0,0,0,0|0,0,1]=3 7004 B7R0.1 C=CCCCNCC Amb32988644 [1,1,0,0,0,0|0,0,1]=3 7005 B7R0.1 C=CCCCOCBr Amb2696014 [1,1,0,0,0,0|1,0,1]=4 7006 B7R0.1 C=CCCCOCCl Amb2694973 [1,1,0,0,0,0|1,0,1]=4 7007 B7R0.1 C=CCCCSCC Amb27600986 [1,1,0,0,0,0|0,0,1]=3 7008 B7R0.1 C=CCCC\C=C\C Amb24700388 [1,1,0,0,0,0|0,0,2]=4 7009 B7R0.1 C=CCCNCCC Amb27796644 [1,1,0,0,0,0|0,0,1]=3 7010 B7R0.1 C=CCCOCCBr Amb9208733 [1,1,0,0,0,0|1,0,1]=4 7011 B7R0.1 C=CCCOCCN Amb22059113 [1,1,0,0,0,0|1,0,1]=4 7012 B7R0.1 C=CCCOCCO Amb26613595 [1,1,0,0,0,0|1,0,1]=4 7013 B7R0.1 C=CCCOCOC Amb27664092 [1,1,0,0,0,0|1,0,1]=4 7014 B7R0.1 C=CCCSCCC Amb27806215 [1,1,0,0,0,0|0,0,1]=3 7015 B7R0.1 C=CCCSCCN Amb25889820 [1,1,0,0,0,0|1,0,1]=4 7016 B7R0.1 C=CCCSCCO Amb28283935 [1,1,0,0,0,0|1,0,1]=4 7017 B7R0.1 C=CCNCCCCl Amb27655586 [1,1,0,0,0,0|1,0,1]=4 7018 B7R0.1 C=CCNCCCI Amb28256753 [1,1,0,0,0,0|1,0,1]=4 7019 B7R0.1 C=CCNCCCN Amb17315274 [1,1,0,0,0,0|1,0,1]=4 7020 B7R0.1 C=CCNCCCO Amb17308751 [1,1,0,0,0,0|1,0,1]=4 7021 B7R0.1 C=CCNCCOC Amb6706505 [1,1,0,0,0,0|1,0,1]=4 7022 B7R0.1 C=CCNOCCC Amb28077176 [1,1,0,0,0,0|1,0,1]=4 7023 B7R0.1 C=CCOCCC=O Amb26516382 [1,1,0,0,0,0|0,0,2]=4 7024 B7R0.1 C=CCOCCCBr Amb8828250 [1,1,0,0,0,0|1,0,1]=4 7025 B7R0.1 C=CCOCCCC Amb3940494 [1,1,0,0,0,0|0,0,1]=3 7026 B7R0.1 C=CCOCCCCl Amb9208730 [1,1,0,0,0,0|1,0,1]=4 7027 B7R0.1 C=CCOCCCN Amb25190295 [1,1,0,0,0,0|1,0,1]=4 7028 B7R0.1 C=CCOCCCO Amb25097051 [1,1,0,0,0,0|1,0,1]=4 7029 B7R0.1 C=CCOCCSC Amb27983164 [1,1,0,0,0,0|1,0,1]=4 7030 B7R0.1 C=CCSCCCBr Amb27228626 [1,1,0,0,0,0|1,0,1]=4 7031 B7R0.1 C=CCSCCCN Amb17500693 [1,1,0,0,0,0|1,0,1]=4 7032 B7R0.1 C=CCSCCCS Amb28293414 [1,1,0,0,0,0|1,0,1]=4 7033 B7R0.1 C=CCSCCNC Amb27594788 [1,1,0,0,0,0|1,0,1]=4 7034 B7R0.1 C=CCSCCOC Amb17799422 [1,1,0,0,0,0|1,0,1]=4 7035 B7R0.1 C=CCSCCSC Amb27594231 [1,1,0,0,0,0|1,0,1]=4 7036 B7R0.1 C=CCSSCCC Amb8393142 [1,1,0,0,0,0|1,0,1]=4 7037 B7R0.1 C=CC\C=C\CCC Amb4035888 [1,1,0,0,0,0|0,0,2]=4 7038 B7R0.1 C=COCCCCO Amb8517109 [1,1,0,0,0,0|1,0,1]=4 7039 B7R0.1 C=COCCCOC Amb28063047 [1,1,0,0,0,0|1,0,1]=4 7040 B7R0.1 C=COCCSCC Amb25720739 [1,1,0,0,0,0|1,0,1]=4 7041 B7R0.1 C=CSCCCCC Amb27666051 [1,1,0,0,0,0|0,0,1]=3 7042 B7R0.1 C=C\C=C\CCCC Amb22729011 [1,1,0,0,0,0|0,0,2]=4 7043 B7R0.1 CC#CCCCC=O Amb17593142 [1,1,0,0,0,0|0,0,1]=3 7044 B7R0.1 CC#CCCCCBr Amb27459340 [1,1,0,0,0,0|0,0,2]=4 7045 B7R0.1 CC#CCCCCC Amb9134714 [1,1,0,0,0,0|0,0,1]=3 7046 B7R0.1 CC#CCCCCO Amb17593158 [1,1,0,0,0,0|0,0,2]=4 7047 B7R0.1 CC=C=CCCCC Amb28284500 [1,1,0,0,0,0|0,0,1]=3 7048 B7R0.1 CCC#CCCCC Amb4017968 [1,1,0,0,0,0|0,0,2]=4 7049 B7R0.1 CCC#CCCNC Amb27838421 [1,1,0,0,0,0|1,0,1]=4 7050 B7R0.1 CCCC#CCCC Amb8514642 [1,1,0,0,0,0|0,0,2]=4 7051 B7R0.1 CCCC#CCNC Amb27815061 [1,1,0,0,0,0|1,0,1]=4 7052 B7R0.1 CCCC=C=CCN Amb27838307 [1,1,0,0,0,0|0,0,2]=4 7053 B7R0.1 CCCCC#CC=O Amb17593134 [1,1,0,0,0,0|0,0,1]=3 7054 B7R0.1 CCCCC#CCBr Amb17670640 [1,1,0,0,0,0|0,0,2]=4 7055 B7R0.1 CCCCCC#CI Amb17940367 [1,1,0,0,0,0|0,0,2]=4 7056 B7R0.1 CCCCCCC#N Amb7764659 [1,1,0,0,0,0|0,0,2]=4 7057 B7R0.1 CCCCCCC=O Amb3939948 [1,1,0,0,0,0|0,0,0]=2 7058 B7R0.1 CCCCCCCBr Amb3941482 [1,1,0,0,0,0|0,0,1]=3 7059 B7R0.1 CCCCCCCC Amb8513274 [1,1,0,0,0,0|0,0,1]=3 7060 B7R0.1 CCCCCCCCl Amb6608669 [1,1,0,0,0,0|0,0,1]=3 7061 B7R0.1 CCCCCCCI Amb3940283 [1,1,0,0,0,0|0,0,1]=3 7062 B7R0.1 CCCCCCCN Amb3940125 [1,1,0,0,0,0|0,0,1]=3 7063 B7R0.1 CCCCCCCO Amb6608791 [1,1,0,0,0,0|0,0,1]=3 7064 B7R0.1 CCCCCCC[Mg+] Amb22351260 [1,1,0,0,0,0|0,0,1]=3 7065 B7R0.1 CCCCCCNC Amb4037010 [1,1,0,0,0,0|0,0,1]=3 7066 B7R0.1 CCCCCCNN Amb7786617 [1,1,0,0,0,0|1,0,1]=4 7067 B7R0.1 CCCCCCNO Amb24591654 [1,1,0,0,0,0|0,0,2]=4 7068 B7R0.1 CCCCCCNO Amb32687464 [1,1,0,0,0,0|0,0,2]=4 7069 B7R0.1 CCCCCCON Amb18641933 [1,1,0,0,0,0|0,0,2]=4 7070 B7R0.1 CCCCCCSC Amb22359692 [1,1,0,0,0,0|0,0,1]=3 7071 B7R0.1 CCCCCC[Mg]Br Amb22337740 [1,1,0,0,0,0|1,0,1]=4 7072 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [1,1,0,0,0,0|1,0,1]=4 7073 B7R0.1 CCCCCN=C=O Amb3939207 [1,1,0,0,0,0|0,0,1]=3 7074 B7R0.1 CCCCCN=C=S Amb6565433 [1,1,0,0,0,0|0,1,1]=4 7075 B7R0.1 CCCCCN=[N+]=[N-] Amb17939435 [1,1,0,0,0,0|2,0,0]=4 7076 B7R0.1 CCCCCNC#N Amb28288523 [1,1,0,0,0,0|1,0,1]=4 7077 B7R0.1 CCCCCNCC Amb6243353 [1,1,0,0,0,0|0,0,1]=3 7078 B7R0.1 CCCCCNCN Amb28388761 [1,1,0,0,0,0|1,0,0]=3 7079 B7R0.1 CCCCCNCO Amb28133981 [1,1,0,0,0,0|1,0,0]=3 7080 B7R0.1 CCCCCOCC Amb22733705 [1,1,0,0,0,0|0,0,1]=3 7081 B7R0.1 CCCCCON=O Amb17939401 [1,1,0,0,0,0|1,0,0]=3 7082 B7R0.1 CCCCCSSC Amb25679654 [1,1,0,0,0,0|1,0,0]=3 7083 B7R0.1 CCCCC\C=C\Br Amb27985859 [1,1,0,0,0,0|0,0,1]=3 7084 B7R0.1 CCCCC\C=C\Cl Amb28384465 [1,1,0,0,0,0|0,0,1]=3 7085 B7R0.1 CCCCC\C=C\I Amb22641605 [1,1,0,0,0,0|0,0,1]=3 7086 B7R0.1 CCCCC\C=N\N Amb27837897 [1,1,0,0,0,0|1,0,0]=3 7087 B7R0.1 CCCCC\C=N\O Amb27477089 [1,1,0,0,0,0|0,0,1]=3 7088 B7R0.1 CCCCNCC#N Amb3997177 [1,1,0,0,0,0|1,0,1]=4 7089 B7R0.1 CCCCNCCC Amb3939261 [1,1,0,0,0,0|0,0,1]=3 7090 B7R0.1 CCCCNCCF Amb27597327 [1,1,0,0,0,0|1,0,1]=4 7091 B7R0.1 CCCCNCCN Amb4020675 [1,1,0,0,0,0|1,0,1]=4 7092 B7R0.1 CCCCNCCO Amb2685641 [1,1,0,0,0,0|0,0,2]=4 7093 B7R0.1 CCCCNCCS Amb22232390 [1,1,0,0,0,0|0,1,1]=4 7094 B7R0.1 CCCCOCC=O Amb26515709 [1,1,0,0,0,0|0,0,0]=2 7095 B7R0.1 CCCCOCCBr Amb2720768 [1,1,0,0,0,0|1,0,1]=4 7096 B7R0.1 CCCCOCCCl Amb8873731 [1,1,0,0,0,0|1,0,1]=4 7097 B7R0.1 CCCCOCCI Amb24474438 [1,1,0,0,0,0|1,0,1]=4 7098 B7R0.1 CCCCOCCN Amb8895131 [1,1,0,0,0,0|1,0,1]=4 7099 B7R0.1 CCCCOCCO Amb3939290 [1,1,0,0,0,0|0,0,2]=4 7100 B7R0.1 CCCCO\C=C/Cl Amb27777227 [1,1,0,0,0,0|1,0,1]=4 7101 B7R0.1 CCCCO\C=C\Br Amb27858551 [1,1,0,0,0,0|1,0,1]=4 7102 B7R0.1 CCCCPCCN Amb27831609 [1,1,0,0,0,0|1,0,1]=4 7103 B7R0.1 CCCCSCC#N Amb6760935 [1,1,0,0,0,0|1,0,1]=4 7104 B7R0.1 CCCCSCC=O Amb28189740 [1,1,0,0,0,0|0,0,0]=2 7105 B7R0.1 CCCCSCCC Amb4017586 [1,1,0,0,0,0|0,0,1]=3 7106 B7R0.1 CCCCSCCCl Amb9479748 [1,1,0,0,0,0|1,0,1]=4 7107 B7R0.1 CCCCSCCN Amb2209242 [1,1,0,0,0,0|1,0,1]=4 7108 B7R0.1 CCCCSCCO Amb1032995 [1,1,0,0,0,0|0,0,2]=4 7109 B7R0.1 CCCCSSCC Amb26515761 [1,1,0,0,0,0|1,0,1]=4 7110 B7R0.1 CCCCS\C=C/Cl Amb28048891 [1,1,0,0,0,0|1,0,1]=4 7111 B7R0.1 CCCC\C=C\C#N Amb18641342 [1,1,0,0,0,0|0,0,2]=4 7112 B7R0.1 CCCC\C=C\C=O Amb2720528 [1,1,0,0,0,0|0,0,1]=3 7113 B7R0.1 CCCC\C=C\CN Amb25175053 [1,1,0,0,0,0|0,0,1]=3 7114 B7R0.1 CCCC\C=C\CO Amb8514979 [1,1,0,0,0,0|0,0,1]=3 7115 B7R0.1 CCCC\C=N\OC Amb27969362 [1,1,0,0,0,0|1,0,1]=4 7116 B7R0.1 CCCC\N=C\CCl Amb28141548 [1,1,0,0,0,0|1,0,0]=3 7117 B7R0.1 CCCNCCC#N Amb2690405 [1,1,0,0,0,0|1,0,1]=4 7118 B7R0.1 CCCNCCC=O Amb27838403 [1,1,0,0,0,0|0,0,0]=2 7119 B7R0.1 CCCNCCCCl Amb27593175 [1,1,0,0,0,0|1,0,1]=4 7120 B7R0.1 CCCNCCCN Amb8515464 [1,1,0,0,0,0|1,0,1]=4 7121 B7R0.1 CCCNCCCO Amb6733725 [1,1,0,0,0,0|0,0,2]=4 7122 B7R0.1 CCCNCCSC Amb27162672 [1,1,0,0,0,0|1,0,0]=3 7123 B7R0.1 CCCNC\C=C\Cl Amb25340126 [1,1,0,0,0,0|1,0,1]=4 7124 B7R0.1 CCCNNCCC Amb27818086 [1,1,0,0,0,0|1,0,1]=4 7125 B7R0.1 CCCNOCCC Amb27792152 [1,1,0,0,0,0|1,0,1]=4 7126 B7R0.1 CCCOCCCBr Amb8874784 [1,1,0,0,0,0|1,0,1]=4 7127 B7R0.1 CCCOCCCCl Amb8874785 [1,1,0,0,0,0|1,0,1]=4 7128 B7R0.1 CCCOCCCN Amb3940017 [1,1,0,0,0,0|1,0,1]=4 7129 B7R0.1 CCCOCCCO Amb19962968 [1,1,0,0,0,0|0,0,2]=4 7130 B7R0.1 CCCOCCCS Amb27212962 [1,1,0,0,0,0|0,1,1]=4 7131 B7R0.1 CCCOC\C=C/Cl Amb27839016 [1,1,0,0,0,0|1,0,1]=4 7132 B7R0.1 CCCSCCC#N Amb6680722 [1,1,0,0,0,0|1,0,1]=4 7133 B7R0.1 CCCSCCCN Amb6680225 [1,1,0,0,0,0|1,0,1]=4 7134 B7R0.1 CCCSCCCO Amb9370793 [1,1,0,0,0,0|0,0,2]=4 7135 B7R0.1 CCCSCCON Amb27262198 [1,1,0,0,0,0|2,0,0]=4 7136 B7R0.1 CCCSCCSC Amb27837913 [1,1,0,0,0,0|1,0,0]=3 7137 B7R0.1 CCC[SiH2]CCCCl Amb28208530 [1,1,0,0,0,0|0,1,1]=4 7138 B7R0.1 CCC\C=C/CCC Amb27838401 [1,1,0,0,0,0|0,0,2]=4 7139 B7R0.1 CCC\C=C\CC=O Amb32954538 [1,1,0,0,0,0|0,0,1]=3 7140 B7R0.1 CCC\C=C\CCC Amb9134769 [1,1,0,0,0,0|0,0,2]=4 7141 B7R0.1 CCC\C=C\CNC Amb33172653 [1,1,0,0,0,0|1,0,1]=4 7142 B7R0.1 CCNCCCCO Amb3940019 [1,1,0,0,0,0|0,0,2]=4 7143 B7R0.1 CCNCCCOC Amb6730311 [1,1,0,0,0,0|1,0,0]=3 7144 B7R0.1 CCNCCNCC Amb9885560 [1,1,0,0,0,0|1,0,1]=4 7145 B7R0.1 CCNCCOCC Amb33529222 [1,1,0,0,0,0|1,0,1]=4 7146 B7R0.1 CCNCC\C=C\Cl Amb27400178 [1,1,0,0,0,0|1,0,1]=4 7147 B7R0.1 CCNC\C=C/CO Amb28072875 [1,1,0,0,0,0|1,0,1]=4 7148 B7R0.1 CCNC\C=C\CN Amb27972499 [1,1,0,0,0,0|1,0,1]=4 7149 B7R0.1 CCNOCCOC Amb28315578 [1,1,0,0,0,0|2,0,0]=4 7150 B7R0.1 CCOCCCC#N Amb6260880 [1,1,0,0,0,0|1,0,1]=4 7151 B7R0.1 CCOCCCC=O Amb27236777 [1,1,0,0,0,0|0,0,0]=2 7152 B7R0.1 CCOCCCCBr Amb8855444 [1,1,0,0,0,0|1,0,1]=4 7153 B7R0.1 CCOCCCCCl Amb20242741 [1,1,0,0,0,0|1,0,1]=4 7154 B7R0.1 CCOCCCCN Amb6249686 [1,1,0,0,0,0|1,0,1]=4 7155 B7R0.1 CCOCCCCO Amb19148112 [1,1,0,0,0,0|0,0,2]=4 7156 B7R0.1 CCOCCCON Amb18061683 [1,1,0,0,0,0|2,0,0]=4 7157 B7R0.1 CCOCCN=C=O Amb27628260 [1,1,0,0,0,0|1,0,1]=4 7158 B7R0.1 CCOCCOCC Amb8517552 [1,1,0,0,0,0|1,0,1]=4 7159 B7R0.1 CCOCC\C=N\N Amb27982628 [1,1,0,0,0,0|2,0,0]=4 7160 B7R0.1 CCOC\C=C\CO Amb25221278 [1,1,0,0,0,0|1,0,1]=4 7161 B7R0.1 CCOC\C=C\CS Amb28254606 [1,1,0,0,0,0|1,0,1]=4 7162 B7R0.1 CCSCCCC#N Amb6680685 [1,1,0,0,0,0|1,0,1]=4 7163 B7R0.1 CCSCCCC=O Amb33323662 [1,1,0,0,0,0|0,0,0]=2 7164 B7R0.1 CCSCCCCBr Amb9304999 [1,1,0,0,0,0|1,0,1]=4 7165 B7R0.1 CCSCCCCCl Amb18796695 [1,1,0,0,0,0|1,0,1]=4 7166 B7R0.1 CCSCCCCN Amb9391471 [1,1,0,0,0,0|1,0,1]=4 7167 B7R0.1 CCSCCCCO Amb9370799 [1,1,0,0,0,0|0,0,2]=4 7168 B7R0.1 CCSCCCCS Amb27223548 [1,1,0,0,0,0|0,1,1]=4 7169 B7R0.1 CCSCCCNC Amb25044529 [1,1,0,0,0,0|1,0,0]=3 7170 B7R0.1 CCSCCCNO Amb27778147 [1,1,0,0,0,0|1,0,1]=4 7171 B7R0.1 CCSCCCON Amb26975230 [1,1,0,0,0,0|2,0,0]=4 7172 B7R0.1 CCSCCN=C=O Amb25110059 [1,1,0,0,0,0|1,0,1]=4 7173 B7R0.1 CCSCCNC=O Amb27752341 [1,1,0,0,0,0|1,0,0]=3 7174 B7R0.1 CCSCCSCC Amb4017493 [1,1,0,0,0,0|1,0,1]=4 7175 B7R0.1 CCSC\C=C\C=O Amb33323727 [1,1,0,0,0,0|0,0,2]=4 7176 B7R0.1 CCSC\C=C\CN Amb33474425 [1,1,0,0,0,0|1,0,1]=4 7177 B7R0.1 CCSC\C=C\CO Amb33475304 [1,1,0,0,0,0|1,0,1]=4 7178 B7R0.1 CC\C=C/CCCO Amb22053865 [1,1,0,0,0,0|1,0,1]=4 7179 B7R0.1 CC\C=C\CCC=O Amb27390797 [1,1,0,0,0,0|0,0,1]=3 7180 B7R0.1 CC\C=C\CCCBr Amb27232700 [1,1,0,0,0,0|1,0,1]=4 7181 B7R0.1 CC\C=C\CCCC Amb19930202 [1,1,0,0,0,0|0,0,1]=3 7182 B7R0.1 CC\C=C\CCCCl Amb28410595 [1,1,0,0,0,0|1,0,1]=4 7183 B7R0.1 CC\C=C\CCCN Amb33474692 [1,1,0,0,0,0|1,0,1]=4 7184 B7R0.1 CC\C=C\CCCO Amb33172698 [1,1,0,0,0,0|1,0,1]=4 7185 B7R0.1 CC\C=C\CCCS Amb32882557 [1,1,0,0,0,0|1,0,1]=4 7186 B7R0.1 CC\C=C\CCNC Amb32953435 [1,1,0,0,0,0|1,0,1]=4 7187 B7R0.1 CC\C=C\CCSC Amb27397344 [1,1,0,0,0,0|1,0,1]=4 7188 B7R0.1 CC\C=N\CCCC Amb27946052 [1,1,0,0,0,0|1,0,0]=3 7189 B7R0.1 CNCCCCC#N Amb18307043 [1,1,0,0,0,0|1,0,1]=4 7190 B7R0.1 CNCCCCCF Amb27595210 [1,1,0,0,0,0|1,0,0]=3 7191 B7R0.1 CNCCCCCI Amb27953747 [1,1,0,0,0,0|1,0,0]=3 7192 B7R0.1 CNCCCCCN Amb23448496 [1,1,0,0,0,0|1,0,0]=3 7193 B7R0.1 CNCCCCCO Amb17334069 [1,1,0,0,0,0|1,0,0]=3 7194 B7R0.1 CNCCCCCO Amb33551687 [1,1,0,0,0,0|1,0,0]=3 7195 B7R0.1 CNCCCCNC Amb19374448 [1,1,0,0,0,0|1,0,0]=3 7196 B7R0.1 CNCCCCOC Amb17569912 [1,1,0,0,0,0|1,0,0]=3 7197 B7R0.1 CNCCCCSC Amb27433707 [1,1,0,0,0,0|1,0,0]=3 7198 B7R0.1 CNCCNCCN Amb18641939 [1,1,0,0,0,0|2,0,0]=4 7199 B7R0.1 CNCCNCCO Amb4020109 [1,1,0,0,0,0|2,0,0]=4 7200 B7R0.1 CNCCNCCS Amb27424661 [1,1,0,0,0,0|2,0,0]=4 7201 B7R0.1 CNCCOCCCl Amb25708208 [1,1,0,0,0,0|2,0,0]=4 7202 B7R0.1 CNCCOCCCl Amb32659597 [1,1,0,0,0,0|2,0,0]=4 7203 B7R0.1 CNCCOCCN Amb27246939 [1,1,0,0,0,0|2,0,0]=4 7204 B7R0.1 CNCCOCCO Amb33536922 [1,1,0,0,0,0|2,0,0]=4 7205 B7R0.1 CNCCSCCO Amb27475549 [1,1,0,0,0,0|2,0,0]=4 7206 B7R0.1 COCCCCC#N Amb13951615 [1,1,0,0,0,0|1,0,1]=4 7207 B7R0.1 COCCCCC=O Amb27410175 [1,1,0,0,0,0|0,0,0]=2 7208 B7R0.1 COCCCCCBr Amb18182548 [1,1,0,0,0,0|1,0,0]=3 7209 B7R0.1 COCCCCCCl Amb9001649 [1,1,0,0,0,0|1,0,0]=3 7210 B7R0.1 COCCCCCI Amb27603403 [1,1,0,0,0,0|1,0,0]=3 7211 B7R0.1 COCCCCCN Amb13951647 [1,1,0,0,0,0|1,0,0]=3 7212 B7R0.1 COCCCCCO Amb19374978 [1,1,0,0,0,0|1,0,0]=3 7213 B7R0.1 COCCCCCS Amb25138209 [1,1,0,0,0,0|1,0,0]=3 7214 B7R0.1 COCCCCNN Amb27753483 [1,1,0,0,0,0|2,0,0]=4 7215 B7R0.1 COCCCCOC Amb6296783 [1,1,0,0,0,0|1,0,0]=3 7216 B7R0.1 COCCCCON Amb25357703 [1,1,0,0,0,0|2,0,0]=4 7217 B7R0.1 COCCCCSC Amb28193488 [1,1,0,0,0,0|1,0,0]=3 7218 B7R0.1 COCCCN=C=O Amb5750716 [1,1,0,0,0,0|1,0,1]=4 7219 B7R0.1 COCCCOCCl Amb28073904 [1,1,0,0,0,0|2,0,0]=4 7220 B7R0.1 COCCCSCCl Amb27466078 [1,1,0,0,0,0|2,0,0]=4 7221 B7R0.1 COCCC\C=N\N Amb28288582 [1,1,0,0,0,0|2,0,0]=4 7222 B7R0.1 COCCNCCF Amb25677392 [1,1,0,0,0,0|2,0,0]=4 7223 B7R0.1 COCCNCCF Amb33552357 [1,1,0,0,0,0|2,0,0]=4 7224 B7R0.1 COCCNCCN Amb17091020 [1,1,0,0,0,0|2,0,0]=4 7225 B7R0.1 COCCNCCN Amb30585091 [1,1,0,0,0,0|2,0,0]=4 7226 B7R0.1 COCCNCCO Amb3939014 [1,1,0,0,0,0|2,0,0]=4 7227 B7R0.1 COCCNCCS Amb27405418 [1,1,0,0,0,0|2,0,0]=4 7228 B7R0.1 COCCOCC=O Amb26051823 [1,1,0,0,0,0|1,0,0]=3 7229 B7R0.1 COCCOCCBr Amb3938999 [1,1,0,0,0,0|2,0,0]=4 7230 B7R0.1 COCCOCCCl Amb9209785 [1,1,0,0,0,0|2,0,0]=4 7231 B7R0.1 COCCOCCI Amb22497515 [1,1,0,0,0,0|2,0,0]=4 7232 B7R0.1 COCCOCCN Amb6244884 [1,1,0,0,0,0|2,0,0]=4 7233 B7R0.1 COCCOCCN Amb7969459 [1,1,0,0,0,0|2,0,0]=4 7234 B7R0.1 COCCOCCO Amb4605829 [1,1,0,0,0,0|2,0,0]=4 7235 B7R0.1 COCCOCCS Amb9787645 [1,1,0,0,0,0|2,0,0]=4 7236 B7R0.1 COCCONC=O Amb28049001 [1,1,0,0,0,0|2,0,0]=4 7237 B7R0.1 COCCSCCF Amb28142604 [1,1,0,0,0,0|2,0,0]=4 7238 B7R0.1 COCCSCCO Amb9273918 [1,1,0,0,0,0|2,0,0]=4 7239 B7R0.1 COCCSCOC Amb27883297 [1,1,0,0,0,0|2,0,0]=4 7240 B7R0.1 COCC\C=C\C=O Amb33377482 [1,1,0,0,0,0|0,0,2]=4 7241 B7R0.1 COCC\C=C\CCl Amb10844762 [1,1,0,0,0,0|1,0,1]=4 7242 B7R0.1 COCC\C=C\CN Amb33474375 [1,1,0,0,0,0|1,0,1]=4 7243 B7R0.1 COCC\C=C\CO Amb32954125 [1,1,0,0,0,0|1,0,1]=4 7244 B7R0.1 COCOCCC=O Amb25804170 [1,1,0,0,0,0|1,0,0]=3 7245 B7R0.1 COCOCCCBr Amb28385749 [1,1,0,0,0,0|2,0,0]=4 7246 B7R0.1 COCOCCCCl Amb27194584 [1,1,0,0,0,0|2,0,0]=4 7247 B7R0.1 COCOCCCN Amb25989339 [1,1,0,0,0,0|2,0,0]=4 7248 B7R0.1 COCOCCCO Amb23591016 [1,1,0,0,0,0|2,0,0]=4 7249 B7R0.1 CONCCCCF Amb28401069 [1,1,0,0,0,0|2,0,0]=4 7250 B7R0.1 CO\C=C\CCC=O Amb18641790 [1,1,0,0,0,0|0,0,2]=4 7251 B7R0.1 CSCCCCC#N Amb27832899 [1,1,0,0,0,0|1,0,1]=4 7252 B7R0.1 CSCCCCC=O Amb25760866 [1,1,0,0,0,0|0,0,0]=2 7253 B7R0.1 CSCCCCCBr Amb25052398 [1,1,0,0,0,0|1,0,0]=3 7254 B7R0.1 CSCCCCCCl Amb18179464 [1,1,0,0,0,0|1,0,0]=3 7255 B7R0.1 CSCCCCCF Amb28049310 [1,1,0,0,0,0|1,0,0]=3 7256 B7R0.1 CSCCCCCN Amb24271082 [1,1,0,0,0,0|1,0,0]=3 7257 B7R0.1 CSCCCCCO Amb24271084 [1,1,0,0,0,0|1,0,0]=3 7258 B7R0.1 CSCCCCCS Amb24633807 [1,1,0,0,0,0|1,0,0]=3 7259 B7R0.1 CSCCCCON Amb33198301 [1,1,0,0,0,0|2,0,0]=4 7260 B7R0.1 CSCCCN=C=O Amb26647796 [1,1,0,0,0,0|1,0,1]=4 7261 B7R0.1 CSCCNCCBr Amb27833219 [1,1,0,0,0,0|2,0,0]=4 7262 B7R0.1 CSCCNCCCl Amb27870606 [1,1,0,0,0,0|2,0,0]=4 7263 B7R0.1 CSCCOCCBr Amb28321116 [1,1,0,0,0,0|2,0,0]=4 7264 B7R0.1 CSCCOCCN Amb17501991 [1,1,0,0,0,0|2,0,0]=4 7265 B7R0.1 CSCCOCCO Amb28368979 [1,1,0,0,0,0|2,0,0]=4 7266 B7R0.1 CSCC\C=C\C=O Amb32953448 [1,1,0,0,0,0|0,0,2]=4 7267 B7R0.1 CSCC\C=C\CN Amb33198278 [1,1,0,0,0,0|1,0,1]=4 7268 B7R0.1 CSCC\C=C\CO Amb33198279 [1,1,0,0,0,0|1,0,1]=4 7269 B7R0.1 CSCOCCCBr Amb27477765 [1,1,0,0,0,0|2,0,0]=4 7270 B7R0.1 CSSCCNC=O Amb27475220 [1,1,0,0,0,0|2,0,0]=4 7271 B7R0.1 C\C=C/CCCCC Amb4035902 [1,1,0,0,0,0|0,0,0]=2 7272 B7R0.1 C\C=C/CCCCO Amb4019856 [1,1,0,0,0,0|0,0,1]=3 7273 B7R0.1 C\C=C\C=C\CCC Amb27493119 [1,1,0,0,0,0|0,0,2]=4 7274 B7R0.1 C\C=C\CCCCC Amb8513437 [1,1,0,0,0,0|0,0,0]=2 7275 B7R0.1 C\C=C\CCCCN Amb27209196 [1,1,0,0,0,0|0,0,1]=3 7276 B7R0.1 C\C=C\CCNC=O Amb27874072 [1,1,0,0,0,0|0,0,2]=4 7277 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [1,1,0,0,0,0|0,0,2]=4 7278 B7R0.1 C\C=C\CNCCC Amb28127654 [1,1,0,0,0,0|0,0,1]=3 7279 B7R0.1 C\C=C\CNCCN Amb27983366 [1,1,0,0,0,0|1,0,1]=4 7280 B7R0.1 C\C=C\CNOCC Amb28048936 [1,1,0,0,0,0|1,0,1]=4 7281 B7R0.1 C\C=C\CSCCO Amb9362982 [1,1,0,0,0,0|1,0,1]=4 7282 B7R0.1 C\C=C\SSCCC Amb25865705 [1,1,0,0,0,0|1,0,1]=4 7283 B7R0.1 C\C=N/CCCCN Amb27838890 [1,1,0,0,0,0|1,0,0]=3 7284 B7R0.1 ClCCCCCCBr Amb10602445 [1,1,0,0,0,0|1,0,1]=4 7285 B7R0.1 ClCCCCCCCl Amb8513108 [1,1,0,0,0,0|1,0,1]=4 7286 B7R0.1 ClCCCCCCI Amb20670134 [1,1,0,0,0,0|1,0,1]=4 7287 B7R0.1 ClCCCCC[Zn]Br Amb22000392 [1,1,0,0,0,0|2,0,0]=4 7288 B7R0.1 ClCCCCOCCl Amb27628371 [1,1,0,0,0,0|2,0,0]=4 7289 B7R0.1 ClCOCCCCBr Amb28195199 [1,1,0,0,0,0|2,0,0]=4 7290 B7R0.1 ClC\C=C\CCCCl Amb27421977 [1,1,0,0,0,0|1,0,1]=4 7291 B7R0.1 FCCCCCCCl Amb27817669 [1,1,0,0,0,0|1,0,1]=4 7292 B7R0.1 FCCCCCCI Amb25080138 [1,1,0,0,0,0|1,0,1]=4 7293 B7R0.1 FCCCCCCS Amb24569228 [1,1,0,0,0,0|0,1,1]=4 7294 B7R0.1 ICCCCCCI Amb8514815 [1,1,0,0,0,0|1,0,1]=4 7295 B7R0.1 N#CCCCCC=O Amb17593149 [1,1,0,0,0,0|0,0,1]=3 7296 B7R0.1 N#CCCCCCBr Amb2685266 [1,1,0,0,0,0|1,0,1]=4 7297 B7R0.1 N#CCCCCCF Amb17593193 [1,1,0,0,0,0|1,0,1]=4 7298 B7R0.1 N#CCCCCCN Amb2721249 [1,1,0,0,0,0|1,0,1]=4 7299 B7R0.1 N#CCCCCCN Amb31031060 [1,1,0,0,0,0|1,0,1]=4 7300 B7R0.1 N#CCCCCCO Amb27665577 [1,1,0,0,0,0|1,0,1]=4 7301 B7R0.1 N#CCCCCCS Amb28144803 [1,1,0,0,0,0|1,0,1]=4 7302 B7R0.1 N#CCCOCC=O Amb27613546 [1,1,0,0,0,0|1,0,1]=4 7303 B7R0.1 NCCCCCCBr Amb18648322 [1,1,0,0,0,0|1,0,1]=4 7304 B7R0.1 NCCCCCCCl Amb31030966 [1,1,0,0,0,0|1,0,1]=4 7305 B7R0.1 NCCCCCCF Amb28314228 [1,1,0,0,0,0|1,0,1]=4 7306 B7R0.1 NCCCCCCN Amb2573303 [1,1,0,0,0,0|1,0,1]=4 7307 B7R0.1 NCCCCCCN Amb8516658 [1,1,0,0,0,0|1,0,1]=4 7308 B7R0.1 NCCCCCCO Amb2720515 [1,1,0,0,0,0|0,0,2]=4 7309 B7R0.1 NCCCCCCS Amb18642745 [1,1,0,0,0,0|0,1,1]=4 7310 B7R0.1 NCCCCCCS Amb24099361 [1,1,0,0,0,0|0,1,1]=4 7311 B7R0.1 NCCCCCNO Amb24381036 [1,1,0,0,0,0|1,0,1]=4 7312 B7R0.1 NCCCCCNO Amb33483225 [1,1,0,0,0,0|1,0,1]=4 7313 B7R0.1 NCCCCNC=O Amb18641902 [1,1,0,0,0,0|1,0,0]=3 7314 B7R0.1 NCCC\C=C/CO Amb27838308 [1,1,0,0,0,0|1,0,1]=4 7315 B7R0.1 NCCC\C=C\CO Amb24117506 [1,1,0,0,0,0|1,0,1]=4 7316 B7R0.1 NCCC\C=C\CO Amb33734220 [1,1,0,0,0,0|1,0,1]=4 7317 B7R0.1 NCCC\C=C\CO Amb33743765 [1,1,0,0,0,0|1,0,1]=4 7318 B7R0.1 O=C=NCCCCCl Amb27595099 [1,1,0,0,0,0|1,0,1]=4 7319 B7R0.1 O=C=NCCCCF Amb27625761 [1,1,0,0,0,0|1,0,1]=4 7320 B7R0.1 O=C=NCCCCO Amb27758809 [1,1,0,0,0,0|1,0,1]=4 7321 B7R0.1 O=CC#CCCCCl Amb27759532 [1,1,0,0,0,0|0,0,2]=4 7322 B7R0.1 O=CCCCCC=O Amb17593185 [1,1,0,0,0,0|0,0,1]=3 7323 B7R0.1 O=CCCCCCBr Amb18127461 [1,1,0,0,0,0|0,0,0]=2 7324 B7R0.1 O=CCCCCCCl Amb16185781 [1,1,0,0,0,0|0,0,0]=2 7325 B7R0.1 O=CCCCCCF Amb24533888 [1,1,0,0,0,0|0,0,0]=2 7326 B7R0.1 O=CCCCCCO Amb18641885 [1,1,0,0,0,0|0,0,0]=2 7327 B7R0.1 O=CCCOCCO Amb18641946 [1,1,0,0,0,0|1,0,0]=3 7328 B7R0.1 O=CCSCCCO Amb27871143 [1,1,0,0,0,0|1,0,0]=3 7329 B7R0.1 O=CNCCCCF Amb27168251 [1,1,0,0,0,0|1,0,0]=3 7330 B7R0.1 O=CNCCCCO Amb28187191 [1,1,0,0,0,0|1,0,0]=3 7331 B7R0.1 O=COCOCCCl Amb28326081 [1,1,0,0,0,0|2,0,0]=4 7332 B7R0.1 OCCCCCCBr Amb24063183 [1,1,0,0,0,0|0,0,2]=4 7333 B7R0.1 OCCCCCCBr Amb8514955 [1,1,0,0,0,0|0,0,2]=4 7334 B7R0.1 OCCCCCCCl Amb2686112 [1,1,0,0,0,0|0,0,2]=4 7335 B7R0.1 OCCCCCCF Amb24428671 [1,1,0,0,0,0|0,0,2]=4 7336 B7R0.1 OCCCCCCI Amb28048917 [1,1,0,0,0,0|0,0,2]=4 7337 B7R0.1 OCCCCCCO Amb6869970 [1,1,0,0,0,0|0,0,2]=4 7338 B7R0.1 OCCCCCCS Amb9786744 [1,1,0,0,0,0|0,0,2]=4 7339 B7R0.1 OCCCC\C=N\O Amb22336271 [1,1,0,0,0,0|1,0,1]=4 7340 B7R0.1 OC\C=C/CCCCl Amb27862350 [1,1,0,0,0,0|1,0,1]=4 7341 B7R0.1 OC\C=C\CCCO Amb27205649 [1,1,0,0,0,0|1,0,1]=4 7342 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [1,1,0,0,0,0|0,0,2]=4 7343 B7R0.1 [C-]#[N+]CCCCOC Amb33377812 [1,1,0,0,0,0|1,0,1]=4 7344 B7R0.1 [C-]#[N+]CCCCSC Amb33198737 [1,1,0,0,0,0|1,0,1]=4 7345 B7R0.1 [C-]#[N+]CCCOCC Amb3973110 [1,1,0,0,0,0|1,0,1]=4 7346 B7R0.1 [C-]#[N+]CCCSCC Amb33324017 [1,1,0,0,0,0|1,0,1]=4 7347 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [1,1,0,0,0,0|1,0,1]=4 7348 B7R0.1 [N-]=[N+]=NCCCC=O Amb26993491 [1,1,0,0,0,0|2,0,0]=4 7349 B7R0.7 C#CCC(C)CCC Amb33321138 [1,1,0,0,0,0|0,0,2]=4 7350 B7R0.7 C#CC[C@H](O)CCC Amb27950875 [1,1,0,0,0,0|0,0,2]=4 7351 B7R0.7 C=C(CCC)CCC Amb25088297 [1,1,0,0,0,0|0,0,2]=4 7352 B7R0.7 C=CCC(C)CCBr Amb25211241 [1,1,0,0,0,0|1,0,1]=4 7353 B7R0.7 C=CCC(C)CCC Amb26958532 [1,1,0,0,0,0|0,0,1]=3 7354 B7R0.7 C=CCC(C)CCCl Amb32688175 [1,1,0,0,0,0|1,0,1]=4 7355 B7R0.7 C=CCC(C)CCN Amb27596627 [1,1,0,0,0,0|1,0,1]=4 7356 B7R0.7 C=CCC(C)CCO Amb27603507 [1,1,0,0,0,0|1,0,1]=4 7357 B7R0.7 C=CCC(N)COC Amb19018008 [1,1,0,0,0,0|1,0,1]=4 7358 B7R0.7 C=CCC(O)CCBr Amb27669769 [1,1,0,0,0,0|1,0,1]=4 7359 B7R0.7 C=CCC(O)CCC Amb4019981 [1,1,0,0,0,0|0,0,1]=3 7360 B7R0.7 C=CCC(O)CCN Amb27839044 [1,1,0,0,0,0|1,0,1]=4 7361 B7R0.7 C=CCC(O)CSC Amb27463975 [1,1,0,0,0,0|1,0,1]=4 7362 B7R0.7 C=CC[C@@H](N)CCO Amb27398150 [1,1,0,0,0,0|1,0,1]=4 7363 B7R0.7 C=CC[C@@H](N)COC Amb28128126 [1,1,0,0,0,0|1,0,1]=4 7364 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [1,1,0,0,0,0|0,0,1]=3 7365 B7R0.7 C=CC[C@H](N)COC Amb27851131 [1,1,0,0,0,0|1,0,1]=4 7366 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [1,1,0,0,0,0|0,0,1]=3 7367 B7R0.7 C=COC(O)CCC Amb27222270 [1,1,0,0,0,0|1,0,1]=4 7368 B7R0.7 CC(CC=O)CC=O Amb17593183 [1,1,0,0,0,0|1,0,1]=4 7369 B7R0.7 CCCC(=O)CC=N Amb28049020 [1,1,0,0,0,0|1,0,1]=4 7370 B7R0.7 CCCC(=O)CCC Amb6608653 [1,1,0,0,0,0|0,0,2]=4 7371 B7R0.7 CCCC(=O)CNC Amb27251893 [1,1,0,0,0,0|1,0,1]=4 7372 B7R0.7 CCCC(Br)CCC Amb8968455 [1,1,0,0,0,0|0,0,1]=3 7373 B7R0.7 CCCC(Br)CCCl Amb27472207 [1,1,0,0,0,0|1,0,1]=4 7374 B7R0.7 CCCC(Br)N=C=O Amb27590951 [1,1,0,0,0,0|1,0,1]=4 7375 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [1,1,0,0,0,0|0,0,2]=4 7376 B7R0.7 CCCC(C)CC#N Amb26515743 [1,1,0,0,0,0|1,0,1]=4 7377 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,0]=3 7378 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,1]=4 7379 B7R0.7 CCCC(C)CCC Amb22229829 [1,1,0,0,0,0|0,0,1]=3 7380 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,1]=4 7381 B7R0.7 CCCC(C)CCN Amb31145475 [1,1,0,0,0,0|1,0,1]=4 7382 B7R0.7 CCCC(C)CCN Amb839082 [1,1,0,0,0,0|1,0,1]=4 7383 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,2]=4 7384 B7R0.7 CCCC(C)CCS Amb33320804 [1,1,0,0,0,0|0,1,1]=4 7385 B7R0.7 CCCC(C)CNC Amb33330634 [1,1,0,0,0,0|1,0,0]=3 7386 B7R0.7 CCCC(C)CNC Amb6719001 [1,1,0,0,0,0|1,0,0]=3 7387 B7R0.7 CCCC(C)CNN Amb6744626 [1,1,0,0,0,0|2,0,0]=4 7388 B7R0.7 CCCC(C)CNO Amb26632405 [1,1,0,0,0,0|1,0,1]=4 7389 B7R0.7 CCCC(C)CON Amb27630051 [1,1,0,0,0,0|2,0,0]=4 7390 B7R0.7 CCCC(C)N=C=O Amb21961819 [1,1,0,0,0,0|1,0,1]=4 7391 B7R0.7 CCCC(C)NC=O Amb27236942 [1,1,0,0,0,0|1,0,0]=3 7392 B7R0.7 CCCC(C)NCC Amb22586730 [1,1,0,0,0,0|1,0,1]=4 7393 B7R0.7 CCCC(C)NCC Amb9726218 [1,1,0,0,0,0|1,0,1]=4 7394 B7R0.7 CCCC(C)OCC Amb22733741 [1,1,0,0,0,0|1,0,1]=4 7395 B7R0.7 CCCC(Cl)CSC Amb27966841 [1,1,0,0,0,0|1,0,0]=3 7396 B7R0.7 CCCC(F)CCN Amb25869704 [1,1,0,0,0,0|1,0,1]=4 7397 B7R0.7 CCCC(F)CCO Amb27662632 [1,1,0,0,0,0|0,0,2]=4 7398 B7R0.7 CCCC(N)CC#N Amb27960346 [1,1,0,0,0,0|1,0,1]=4 7399 B7R0.7 CCCC(N)CCC Amb1102706 [1,1,0,0,0,0|0,0,1]=3 7400 B7R0.7 CCCC(N)CCN Amb27838332 [1,1,0,0,0,0|1,0,1]=4 7401 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,2]=4 7402 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|1,0,0]=3 7403 B7R0.7 CCCC(O)CCC Amb4035747 [1,1,0,0,0,0|0,0,1]=3 7404 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,1]=4 7405 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,2]=4 7406 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|1,0,0]=3 7407 B7R0.7 CCCC(O)CNN Amb28316120 [1,1,0,0,0,0|2,0,0]=4 7408 B7R0.7 CCCC(O)COC Amb28347497 [1,1,0,0,0,0|1,0,0]=3 7409 B7R0.7 CCCC(O)\C=C\F Amb27981709 [1,1,0,0,0,0|1,0,1]=4 7410 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|0,0,0]=2 7411 B7R0.7 CCCC(S)CCC Amb7784733 [1,1,0,0,0,0|0,0,1]=3 7412 B7R0.7 CCCN(C)CCC Amb9787750 [1,1,0,0,0,0|1,0,1]=4 7413 B7R0.7 CCCN(N)CCC Amb17593208 [1,1,0,0,0,0|1,0,1]=4 7414 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|1,0,1]=4 7415 B7R0.7 CCCS(=O)CCC Amb6366329 [1,1,0,0,0,0|1,0,1]=4 7416 B7R0.7 CCC[C@@H](C)CC=O Amb27393066 [1,1,0,0,0,0|0,0,0]=2 7417 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [1,1,0,0,0,0|1,0,1]=4 7418 B7R0.7 CCC[C@@H](C)N=C=O Amb28128423 [1,1,0,0,0,0|1,0,1]=4 7419 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,2]=4 7420 B7R0.7 CCC[C@@H](N)CNC Amb27452197 [1,1,0,0,0,0|1,0,0]=3 7421 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [1,1,0,0,0,0|1,0,1]=4 7422 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,2]=4 7423 B7R0.7 CCC[C@H](N)CC#N Amb28241461 [1,1,0,0,0,0|1,0,1]=4 7424 B7R0.7 CCC[C@H](N)CCO Amb25889377 [1,1,0,0,0,0|0,0,2]=4 7425 B7R0.7 CCC[C@H](N)CCO Amb32409602 [1,1,0,0,0,0|0,0,2]=4 7426 B7R0.7 CCC[C@H](N)COC Amb28316177 [1,1,0,0,0,0|1,0,0]=3 7427 B7R0.7 CCC[C@H](N)CSC Amb28206579 [1,1,0,0,0,0|1,0,0]=3 7428 B7R0.7 CCC[C@H](O)CCN Amb33204238 [1,1,0,0,0,0|1,0,1]=4 7429 B7R0.7 CCC[PH](=O)CCC Amb26366296 [1,1,0,0,0,0|1,0,1]=4 7430 B7R0.7 CCC\C(Br)=C/C=O Amb28252419 [1,1,0,0,0,0|0,0,2]=4 7431 B7R0.7 CCC\C(C)=C\C=O Amb27237056 [1,1,0,0,0,0|0,0,2]=4 7432 B7R0.7 CCNC(C)COC Amb6689696 [1,1,0,0,0,0|2,0,0]=4 7433 B7R0.7 CCNC(C)COC Amb7969718 [1,1,0,0,0,0|2,0,0]=4 7434 B7R0.7 CCNC(C)CSC Amb18313762 [1,1,0,0,0,0|2,0,0]=4 7435 B7R0.7 CCOC(=O)CC=O Amb8394868 [1,1,0,0,0,0|1,0,1]=4 7436 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|1,0,0]=3 7437 B7R0.7 CCOC(C)CNC Amb10608191 [1,1,0,0,0,0|2,0,0]=4 7438 B7R0.7 CCOC(C)NC=O Amb27391666 [1,1,0,0,0,0|2,0,0]=4 7439 B7R0.7 CCSC(C)CC=O Amb22232285 [1,1,0,0,0,0|1,0,0]=3 7440 B7R0.7 CNCC(Br)COC Amb28316163 [1,1,0,0,0,0|2,0,0]=4 7441 B7R0.7 CNCC(C)CCN Amb17334067 [1,1,0,0,0,0|2,0,0]=4 7442 B7R0.7 CNCC(C)CCO Amb17569901 [1,1,0,0,0,0|2,0,0]=4 7443 B7R0.7 CNCC(C)CNC Amb4017664 [1,1,0,0,0,0|2,0,0]=4 7444 B7R0.7 CNCC(C)COC Amb17569917 [1,1,0,0,0,0|2,0,0]=4 7445 B7R0.7 CNCC(Cl)COC Amb27483953 [1,1,0,0,0,0|2,0,0]=4 7446 B7R0.7 CNCC(O)CCF Amb33196461 [1,1,0,0,0,0|2,0,0]=4 7447 B7R0.7 CNCC(O)CCN Amb18559793 [1,1,0,0,0,0|2,0,0]=4 7448 B7R0.7 CNCC(O)CCO Amb27593318 [1,1,0,0,0,0|2,0,0]=4 7449 B7R0.7 CNCC(O)CNC Amb27838335 [1,1,0,0,0,0|2,0,0]=4 7450 B7R0.7 CNCC(O)COC Amb7969838 [1,1,0,0,0,0|2,0,0]=4 7451 B7R0.7 CNCC(O)COC Amb9741140 [1,1,0,0,0,0|2,0,0]=4 7452 B7R0.7 CNCC(O)CSC Amb19008591 [1,1,0,0,0,0|2,0,0]=4 7453 B7R0.7 CNC[C@H](O)COC Amb28133685 [1,1,0,0,0,0|2,0,0]=4 7454 B7R0.7 COCC(Br)CCN Amb27218920 [1,1,0,0,0,0|2,0,0]=4 7455 B7R0.7 COCC(Br)COC Amb24407024 [1,1,0,0,0,0|2,0,0]=4 7456 B7R0.7 COCC(C)CCBr Amb28187454 [1,1,0,0,0,0|2,0,0]=4 7457 B7R0.7 COCC(C)CCCl Amb26515746 [1,1,0,0,0,0|2,0,0]=4 7458 B7R0.7 COCC(C)CCN Amb17569914 [1,1,0,0,0,0|2,0,0]=4 7459 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|2,0,0]=4 7460 B7R0.7 COCC(C)NC=O Amb27838341 [1,1,0,0,0,0|2,0,0]=4 7461 B7R0.7 COCC(Cl)CCO Amb28454426 [1,1,0,0,0,0|2,0,0]=4 7462 B7R0.7 COCC(Cl)COC Amb8630605 [1,1,0,0,0,0|2,0,0]=4 7463 B7R0.7 COCC(F)CCN Amb27397139 [1,1,0,0,0,0|2,0,0]=4 7464 B7R0.7 COCC(N)CCCl Amb28207136 [1,1,0,0,0,0|2,0,0]=4 7465 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|2,0,0]=4 7466 B7R0.7 COCC(N)COC Amb32662798 [1,1,0,0,0,0|2,0,0]=4 7467 B7R0.7 COCC(N)COC Amb33543407 [1,1,0,0,0,0|2,0,0]=4 7468 B7R0.7 COCC(N)CSC Amb28041040 [1,1,0,0,0,0|2,0,0]=4 7469 B7R0.7 COCC(O)CCN Amb18203347 [1,1,0,0,0,0|2,0,0]=4 7470 B7R0.7 COCC(O)COC Amb2694755 [1,1,0,0,0,0|2,0,0]=4 7471 B7R0.7 COCC(O)CSC Amb27399113 [1,1,0,0,0,0|2,0,0]=4 7472 B7R0.7 COCC(S)COC Amb26549618 [1,1,0,0,0,0|2,0,0]=4 7473 B7R0.7 COC[C@@H](N)CCO Amb27964057 [1,1,0,0,0,0|2,0,0]=4 7474 B7R0.7 COC[C@@H](O)CCN Amb24474146 [1,1,0,0,0,0|2,0,0]=4 7475 B7R0.7 COC[C@H](O)CCN Amb27650451 [1,1,0,0,0,0|2,0,0]=4 7476 B7R0.7 CSCC(C)CCN Amb33272059 [1,1,0,0,0,0|2,0,0]=4 7477 B7R0.7 CSCC(F)CCN Amb33225468 [1,1,0,0,0,0|2,0,0]=4 7478 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|2,0,0]=4 7479 B7R0.7 CSCC(O)CCN Amb25078322 [1,1,0,0,0,0|2,0,0]=4 7480 B7R0.7 CSCC(O)CSC Amb2779300 [1,1,0,0,0,0|2,0,0]=4 7481 B7R0.7 CSC[C@@H](O)CCN Amb33271743 [1,1,0,0,0,0|2,0,0]=4 7482 B7R0.7 CSC[C@H](O)CCN Amb33271745 [1,1,0,0,0,0|2,0,0]=4 7483 B7R0.7 C\C=C/[C@@H](C)CCBr Amb27433882 [1,1,0,0,0,0|1,0,1]=4 7484 B7R0.7 C\C=C\C(=O)CCC Amb25717214 [1,1,0,0,0,0|0,0,2]=4 7485 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [1,1,0,0,0,0|0,0,1]=3 7486 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [1,1,0,0,0,0|0,0,2]=4 7487 B7R0.7 C\C=C\C(C)CCC Amb26633016 [1,1,0,0,0,0|0,0,1]=3 7488 B7R0.7 C\C=C\C(C)CCO Amb27437234 [1,1,0,0,0,0|1,0,1]=4 7489 B7R0.7 C\C=C\C(Cl)CSC Amb27657144 [1,1,0,0,0,0|1,0,1]=4 7490 B7R0.7 C\C=C\C(O)CCO Amb3354799 [1,1,0,0,0,0|1,0,1]=4 7491 B7R0.7 C\C=C\[C@@H](C)CC=O Amb27791915 [1,1,0,0,0,0|0,0,2]=4 7492 B7R0.7 C\C=C\[C@@H](C)CCO Amb27651868 [1,1,0,0,0,0|1,0,1]=4 7493 B7R0.7 C\C=C\[C@H](O)CCO Amb27164439 [1,1,0,0,0,0|1,0,1]=4 7494 B7R0.7 C\C=N\S(=O)CCC Amb35732315 [1,1,0,0,0,0|2,0,0]=4 7495 B7R0.7 O=CCC(=O)CCO Amb28255739 [1,1,0,0,0,0|1,0,1]=4 7496 B7R0.7 [C-]#[N+]CC(C)CCC Amb33322331 [1,1,0,0,0,0|1,0,1]=4 7497 B7R0.7 [C-]#[N+]CC(F)CCC Amb27421865 [1,1,0,0,0,0|1,0,1]=4 7498 B9R0.4 C=C(Br)CC(O)CCCO Amb27641988 [0,2,0,0,0,0|1,0,1]=4 7499 B9R0.4 C=C(Br)CN(C)CCCC Amb27831854 [0,2,0,0,0,0|1,0,1]=4 7500 B9R0.4 C=C(C)CC(=O)CCCCl Amb28397182 [0,2,0,0,0,0|1,0,1]=4 7501 B9R0.4 C=C(C)CC(=O)CCCN Amb27252833 [0,2,0,0,0,0|1,0,1]=4 7502 B9R0.4 C=C(C)CC(=O)CCSC Amb27594735 [0,2,0,0,0,0|1,0,1]=4 7503 B9R0.4 C=C(C)CC(=O)COCC Amb27759061 [0,2,0,0,0,0|1,0,1]=4 7504 B9R0.4 C=C(C)CC(=O)CSCC Amb28128355 [0,2,0,0,0,0|1,0,1]=4 7505 B9R0.4 C=C(C)CC(N)CCSC Amb27779574 [0,2,0,0,0,0|1,0,0]=3 7506 B9R0.4 C=C(C)CC(O)CCCC Amb27221835 [0,2,0,0,0,0|1,0,0]=3 7507 B9R0.4 C=C(C)CC(O)CCCCl Amb27648663 [0,2,0,0,0,0|1,0,0]=3 7508 B9R0.4 C=C(C)CC(O)CCSC Amb27805568 [0,2,0,0,0,0|1,0,0]=3 7509 B9R0.4 C=C(C)CC(O)COCC Amb27960730 [0,2,0,0,0,0|1,0,0]=3 7510 B9R0.4 C=C(C)CN(C)CCCN Amb28049499 [0,2,0,0,0,0|2,0,0]=4 7511 B9R0.4 C=C(C)CN(C)CCCO Amb27257263 [0,2,0,0,0,0|2,0,0]=4 7512 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [0,2,0,0,0,0|1,0,0]=3 7513 B9R0.4 C=CCCC(C)CC(C)=O Amb24738371 [0,2,0,0,0,0|0,0,1]=3 7514 B9R0.4 C=CCCC(N)CC(=O)O Amb22641959 [0,2,0,0,0,0|1,0,1]=4 7515 B9R0.4 C=CCCC(N)CC(=O)O Amb31307612 [0,2,0,0,0,0|1,0,1]=4 7516 B9R0.4 C=CCCC(N)CC(N)=O Amb25367476 [0,2,0,0,0,0|1,0,1]=4 7517 B9R0.4 C=CCC[C@@H](C)CC(=O)O Amb27390713 [0,2,0,0,0,0|1,0,1]=4 7518 B9R0.4 C=CCC[C@@H](O)CC(C)=O Amb28122093 [0,2,0,0,0,0|0,0,1]=3 7519 B9R0.4 C=CCC[C@H](N)CC(=O)O Amb10066917 [0,2,0,0,0,0|1,0,1]=4 7520 B9R0.4 C=CCSC(C)CC(C)=O Amb28076621 [0,2,0,0,0,0|0,0,2]=4 7521 B9R0.4 CC#CCC(C)CC(C)=O Amb27839057 [0,2,0,0,0,0|0,0,1]=3 7522 B9R0.4 CC(=O)CC(=O)NCCCl Amb27592435 [0,2,0,0,0,0|1,0,1]=4 7523 B9R0.4 CC(=O)CC(=O)NCCN Amb19011382 [0,2,0,0,0,0|1,0,1]=4 7524 B9R0.4 CC(=O)CC(=O)NCCO Amb9820184 [0,2,0,0,0,0|1,0,1]=4 7525 B9R0.4 CC(=O)CC(=O)OCCBr Amb27237639 [0,2,0,0,0,0|1,0,1]=4 7526 B9R0.4 CC(=O)CC(=O)OCCO Amb24620465 [0,2,0,0,0,0|1,0,1]=4 7527 B9R0.4 CC(=O)CC(=O)SCCCl Amb27656742 [0,2,0,0,0,0|1,0,1]=4 7528 B9R0.4 CC(=O)CC(C)CCC=O Amb27838122 [0,2,0,0,0,0|0,0,1]=3 7529 B9R0.4 CC(=O)CN(C)CCC#N Amb27617060 [0,2,0,0,0,0|1,0,1]=4 7530 B9R0.4 CC(=O)C[C@@H](O)CCC#N Amb26599245 [0,2,0,0,0,0|0,0,1]=3 7531 B9R0.4 CC(=O)C[C@H](O)CCC#N Amb28314339 [0,2,0,0,0,0|0,0,1]=3 7532 B9R0.4 CC(=O)NC(=O)CCCCl Amb28135496 [0,2,0,0,0,0|1,0,1]=4 7533 B9R0.4 CC(=O)NC(C)CCCO Amb28120258 [0,2,0,0,0,0|1,0,0]=3 7534 B9R0.4 CC(=O)OC(=O)CCCCl Amb27597994 [0,2,0,0,0,0|1,0,1]=4 7535 B9R0.4 CC(=O)OC(C)COCCl Amb27244906 [0,2,0,0,0,0|2,0,0]=4 7536 B9R0.4 CC(C)=CC(C)CCCO Amb28079248 [0,2,0,0,0,0|1,0,1]=4 7537 B9R0.4 CC(C)CC(C)CCCBr Amb24064688 [0,2,0,0,0,0|1,0,1]=4 7538 B9R0.4 CC(C)CC(C)CCCCl Amb24432723 [0,2,0,0,0,0|1,0,1]=4 7539 B9R0.4 CC(C)CC(O)CCCF Amb27410874 [0,2,0,0,0,0|1,0,1]=4 7540 B9R0.4 CC(C)CC(O)CCCO Amb27791444 [0,2,0,0,0,0|1,0,1]=4 7541 B9R0.4 CC(CC(=O)O)NCCF Amb28144859 [0,2,0,0,0,0|2,0,0]=4 7542 B9R0.4 CC(CC(=O)O)NCCO Amb9398895 [0,2,0,0,0,0|2,0,0]=4 7543 B9R0.4 CC(CC(=O)O)SCCN Amb18788220 [0,2,0,0,0,0|2,0,0]=4 7544 B9R0.4 CC(CC(=O)O)SCCO Amb9481722 [0,2,0,0,0,0|2,0,0]=4 7545 B9R0.4 CC(CCC=O)CC(=O)O Amb28251065 [0,2,0,0,0,0|1,0,1]=4 7546 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [0,2,0,0,0,0|1,0,0]=3 7547 B9R0.4 CC(CCCN)NS(C)=O Amb28199697 [0,2,0,0,0,0|2,0,0]=4 7548 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [0,2,0,0,0,0|1,0,0]=3 7549 B9R0.4 CC(CCCO)CN(C)C Amb28324038 [0,2,0,0,0,0|2,0,0]=4 7550 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [0,2,0,0,0,0|1,0,0]=3 7551 B9R0.4 CCC#CC(C)CC(=O)O Amb28050086 [0,2,0,0,0,0|1,0,1]=4 7552 B9R0.4 CCC#C[C@@H](C)CC(=O)O Amb27216422 [0,2,0,0,0,0|1,0,1]=4 7553 B9R0.4 CCC#C[C@H](C)CC(=O)O Amb27174782 [0,2,0,0,0,0|1,0,1]=4 7554 B9R0.4 CCCCC(=O)C=C(C)C Amb27664643 [0,2,0,0,0,0|1,0,1]=4 7555 B9R0.4 CCCCC(=O)CC(C)=O Amb9775080 [0,2,0,0,0,0|0,0,0]=2 7556 B9R0.4 CCCCC(=O)CC(C)Cl Amb27984861 [0,2,0,0,0,0|1,0,1]=4 7557 B9R0.4 CCCCC(=O)CC(N)=S Amb27590363 [0,2,0,0,0,0|1,1,0]=4 7558 B9R0.4 CCCCC(=O)NC(N)=O Amb28050036 [0,2,0,0,0,0|1,0,1]=4 7559 B9R0.4 CCCCC(=O)OC(C)=O Amb34916560 [0,2,0,0,0,0|0,0,1]=3 7560 B9R0.4 CCCCC(=S)NC(C)=O Amb28341039 [0,2,0,0,0,0|0,0,1]=3 7561 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [0,2,0,0,0,0|1,0,0]=3 7562 B9R0.4 CCCCC(C)CC(C)Cl Amb27972096 [0,2,0,0,0,0|1,0,1]=4 7563 B9R0.4 CCCCC(C)CC(C)N Amb27618079 [0,2,0,0,0,0|1,0,1]=4 7564 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,2,0,0,0,0|0,0,2]=4 7565 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [0,2,0,0,0,0|1,0,0]=3 7566 B9R0.4 CCCCC(C)NC(=N)N Amb27790523 [0,2,0,0,0,0|2,0,0]=4 7567 B9R0.4 CCCCC(C)NC(C)=O Amb27487886 [0,2,0,0,0,0|0,0,0]=2 7568 B9R0.4 CCCCC(C)NC(C)C Amb9622306 [0,2,0,0,0,0|1,0,1]=4 7569 B9R0.4 CCCCC(C)OC(=O)Cl Amb32654980 [0,2,0,0,0,0|1,0,0]=3 7570 B9R0.4 CCCCC(C)OC(C)=O Amb27594424 [0,2,0,0,0,0|0,0,0]=2 7571 B9R0.4 CCCCC(C)OC(N)=O Amb28050035 [0,2,0,0,0,0|1,0,0]=3 7572 B9R0.4 CCCCC(Cl)CC(C)C Amb27758354 [0,2,0,0,0,0|1,0,1]=4 7573 B9R0.4 CCCCC(N)C=C(C)C Amb27486513 [0,2,0,0,0,0|1,0,0]=3 7574 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [0,2,0,0,0,0|1,0,0]=3 7575 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [0,2,0,0,0,0|1,0,0]=3 7576 B9R0.4 CCCCC(N)CC(C)C Amb27168956 [0,2,0,0,0,0|1,0,1]=4 7577 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [0,2,0,0,0,0|1,0,0]=3 7578 B9R0.4 CCCCC(O)C=C(Cl)Cl Amb27394754 [0,2,0,0,0,0|2,0,0]=4 7579 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [0,2,0,0,0,0|1,0,0]=3 7580 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [0,2,0,0,0,0|0,0,0]=2 7581 B9R0.4 CCCCC(O)CC(C)C Amb22734801 [0,2,0,0,0,0|1,0,1]=4 7582 B9R0.4 CCCCN(C)CC(=O)Cl Amb17142904 [0,2,0,0,0,0|1,0,0]=3 7583 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [0,2,0,0,0,0|1,0,0]=3 7584 B9R0.4 CCCCN(C)CC(C)N Amb6661193 [0,2,0,0,0,0|1,0,1]=4 7585 B9R0.4 CCCCN(C)CC(N)=S Amb6273896 [0,2,0,0,0,0|1,1,0]=4 7586 B9R0.4 CCCCN(C)C[C@@H](C)N Amb18014373 [0,2,0,0,0,0|1,0,1]=4 7587 B9R0.4 CCCCN(C)C[C@H](C)N Amb5782063 [0,2,0,0,0,0|1,0,1]=4 7588 B9R0.4 CCCCN(C)C[N+](=O)[O-] Amb28064742 [0,2,0,0,0,0|2,0,0]=4 7589 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [0,2,0,0,0,0|1,0,0]=3 7590 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [0,2,0,0,0,0|1,0,0]=3 7591 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [0,2,0,0,0,0|0,0,0]=2 7592 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [0,2,0,0,0,0|1,0,0]=3 7593 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [0,2,0,0,0,0|1,0,0]=3 7594 B9R0.4 CCCC[C@@H](O)C=C(C)C Amb27650406 [0,2,0,0,0,0|1,0,0]=3 7595 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [0,2,0,0,0,0|1,0,0]=3 7596 B9R0.4 CCCC[C@@H](O)CC(C)C Amb27399625 [0,2,0,0,0,0|1,0,1]=4 7597 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [0,2,0,0,0,0|0,0,2]=4 7598 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [0,2,0,0,0,0|1,0,0]=3 7599 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [0,2,0,0,0,0|0,0,0]=2 7600 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [0,2,0,0,0,0|1,0,0]=3 7601 B9R0.4 CCCC[C@H](C)NC(C)=O Amb27173638 [0,2,0,0,0,0|0,0,0]=2 7602 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [0,2,0,0,0,0|1,0,0]=3 7603 B9R0.4 CCCC[C@H](O)CC(C)C Amb28429013 [0,2,0,0,0,0|1,0,1]=4 7604 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [0,2,0,0,0,0|0,0,2]=4 7605 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [0,2,0,0,0,0|0,0,2]=4 7606 B9R0.4 CCCC\C(Br)=C/C(=O)O Amb27622154 [0,2,0,0,0,0|1,0,1]=4 7607 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [0,2,0,0,0,0|1,0,1]=4 7608 B9R0.4 CCCC\C(C)=N\C(N)=O Amb27645991 [0,2,0,0,0,0|1,0,1]=4 7609 B9R0.4 CCCC\C(O)=C/C(C)=O Amb28184671 [0,2,0,0,0,0|0,0,1]=3 7610 B9R0.4 CCCC\C(O)=C\C(C)=O Amb27432598 [0,2,0,0,0,0|0,0,1]=3 7611 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [0,2,0,0,0,0|1,0,1]=4 7612 B9R0.4 CCCNC(=O)CC(C)=O Amb4025887 [0,2,0,0,0,0|0,0,1]=3 7613 B9R0.4 CCCNC(=S)CC(=O)[O-] Amb27797119 [0,2,0,0,0,0|1,0,1]=4 7614 B9R0.4 CCCNC(C)CC(C)Br Amb27860452 [0,2,0,0,0,0|1,0,1]=4 7615 B9R0.4 CCCN\C(C)=C/C(C)=O Amb27410248 [0,2,0,0,0,0|0,0,2]=4 7616 B9R0.4 CCCOC(=O)CC(=O)O Amb27254303 [0,2,0,0,0,0|1,0,1]=4 7617 B9R0.4 CCCOC(=O)CC(C)=O Amb17593619 [0,2,0,0,0,0|0,0,1]=3 7618 B9R0.4 CCCOC(=O)CC(N)=O Amb28125596 [0,2,0,0,0,0|1,0,1]=4 7619 B9R0.4 CCCOC(=S)CC(C)=O Amb27617801 [0,2,0,0,0,0|0,0,1]=3 7620 B9R0.4 CCCOC(C)CC(C)=O Amb28344519 [0,2,0,0,0,0|0,0,0]=2 7621 B9R0.4 CCCSC(=O)CC(C)=O Amb28126646 [0,2,0,0,0,0|0,0,1]=3 7622 B9R0.4 CCCS\C(N)=C\C(C)=O Amb27201303 [0,2,0,0,0,0|0,0,2]=4 7623 B9R0.4 CCC\C=C(\C)CC(=O)O Amb25947471 [0,2,0,0,0,0|1,0,1]=4 7624 B9R0.4 CCC\C=C(\C)CC(C)=O Amb28285885 [0,2,0,0,0,0|0,0,1]=3 7625 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [0,2,0,0,0,0|1,0,0]=3 7626 B9R0.4 CCNCC(C)CC(C)O Amb27961754 [0,2,0,0,0,0|0,0,2]=4 7627 B9R0.4 CCNCC(C)CN(C)C Amb27955050 [0,2,0,0,0,0|2,0,0]=4 7628 B9R0.4 CCNCC(N)CC(C)C Amb28143133 [0,2,0,0,0,0|1,0,1]=4 7629 B9R0.4 CCNCC(O)CN(C)C Amb8856064 [0,2,0,0,0,0|2,0,0]=4 7630 B9R0.4 CCOCC(C)CS(=O)Cl Amb32720535 [0,2,0,0,0,0|2,0,0]=4 7631 B9R0.4 CCOCC(C)CS(=O)[O-] Amb32754829 [0,2,0,0,0,0|2,0,0]=4 7632 B9R0.4 CCOCC(C)CS(N)=O Amb32720509 [0,2,0,0,0,0|2,0,0]=4 7633 B9R0.4 CCOCC(C)OC(=O)Cl Amb26020310 [0,2,0,0,0,0|2,0,0]=4 7634 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,2,0,0,0,0|1,0,0]=3 7635 B9R0.4 CCOCC(Cl)CC(N)=O Amb27878741 [0,2,0,0,0,0|1,0,0]=3 7636 B9R0.4 CCOCC(N)C=C(C)C Amb28382767 [0,2,0,0,0,0|1,0,1]=4 7637 B9R0.4 CCOCC(N)CN(C)C Amb27403408 [0,2,0,0,0,0|2,0,0]=4 7638 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [0,2,0,0,0,0|1,0,0]=3 7639 B9R0.4 CCOC[C@@H](N)CC(C)C Amb17061644 [0,2,0,0,0,0|1,0,1]=4 7640 B9R0.4 CCONC(C)CC(=O)O Amb28137486 [0,2,0,0,0,0|2,0,0]=4 7641 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [0,2,0,0,0,0|1,0,0]=3 7642 B9R0.4 CCSCC(C)CC(C)C Amb28282480 [0,2,0,0,0,0|1,0,1]=4 7643 B9R0.4 CCSCC(C)NC(C)=N Amb27454411 [0,2,0,0,0,0|2,0,0]=4 7644 B9R0.4 CCSCC(Cl)OC(C)=O Amb17940617 [0,2,0,0,0,0|1,0,0]=3 7645 B9R0.4 CCSCC(N)CC(=O)O Amb27233388 [0,2,0,0,0,0|1,0,0]=3 7646 B9R0.4 CCSCC(N)CC(C)C Amb28182459 [0,2,0,0,0,0|1,0,1]=4 7647 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [0,2,0,0,0,0|1,0,0]=3 7648 B9R0.4 CCSCC(O)CN(C)C Amb27839292 [0,2,0,0,0,0|2,0,0]=4 7649 B9R0.4 CCSC[C@@H](N)CC(C)C Amb27659366 [0,2,0,0,0,0|1,0,1]=4 7650 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [0,2,0,0,0,0|1,0,0]=3 7651 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [0,2,0,0,0,0|1,0,0]=3 7652 B9R0.4 CC\C=C\C(C)CC(=O)O Amb32954891 [0,2,0,0,0,0|1,0,1]=4 7653 B9R0.4 CC\C=C\C(N)CC(=O)O Amb25843767 [0,2,0,0,0,0|1,0,1]=4 7654 B9R0.4 CC\C=C\C(O)CC(=O)O Amb33429309 [0,2,0,0,0,0|1,0,1]=4 7655 B9R0.4 CC\C=C\[C@@H](O)CC(=O)O Amb33268250 [0,2,0,0,0,0|1,0,1]=4 7656 B9R0.4 CC\C=C\[C@H](O)CC(=O)O Amb28340505 [0,2,0,0,0,0|1,0,1]=4 7657 B9R0.4 CN(CCCF)CC(N)=O Amb28282361 [0,2,0,0,0,0|2,0,0]=4 7658 B9R0.4 CNCCC(C)CC(C)C Amb27776032 [0,2,0,0,0,0|1,0,1]=4 7659 B9R0.4 CNCCC(O)CN(C)C Amb18644293 [0,2,0,0,0,0|2,0,0]=4 7660 B9R0.4 CNCCN(C)CC(N)=O Amb27605675 [0,2,0,0,0,0|2,0,0]=4 7661 B9R0.4 CNCC[C@@H](N)CC(=O)O Amb24117036 [0,2,0,0,0,0|1,0,0]=3 7662 B9R0.4 CNCC[C@@H](N)CC(C)C Amb33163990 [0,2,0,0,0,0|1,0,1]=4 7663 B9R0.4 COCCC(=O)CC(C)=O Amb25760850 [0,2,0,0,0,0|0,0,1]=3 7664 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [0,2,0,0,0,0|1,0,0]=3 7665 B9R0.4 COCCC(C)CC(C)N Amb27839042 [0,2,0,0,0,0|1,0,1]=4 7666 B9R0.4 COCCC(C)CC(C)O Amb27399300 [0,2,0,0,0,0|0,0,2]=4 7667 B9R0.4 COCCC(C)OC(=O)Cl Amb32656123 [0,2,0,0,0,0|2,0,0]=4 7668 B9R0.4 COCCC(N)CC(=O)O Amb32687893 [0,2,0,0,0,0|1,0,0]=3 7669 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [0,2,0,0,0,0|1,0,0]=3 7670 B9R0.4 COCCN(C)CC(=O)O Amb22587006 [0,2,0,0,0,0|2,0,0]=4 7671 B9R0.4 COCCN(C)CC(=O)O Amb22587626 [0,2,0,0,0,0|2,0,0]=4 7672 B9R0.4 COCCN(C)CC(=O)O Amb9173718 [0,2,0,0,0,0|2,0,0]=4 7673 B9R0.4 COCCS(=O)CC(=O)O Amb18792760 [0,2,0,0,0,0|2,0,0]=4 7674 B9R0.4 COCCS(=O)CC(N)=O Amb28069973 [0,2,0,0,0,0|2,0,0]=4 7675 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [0,2,0,0,0,0|1,0,0]=3 7676 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [0,2,0,0,0,0|1,0,0]=3 7677 B9R0.4 COCOC(C)CC(=O)O Amb28141098 [0,2,0,0,0,0|2,0,0]=4 7678 B9R0.4 COCO[C@@H](C)CC(C)=O Amb27783387 [0,2,0,0,0,0|1,0,0]=3 7679 B9R0.4 CONCC(O)CC(=O)O Amb28071252 [0,2,0,0,0,0|2,0,0]=4 7680 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [0,2,0,0,0,0|1,0,0]=3 7681 B9R0.4 CSCCC(C)CC(C)Cl Amb28187785 [0,2,0,0,0,0|1,0,1]=4 7682 B9R0.4 CSCCC(C)NC(C)=O Amb27868995 [0,2,0,0,0,0|1,0,0]=3 7683 B9R0.4 CSCCC(N)C=C(C)C Amb28130951 [0,2,0,0,0,0|1,0,1]=4 7684 B9R0.4 CSCCC(N)CC(=O)O Amb22353181 [0,2,0,0,0,0|1,0,0]=3 7685 B9R0.4 CSCCC(N)CC(=O)O Amb30666600 [0,2,0,0,0,0|1,0,0]=3 7686 B9R0.4 CSCCC(N)CC(N)=O Amb26023351 [0,2,0,0,0,0|1,0,0]=3 7687 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [0,2,0,0,0,0|1,0,0]=3 7688 B9R0.4 CSCCN(C)CC(=O)O Amb27448940 [0,2,0,0,0,0|2,0,0]=4 7689 B9R0.4 CSCCN(C)CC(C)=O Amb27880841 [0,2,0,0,0,0|1,0,0]=3 7690 B9R0.4 CSCCN(C)CC(N)=O Amb27944587 [0,2,0,0,0,0|2,0,0]=4 7691 B9R0.4 CSCC[C@@H](N)CC(=O)O Amb26930581 [0,2,0,0,0,0|1,0,0]=3 7692 B9R0.4 CSCC[C@@H](N)CN(C)C Amb27806419 [0,2,0,0,0,0|2,0,0]=4 7693 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [0,2,0,0,0,0|1,0,0]=3 7694 B9R0.4 CSCC[C@H](N)CC(=O)O Amb16184019 [0,2,0,0,0,0|1,0,0]=3 7695 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [0,2,0,0,0,0|1,0,0]=3 7696 B9R0.4 C[C@@H](CCC=O)CC(=O)O Amb27614920 [0,2,0,0,0,0|1,0,1]=4 7697 B9R0.4 C\C=C/C[C@@H](O)CC(=O)O Amb28050083 [0,2,0,0,0,0|1,0,1]=4 7698 B9R0.4 NCCCC(N)CC(=O)O Amb18644278 [0,2,0,0,0,0|1,0,0]=3 7699 B9R0.4 NCCCC(N)CC(=O)O Amb32753541 [0,2,0,0,0,0|1,0,0]=3 7700 B9R0.4 NCCCS(=O)CC(=O)O Amb27965039 [0,2,0,0,0,0|2,0,0]=4 7701 B9R0.4 NCCCS(=O)CC(N)=O Amb28133954 [0,2,0,0,0,0|2,0,0]=4 7702 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117039 [0,2,0,0,0,0|1,0,0]=3 7703 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117927 [0,2,0,0,0,0|1,0,0]=3 7704 B9R0.4 NCCC[C@H](N)CC(=O)O Amb25757485 [0,2,0,0,0,0|1,0,0]=3 7705 B9R0.4 NCCC[C@H](N)CC(=O)O Amb32684506 [0,2,0,0,0,0|1,0,0]=3 7706 B9R0.6 C=C(C(=O)O)C(C)CCC Amb33321132 [0,2,0,0,0,0|1,0,1]=4 7707 B9R0.6 C=C(C(C)=O)[C@@H](O)CCC Amb28141638 [0,2,0,0,0,0|0,0,1]=3 7708 B9R0.6 C=C(C)C(=O)C(N)CCC Amb27881201 [0,2,0,0,0,0|1,0,1]=4 7709 B9R0.6 C=C(C)C(=O)C(O)CCC Amb27478958 [0,2,0,0,0,0|1,0,1]=4 7710 B9R0.6 C=C(C)C(N)C(C)CSC Amb28138457 [0,2,0,0,0,0|2,0,0]=4 7711 B9R0.6 C=C(C)C(N)C(C)OCC Amb27799925 [0,2,0,0,0,0|2,0,0]=4 7712 B9R0.6 C=C(C)C(O)C(C)COC Amb27770498 [0,2,0,0,0,0|2,0,0]=4 7713 B9R0.6 C=C(C)C(O)C(O)CCC Amb27858600 [0,2,0,0,0,0|1,0,0]=3 7714 B9R0.6 C=C(C)[C@@H](O)[C@H](C)CCC Amb27833712 [0,2,0,0,0,0|1,0,0]=3 7715 B9R0.6 C=C(CCC)[C@H](N)C(=O)O Amb27404609 [0,2,0,0,0,0|1,0,1]=4 7716 B9R0.6 CC(=O)C(C)C(C)CC=O Amb27827459 [0,2,0,0,0,0|1,0,1]=4 7717 B9R0.6 CC(=O)C(O)C(O)CC=O Amb28050017 [0,2,0,0,0,0|1,0,1]=4 7718 B9R0.6 CCCC(=O)C(C)C(C)=O Amb17593599 [0,2,0,0,0,0|0,0,1]=3 7719 B9R0.6 CCCC(C)C(=O)C(=O)O Amb24747027 [0,2,0,0,0,0|1,0,1]=4 7720 B9R0.6 CCCC(C)C(=O)C(C)=O Amb28144170 [0,2,0,0,0,0|0,0,1]=3 7721 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [0,2,0,0,0,0|1,0,0]=3 7722 B9R0.6 CCCC(C)C(C)C(C)O Amb28126833 [0,2,0,0,0,0|0,0,2]=4 7723 B9R0.6 CCCC(C)C(Cl)C(N)=O Amb18800738 [0,2,0,0,0,0|1,0,0]=3 7724 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [0,2,0,0,0,0|1,0,0]=3 7725 B9R0.6 CCCC(C)C(N)C(N)=O Amb27809015 [0,2,0,0,0,0|1,0,0]=3 7726 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [0,2,0,0,0,0|1,0,0]=3 7727 B9R0.6 CCCC(C)C(O)C(C)=O Amb27645205 [0,2,0,0,0,0|0,0,0]=2 7728 B9R0.6 CCCC(C)C(O)C(C)C Amb4035864 [0,2,0,0,0,0|1,0,1]=4 7729 B9R0.6 CCCC(C)C(O)C(C)O Amb28126834 [0,2,0,0,0,0|0,0,2]=4 7730 B9R0.6 CCCC(C)C(O)C(N)=O Amb27407802 [0,2,0,0,0,0|1,0,0]=3 7731 B9R0.6 CCCC(C)N(C)C(=O)Cl Amb27837818 [0,2,0,0,0,0|2,0,0]=4 7732 B9R0.6 CCCC(C)N(C)C(C)=O Amb27839148 [0,2,0,0,0,0|1,0,0]=3 7733 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [0,2,0,0,0,0|1,0,0]=3 7734 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [0,2,0,0,0,0|1,0,0]=3 7735 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [0,2,0,0,0,0|1,0,0]=3 7736 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [0,2,0,0,0,0|1,0,0]=3 7737 B9R0.6 CCCC(Cl)C(O)C(C)=O Amb25943692 [0,2,0,0,0,0|0,0,0]=2 7738 B9R0.6 CCCC(F)C(Br)C(=O)O Amb27623862 [0,2,0,0,0,0|1,0,0]=3 7739 B9R0.6 CCCC(F)C(N)C(=O)O Amb10839857 [0,2,0,0,0,0|1,0,0]=3 7740 B9R0.6 CCCC(N)C(C)C(=O)O Amb24763852 [0,2,0,0,0,0|1,0,0]=3 7741 B9R0.6 CCCC(N)C(F)C(=O)O Amb33036385 [0,2,0,0,0,0|1,0,0]=3 7742 B9R0.6 CCCC(N)C(O)C(N)=O Amb8391315 [0,2,0,0,0,0|1,0,0]=3 7743 B9R0.6 CCCC(O)C(C)C(=O)O Amb18310700 [0,2,0,0,0,0|1,0,0]=3 7744 B9R0.6 CCCC(O)C(C)C(C)O Amb17779410 [0,2,0,0,0,0|0,0,2]=4 7745 B9R0.6 CCCC(O)C(C)C(N)=O Amb27816041 [0,2,0,0,0,0|1,0,0]=3 7746 B9R0.6 CCCC(O)C(Cl)C(=O)O Amb28120934 [0,2,0,0,0,0|1,0,0]=3 7747 B9R0.6 CCCC(O)C(Cl)C(C)=O Amb26066170 [0,2,0,0,0,0|0,0,0]=2 7748 B9R0.6 CCCC(O)C(F)C(=O)O Amb33036248 [0,2,0,0,0,0|1,0,0]=3 7749 B9R0.6 CCCC(O)C(N)C(=O)O Amb18124815 [0,2,0,0,0,0|1,0,0]=3 7750 B9R0.6 CCCC(O)C(O)C(=O)O Amb27772742 [0,2,0,0,0,0|1,0,0]=3 7751 B9R0.6 CCCC(O)C(O)C(C)=O Amb28122464 [0,2,0,0,0,0|0,0,0]=2 7752 B9R0.6 CCCC(O)C(O)C(C)Cl Amb27591040 [0,2,0,0,0,0|1,0,1]=4 7753 B9R0.6 CCCC(O)C(O)C(C)O Amb27207836 [0,2,0,0,0,0|0,0,2]=4 7754 B9R0.6 CCCC(O)[C@@H](O)C(=O)O Amb27256644 [0,2,0,0,0,0|1,0,0]=3 7755 B9R0.6 CCCC(O)[C@H](N)C(=O)O Amb26635079 [0,2,0,0,0,0|1,0,0]=3 7756 B9R0.6 CCCC(S)C(N)C(=O)O Amb27860699 [0,2,0,0,0,0|1,0,0]=3 7757 B9R0.6 CCCC(S)[C@@H](N)C(=O)O Amb27759942 [0,2,0,0,0,0|1,0,0]=3 7758 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [0,2,0,0,0,0|1,0,0]=3 7759 B9R0.6 CCC[C@@H](N)C(O)C(N)=O Amb33716855 [0,2,0,0,0,0|1,0,0]=3 7760 B9R0.6 CCC[C@@H](N)[C@@H](C)C(=O)O Amb27784849 [0,2,0,0,0,0|1,0,0]=3 7761 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O Amb22747816 [0,2,0,0,0,0|1,0,0]=3 7762 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O Amb22747809 [0,2,0,0,0,0|1,0,0]=3 7763 B9R0.6 CCC[C@@H](O)[C@@H](N)C(=O)O Amb25367288 [0,2,0,0,0,0|1,0,0]=3 7764 B9R0.6 CCC[C@@H](O)[C@@H](N)C(C)C Amb28423427 [0,2,0,0,0,0|1,0,1]=4 7765 B9R0.6 CCC[C@@H](O)[C@H](N)C(=O)O Amb24715802 [0,2,0,0,0,0|1,0,0]=3 7766 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [0,2,0,0,0,0|1,0,0]=3 7767 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [0,2,0,0,0,0|1,0,0]=3 7768 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [0,2,0,0,0,0|1,0,0]=3 7769 B9R0.6 CCC[C@H](N)C(O)C(=O)O Amb27229636 [0,2,0,0,0,0|1,0,0]=3 7770 B9R0.6 CCC[C@H](N)[C@@H](C)C(=O)O Amb27618082 [0,2,0,0,0,0|1,0,0]=3 7771 B9R0.6 CCC[C@H](N)[C@@H](O)C(=O)O Amb26344900 [0,2,0,0,0,0|1,0,0]=3 7772 B9R0.6 CCC[C@H](N)[C@H](O)C(=O)O Amb25084552 [0,2,0,0,0,0|1,0,0]=3 7773 B9R0.6 CCC[C@H](O)[C@@H](N)C(=O)O Amb26415873 [0,2,0,0,0,0|1,0,0]=3 7774 B9R0.6 CCC[C@H](O)[C@H](N)C(=O)O Amb25113866 [0,2,0,0,0,0|1,0,0]=3 7775 B9R0.6 CCNC(=O)C(Cl)C(C)=O Amb26979740 [0,2,0,0,0,0|1,0,1]=4 7776 B9R0.6 CCNC(C)C(C)S(C)=O Amb27191826 [0,2,0,0,0,0|2,0,0]=4 7777 B9R0.6 CCOC(=N)C(C)C(C)=O Amb28189941 [0,2,0,0,0,0|1,0,1]=4 7778 B9R0.6 CCOC(=O)C(Br)C(C)=O Amb22232107 [0,2,0,0,0,0|1,0,1]=4 7779 B9R0.6 CCOC(=O)C(C)C(C)=O Amb3941651 [0,2,0,0,0,0|1,0,1]=4 7780 B9R0.6 CCOC(=O)C(Cl)C(C)=O Amb932833 [0,2,0,0,0,0|1,0,1]=4 7781 B9R0.6 CCOC(=O)C(F)C(C)=O Amb2687850 [0,2,0,0,0,0|1,0,1]=4 7782 B9R0.6 CCOC(=O)C(N)C(C)=O Amb18124722 [0,2,0,0,0,0|1,0,1]=4 7783 B9R0.6 CCOC(=O)C(N)C(C)=O Amb6893882 [0,2,0,0,0,0|1,0,1]=4 7784 B9R0.6 CCOC(=O)C(O)C(C)=O Amb17593653 [0,2,0,0,0,0|1,0,1]=4 7785 B9R0.6 CCOC(=S)C(C)C(C)=O Amb27945529 [0,2,0,0,0,0|1,0,1]=4 7786 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [0,2,0,0,0,0|2,0,0]=4 7787 B9R0.6 CCOC(C)C(N)C(=O)O Amb25887694 [0,2,0,0,0,0|2,0,0]=4 7788 B9R0.6 CCOC(C)C(N)C(N)=O Amb33037044 [0,2,0,0,0,0|2,0,0]=4 7789 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [0,2,0,0,0,0|2,0,0]=4 7790 B9R0.6 CCOC(C)C(O)C(C)=O Amb27226954 [0,2,0,0,0,0|1,0,0]=3 7791 B9R0.6 CCOC(C)[C@@H](N)C(=O)O Amb33065865 [0,2,0,0,0,0|2,0,0]=4 7792 B9R0.6 CCOC(C)[C@H](N)C(=O)O Amb33065957 [0,2,0,0,0,0|2,0,0]=4 7793 B9R0.6 CCO[C@H](C)[C@@H](N)C(=O)O Amb22747686 [0,2,0,0,0,0|2,0,0]=4 7794 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [0,2,0,0,0,0|2,0,0]=4 7795 B9R0.6 CCSC(C)C(N)C(=O)O Amb26359481 [0,2,0,0,0,0|2,0,0]=4 7796 B9R0.6 CC\C=C(/C)C(O)C(C)=O Amb28202152 [0,2,0,0,0,0|0,0,2]=4 7797 B9R0.6 COCC(=O)C(Cl)C(C)=O Amb27617106 [0,2,0,0,0,0|1,0,1]=4 7798 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [0,2,0,0,0,0|2,0,0]=4 7799 B9R0.6 COCC(C)C(Cl)C(N)=O Amb27614969 [0,2,0,0,0,0|2,0,0]=4 7800 B9R0.6 COCC(C)C(N)C(=O)O Amb24116980 [0,2,0,0,0,0|2,0,0]=4 7801 B9R0.6 COCC(C)C(N)C(N)=O Amb24468545 [0,2,0,0,0,0|2,0,0]=4 7802 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [0,2,0,0,0,0|2,0,0]=4 7803 B9R0.6 COCC(C)N(C)C(C)=O Amb28203512 [0,2,0,0,0,0|2,0,0]=4 7804 B9R0.6 COCC(C)[C@@H](N)C(=O)O Amb26467489 [0,2,0,0,0,0|2,0,0]=4 7805 B9R0.6 COCC(C)[C@H](N)C(=O)O Amb25729786 [0,2,0,0,0,0|2,0,0]=4 7806 B9R0.6 COCC(O)C(N)C(=O)O Amb25147551 [0,2,0,0,0,0|2,0,0]=4 7807 B9R0.6 CSCC(C)C(N)C(=O)O Amb27161222 [0,2,0,0,0,0|2,0,0]=4 7808 B9R0.6 CSCC(C)[C@H](N)C(=O)O Amb28137881 [0,2,0,0,0,0|2,0,0]=4 7809 B9R0.6 CSCC(O)C(N)C(=O)O Amb18646340 [0,2,0,0,0,0|2,0,0]=4 7810 B9R0.6 CSC[C@@H](C)C(N)C(=O)O Amb27629392 [0,2,0,0,0,0|2,0,0]=4 7811 B9R0.6 CSC[C@H](O)[C@@H](N)C(=O)O Amb28320767 [0,2,0,0,0,0|2,0,0]=4 7812 B9R0.6 C[C@@H](CCCl)[C@H](N)C(=O)O Amb28203940 [0,2,0,0,0,0|2,0,0]=4 7813 B9R0.6 C\C=C\C(C)C(C)C(C)=O Amb24570391 [0,2,0,0,0,0|0,0,2]=4 7814 B9R0.6 NC(C(=O)O)C(O)CCF Amb33196437 [0,2,0,0,0,0|2,0,0]=4 7815 B9R0.6 NCCC(F)C(N)C(=O)O Amb28204060 [0,2,0,0,0,0|2,0,0]=4 7816 B9R0.6 NCCC(N)C(N)C(=O)O Amb27759858 [0,2,0,0,0,0|2,0,0]=4 7817 B9R0.6 NCC[C@@H](F)[C@H](N)C(=O)O Amb27818085 [0,2,0,0,0,0|2,0,0]=4 7818 B9R0.6 NCC[C@@H](O)[C@H](N)C(=O)O Amb27800764 [0,2,0,0,0,0|2,0,0]=4 7819 B9R0.6 NCC[C@H](O)[C@H](N)C(=O)O Amb27263062 [0,2,0,0,0,0|2,0,0]=4 7820 B9R0.14 C#CC(CCC)NC(C)=O Amb28143405 [0,2,0,0,0,0|1,0,0]=3 7821 B9R0.14 C#CC(COC)NC(C)=O Amb28315914 [0,2,0,0,0,0|2,0,0]=4 7822 B9R0.14 C#C[C@H](CCO)OC(C)=O Amb27766533 [0,2,0,0,0,0|2,0,0]=4 7823 B9R0.14 C=C(C)CC(CBr)CCC Amb32689649 [0,2,0,0,0,0|1,0,0]=3 7824 B9R0.14 C=C(C)CC(CC)NCC Amb28143463 [0,2,0,0,0,0|2,0,0]=4 7825 B9R0.14 C=C(C)CC(CCl)CCC Amb25132141 [0,2,0,0,0,0|1,0,0]=3 7826 B9R0.14 C=C(C)CC(COC)NC Amb27477454 [0,2,0,0,0,0|2,0,0]=4 7827 B9R0.14 C=C(C)CC(COC)NN Amb27409435 [0,2,0,0,0,0|2,0,0]=4 7828 B9R0.14 C=C(C)CC(CSC)NC Amb27395580 [0,2,0,0,0,0|2,0,0]=4 7829 B9R0.14 C=C(Cl)CC(CBr)CCC Amb32689753 [0,2,0,0,0,0|1,0,1]=4 7830 B9R0.14 C=C(Cl)CC(CCl)CCC Amb32689727 [0,2,0,0,0,0|1,0,1]=4 7831 B9R0.14 C=CC(CC(=O)O)OCC Amb27882607 [0,2,0,0,0,0|2,0,0]=4 7832 B9R0.14 C=CC(CC(C)=O)OCC Amb28199980 [0,2,0,0,0,0|1,0,0]=3 7833 B9R0.14 C=CC(CCC)CC(=O)O Amb26348136 [0,2,0,0,0,0|1,0,0]=3 7834 B9R0.14 C=CC(CCC)OC(C)=O Amb22227963 [0,2,0,0,0,0|1,0,0]=3 7835 B9R0.14 C=CC(CCCl)OC(C)=O Amb27267417 [0,2,0,0,0,0|2,0,0]=4 7836 B9R0.14 CC(=O)NC(CO)CCO Amb26855329 [0,2,0,0,0,0|2,0,0]=4 7837 B9R0.14 CC(=O)N[C@H](CO)CCO Amb28043105 [0,2,0,0,0,0|2,0,0]=4 7838 B9R0.14 CC(=O)OC(C#N)CCCl Amb27770594 [0,2,0,0,0,0|2,0,0]=4 7839 B9R0.14 CC(=O)OC(CCl)CCCl Amb22359668 [0,2,0,0,0,0|2,0,0]=4 7840 B9R0.14 CCC(CC#N)CC(C)=O Amb24698909 [0,2,0,0,0,0|1,0,1]=4 7841 B9R0.14 CCC(CC=O)CC(C)=O Amb26587505 [0,2,0,0,0,0|1,0,1]=4 7842 B9R0.14 CCC(CCN)NC(C)=O Amb19028043 [0,2,0,0,0,0|2,0,0]=4 7843 B9R0.14 CCC(CCO)CC(=O)O Amb27216253 [0,2,0,0,0,0|2,0,0]=4 7844 B9R0.14 CCC(CCO)OC(C)=O Amb28050736 [0,2,0,0,0,0|2,0,0]=4 7845 B9R0.14 CCC(COC)CC(=O)O Amb18202336 [0,2,0,0,0,0|2,0,0]=4 7846 B9R0.14 CCCC(C#N)CC(=O)O Amb28132763 [0,2,0,0,0,0|1,0,0]=3 7847 B9R0.14 CCCC(C#N)CC(C)=O Amb25714287 [0,2,0,0,0,0|0,0,0]=2 7848 B9R0.14 CCCC(C#N)CC(C)C Amb27414657 [0,2,0,0,0,0|1,0,1]=4 7849 B9R0.14 CCCC(C#N)NC(N)=O Amb28126932 [0,2,0,0,0,0|2,0,0]=4 7850 B9R0.14 CCCC(C#N)NS(C)=O Amb28324178 [0,2,0,0,0,0|2,0,0]=4 7851 B9R0.14 CCCC(C#N)OC(C)=O Amb28345160 [0,2,0,0,0,0|1,0,0]=3 7852 B9R0.14 CCCC(C=O)CN(C)C Amb18644037 [0,2,0,0,0,0|2,0,0]=4 7853 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [0,2,0,0,0,0|1,0,0]=3 7854 B9R0.14 CCCC(CBr)CC(C)C Amb25712263 [0,2,0,0,0,0|1,0,1]=4 7855 B9R0.14 CCCC(CC(=O)O)SC Amb27660749 [0,2,0,0,0,0|1,0,0]=3 7856 B9R0.14 CCCC(CC(C)C)NC Amb28069955 [0,2,0,0,0,0|1,0,1]=4 7857 B9R0.14 CCCC(CC)CC(=O)O Amb18124694 [0,2,0,0,0,0|1,0,0]=3 7858 B9R0.14 CCCC(CC)CC(C)N Amb27810747 [0,2,0,0,0,0|1,0,1]=4 7859 B9R0.14 CCCC(CC)NC(C)=N Amb27466822 [0,2,0,0,0,0|2,0,0]=4 7860 B9R0.14 CCCC(CC)NC(N)=O Amb4009047 [0,2,0,0,0,0|2,0,0]=4 7861 B9R0.14 CCCC(CC)OC(=O)Cl Amb32655634 [0,2,0,0,0,0|2,0,0]=4 7862 B9R0.14 CCCC(CCl)CC(C)C Amb25039933 [0,2,0,0,0,0|1,0,1]=4 7863 B9R0.14 CCCC(CI)CC(=O)O Amb8395787 [0,2,0,0,0,0|1,0,0]=3 7864 B9R0.14 CCCC(CN)CC(=O)O Amb24587738 [0,2,0,0,0,0|1,0,0]=3 7865 B9R0.14 CCCN(C#N)CC(N)=O Amb28141564 [0,2,0,0,0,0|2,0,0]=4 7866 B9R0.14 CCC[C@@H](C#N)CC(=O)O Amb27469248 [0,2,0,0,0,0|1,0,0]=3 7867 B9R0.14 CCC[C@H](C#N)CC(=O)O Amb27219782 [0,2,0,0,0,0|1,0,0]=3 7868 B9R0.14 CCC\C(=C\C(C)=O)CC Amb26907948 [0,2,0,0,0,0|0,0,2]=4 7869 B9R0.14 CCC\C(=C\C(C)=O)NC Amb27233878 [0,2,0,0,0,0|0,0,2]=4 7870 B9R0.14 CCC\C(=C\C(C)=O)OC Amb28248004 [0,2,0,0,0,0|0,0,2]=4 7871 B9R0.14 CCC\C(CC(=O)O)=N/O Amb27755096 [0,2,0,0,0,0|1,0,1]=4 7872 B9R0.14 CCOC(CCl)CC(=O)O Amb27494074 [0,2,0,0,0,0|2,0,0]=4 7873 B9R0.14 CCOC(CCl)CC(C)=O Amb27618172 [0,2,0,0,0,0|1,0,0]=3 7874 B9R0.14 CCSC(CC)CC(=O)O Amb18788141 [0,2,0,0,0,0|2,0,0]=4 7875 B9R0.14 CC\C=C(\C#N)CC(C)=O Amb28385484 [0,2,0,0,0,0|0,0,2]=4 7876 B9R0.14 CNC(COC)CS(C)=O Amb28313125 [0,2,0,0,0,0|2,0,0]=4 7877 B9R0.14 COCC(CCl)NC(C)=O Amb27766500 [0,2,0,0,0,0|2,0,0]=4 7878 B9R0.14 COCC(CCl)OC(C)=O Amb27203315 [0,2,0,0,0,0|2,0,0]=4 7879 B9R0.14 COCC(CN)CC(=O)O Amb33428858 [0,2,0,0,0,0|2,0,0]=4 7880 B9R0.14 COC[C@H](CO)NC(C)=O Amb28342322 [0,2,0,0,0,0|2,0,0]=4 7881 B9R0.14 CSCC(CN)CC(=O)O Amb33272064 [0,2,0,0,0,0|2,0,0]=4 7882 B9R0.14 C\C=C\C(CC(C)=O)OC Amb25091874 [0,2,0,0,0,0|0,0,2]=4 7883 B9R0.14 NCC(CCF)CC(=O)O Amb33196466 [0,2,0,0,0,0|2,0,0]=4 7884 B9R0.23 C=C(C)CC(=O)C(C)CC Amb27875938 [0,2,0,0,0,0|1,0,1]=4 7885 B9R0.23 C=C(C)CC(=O)C(N)CC Amb28050385 [0,2,0,0,0,0|1,0,1]=4 7886 B9R0.23 C=C(C)CC(C)C(C)CN Amb28248400 [0,2,0,0,0,0|2,0,0]=4 7887 B9R0.23 C=C(C)CC(Cl)C(C)CC Amb27948813 [0,2,0,0,0,0|1,0,0]=3 7888 B9R0.23 C=C(C)CC(O)C(C)OC Amb28323852 [0,2,0,0,0,0|2,0,0]=4 7889 B9R0.23 C=C(C)CC(O)C(O)CO Amb28281794 [0,2,0,0,0,0|2,0,0]=4 7890 B9R0.23 C=C(C)C[C@@H](O)[C@@H](C)CO Amb27662139 [0,2,0,0,0,0|2,0,0]=4 7891 B9R0.23 C=C(C)C[C@@H](O)[C@@H](F)CO Amb28455104 [0,2,0,0,0,0|2,0,0]=4 7892 B9R0.23 C=C(C)C[C@H](O)[C@H](F)CO Amb28207133 [0,2,0,0,0,0|2,0,0]=4 7893 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,2,0,0,0,0|1,0,1]=4 7894 B9R0.23 C=C(CC)C(N)CC(N)=O Amb28247069 [0,2,0,0,0,0|1,0,1]=4 7895 B9R0.23 C=CC(C)C(C)CC(C)=O Amb27424833 [0,2,0,0,0,0|0,0,2]=4 7896 B9R0.23 C=C[C@H](Cl)[C@@H](O)CC(C)=O Amb27444616 [0,2,0,0,0,0|0,0,2]=4 7897 B9R0.23 CC(=O)CC(C)C(C)C=O Amb28049891 [0,2,0,0,0,0|1,0,1]=4 7898 B9R0.23 CC(=O)CN(C)C(C)CO Amb27603879 [0,2,0,0,0,0|2,0,0]=4 7899 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,2,0,0,0,0|1,0,0]=3 7900 B9R0.23 CC(=O)NC(C)C(O)CO Amb35660314 [0,2,0,0,0,0|2,0,0]=4 7901 B9R0.23 CC(=O)OC(C)C(C)CN Amb27838034 [0,2,0,0,0,0|2,0,0]=4 7902 B9R0.23 CC(=O)O[C@@H](Cl)[C@@H](Cl)CCl Amb28397511 [0,2,0,0,0,0|2,0,0]=4 7903 B9R0.23 CC(=O)O[C@@H](Cl)[C@H](Cl)CCl Amb28239301 [0,2,0,0,0,0|2,0,0]=4 7904 B9R0.23 CC(=O)O[C@H](C)[C@H](C)CN Amb27876408 [0,2,0,0,0,0|2,0,0]=4 7905 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,2,0,0,0,0|2,0,0]=4 7906 B9R0.23 CCC(=O)C(C)OC(C)=O Amb25909694 [0,2,0,0,0,0|1,0,1]=4 7907 B9R0.23 CCC(=O)N(C)CC(C)=O Amb27448733 [0,2,0,0,0,0|1,0,1]=4 7908 B9R0.23 CCC(=O)[C@H](C)NC(C)=O Amb27468250 [0,2,0,0,0,0|1,0,1]=4 7909 B9R0.23 CCC(Br)C(C)OC(C)=O Amb27234888 [0,2,0,0,0,0|1,0,0]=3 7910 B9R0.23 CCC(C)C(=N)CC(C)=O Amb27629398 [0,2,0,0,0,0|0,0,1]=3 7911 B9R0.23 CCC(C)C(=O)CC(C)=O Amb24544654 [0,2,0,0,0,0|0,0,1]=3 7912 B9R0.23 CCC(C)C(=O)CS(C)=O Amb27837870 [0,2,0,0,0,0|1,0,1]=4 7913 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,2,0,0,0,0|1,0,0]=3 7914 B9R0.23 CCC(C)C(C)CC(C)Cl Amb28184712 [0,2,0,0,0,0|1,0,1]=4 7915 B9R0.23 CCC(C)C(C)NC(=O)Cl Amb35625811 [0,2,0,0,0,0|2,0,0]=4 7916 B9R0.23 CCC(C)C(C)NC(C)=O Amb27778847 [0,2,0,0,0,0|1,0,0]=3 7917 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,2,0,0,0,0|1,0,0]=3 7918 B9R0.23 CCC(C)C(N)CC(C)C Amb27827525 [0,2,0,0,0,0|1,0,1]=4 7919 B9R0.23 CCC(C)C(N)CC(N)=O Amb25312995 [0,2,0,0,0,0|1,0,0]=3 7920 B9R0.23 CCC(C)C(N)CN(C)C Amb32665463 [0,2,0,0,0,0|2,0,0]=4 7921 B9R0.23 CCC(C)C(N)CN(C)C Amb6715645 [0,2,0,0,0,0|2,0,0]=4 7922 B9R0.23 CCC(C)C(N)CS(C)=O Amb27768663 [0,2,0,0,0,0|1,0,0]=3 7923 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,2,0,0,0,0|1,0,0]=3 7924 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,2,0,0,0,0|2,0,0]=4 7925 B9R0.23 CCC(C)N(C)CC(N)=O Amb27171388 [0,2,0,0,0,0|2,0,0]=4 7926 B9R0.23 CCC(C)S(=O)CC(=O)O Amb18523822 [0,2,0,0,0,0|2,0,0]=4 7927 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,2,0,0,0,0|1,0,0]=3 7928 B9R0.23 CCC(C)[C@@H](N)CC(N)=O Amb25823252 [0,2,0,0,0,0|1,0,0]=3 7929 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,2,0,0,0,0|1,0,0]=3 7930 B9R0.23 CCC(C)[C@@H](O)CC(C)=O Amb27227937 [0,2,0,0,0,0|0,0,0]=2 7931 B9R0.23 CCC(C)[C@@H](O)C[C@@H](C)O Amb28126884 [0,2,0,0,0,0|0,0,2]=4 7932 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,2,0,0,0,0|1,0,0]=3 7933 B9R0.23 CCC(C)[C@H](N)CC(N)=O Amb28050389 [0,2,0,0,0,0|1,0,0]=3 7934 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,2,0,0,0,0|1,0,0]=3 7935 B9R0.23 CCC(C)[C@H](O)CC(C)=O Amb27243299 [0,2,0,0,0,0|0,0,0]=2 7936 B9R0.23 CCC(C)[C@H](O)C[C@@H](C)O Amb27835112 [0,2,0,0,0,0|0,0,2]=4 7937 B9R0.23 CCC(C)\C(C)=C\C(C)=O Amb27196911 [0,2,0,0,0,0|0,0,2]=4 7938 B9R0.23 CCC(Cl)C(=O)NC(C)=O Amb27407290 [0,2,0,0,0,0|1,0,1]=4 7939 B9R0.23 CCC(Cl)C(C)OC(C)=O Amb28208308 [0,2,0,0,0,0|1,0,0]=3 7940 B9R0.23 CCC(N)C(C)NC(C)=O Amb27228184 [0,2,0,0,0,0|1,0,0]=3 7941 B9R0.23 CCC(N)C(O)C=C(C)C Amb29875606 [0,2,0,0,0,0|1,0,1]=4 7942 B9R0.23 CCC(O)C(C)CC(C)C Amb27985797 [0,2,0,0,0,0|1,0,1]=4 7943 B9R0.23 CCN(C)C(C)CC(=O)O Amb22587145 [0,2,0,0,0,0|2,0,0]=4 7944 B9R0.23 CCN(C)C(C)CC(=O)O Amb9399322 [0,2,0,0,0,0|2,0,0]=4 7945 B9R0.23 CCS(=O)C(C)CC(=O)O Amb19012075 [0,2,0,0,0,0|2,0,0]=4 7946 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,2,0,0,0,0|1,0,0]=3 7947 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,2,0,0,0,0|1,0,0]=3 7948 B9R0.23 CC[C@@H](Cl)[C@H](C)OC(C)=O Amb27790836 [0,2,0,0,0,0|1,0,0]=3 7949 B9R0.23 CC[C@@H](N)C(O)C=C(C)C Amb35659334 [0,2,0,0,0,0|1,0,1]=4 7950 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,2,0,0,0,0|1,0,0]=3 7951 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,2,0,0,0,0|1,0,0]=3 7952 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,2,0,0,0,0|1,0,0]=3 7953 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,2,0,0,0,0|1,0,0]=3 7954 B9R0.23 CC[C@H](C)[C@H](N)CN(C)C Amb25968066 [0,2,0,0,0,0|2,0,0]=4 7955 B9R0.23 CC[C@H](C)[C@H](N)CN(C)C Amb32665076 [0,2,0,0,0,0|2,0,0]=4 7956 B9R0.23 CC[C@H](N)C(O)C=C(C)C Amb35601445 [0,2,0,0,0,0|1,0,1]=4 7957 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,2,0,0,0,0|1,0,0]=3 7958 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,2,0,0,0,0|1,0,1]=4 7959 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,2,0,0,0,0|1,0,1]=4 7960 B9R0.23 COC(C)C(=O)CC(C)=O Amb26479508 [0,2,0,0,0,0|1,0,1]=4 7961 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,2,0,0,0,0|2,0,0]=4 7962 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,2,0,0,0,0|2,0,0]=4 7963 B9R0.23 COC(C)C(N)CC(N)=O Amb26580109 [0,2,0,0,0,0|2,0,0]=4 7964 B9R0.23 COC(C)[C@@H](C)NC(C)=O Amb27197797 [0,2,0,0,0,0|2,0,0]=4 7965 B9R0.23 COC(C)[C@H](C)NC(C)=O Amb28063340 [0,2,0,0,0,0|2,0,0]=4 7966 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,2,0,0,0,0|2,0,0]=4 7967 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,2,0,0,0,0|2,0,0]=4 7968 B9R0.23 NC(=O)CC(N)[C@H](O)CO Amb28050874 [0,2,0,0,0,0|2,0,0]=4 7969 B9R0.23 NC(=O)C[C@@H](O)[C@H](O)CO Amb27788545 [0,2,0,0,0,0|2,0,0]=4 7970 B9R0.23 NC(=O)C[C@H](O)[C@H](O)CO Amb27759937 [0,2,0,0,0,0|2,0,0]=4 7971 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,2,0,0,0,0|2,0,0]=4 7972 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,2,0,0,0,0|2,0,0]=4 7973 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,2,0,0,0,0|2,0,0]=4 7974 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,2,0,0,0,0|2,0,0]=4 7975 B9R0.34 C#CC(=O)CC(N)CCC Amb27883080 [0,2,0,0,0,0|0,0,1]=3 7976 B9R0.34 C#C\C(C)=C/C(O)CCC Amb27833603 [0,2,0,0,0,0|1,0,1]=4 7977 B9R0.34 C=C(CC)CC(Cl)CCC Amb27215882 [0,2,0,0,0,0|1,0,0]=3 7978 B9R0.34 C=C(CC)CC(N)CCC Amb28190409 [0,2,0,0,0,0|1,0,0]=3 7979 B9R0.34 C=C(CC)CC(O)CSC Amb27601015 [0,2,0,0,0,0|2,0,0]=4 7980 B9R0.34 C=C(CC)CN(C)CCC Amb28345184 [0,2,0,0,0,0|2,0,0]=4 7981 B9R0.34 C=CC(=O)CC(N)CCC Amb27842052 [0,2,0,0,0,0|0,0,1]=3 7982 B9R0.34 C=CC[C@@H](C)CC(=O)OC Amb27265905 [0,2,0,0,0,0|0,0,2]=4 7983 B9R0.34 CC(C=O)CC(C)CCO Amb27750291 [0,2,0,0,0,0|1,0,1]=4 7984 B9R0.34 CC(CCCl)OC(=O)CCl Amb27454365 [0,2,0,0,0,0|2,0,0]=4 7985 B9R0.34 CC(CCN)CC(=O)NN Amb27190971 [0,2,0,0,0,0|2,0,0]=4 7986 B9R0.34 CC(CCN)NC(=O)CN Amb28194525 [0,2,0,0,0,0|2,0,0]=4 7987 B9R0.34 CC(CCO)NC(=O)CBr Amb27229554 [0,2,0,0,0,0|2,0,0]=4 7988 B9R0.34 CCC(=O)CC(=O)COC Amb27802799 [0,2,0,0,0,0|1,0,1]=4 7989 B9R0.34 CCC(=O)CN(C)CCO Amb27776420 [0,2,0,0,0,0|2,0,0]=4 7990 B9R0.34 CCC(=O)NC(C)CCCl Amb27761060 [0,2,0,0,0,0|2,0,0]=4 7991 B9R0.34 CCC(=O)NC(C)CSC Amb27862227 [0,2,0,0,0,0|2,0,0]=4 7992 B9R0.34 CCC(=O)N[C@H](C)CCO Amb27487290 [0,2,0,0,0,0|2,0,0]=4 7993 B9R0.34 CCC(=O)OC(C)CSC Amb27651506 [0,2,0,0,0,0|2,0,0]=4 7994 B9R0.34 CCCC(=O)CC(=O)CCl Amb26464054 [0,2,0,0,0,0|0,0,1]=3 7995 B9R0.34 CCCC(=O)CC(=O)NC Amb27412600 [0,2,0,0,0,0|0,0,1]=3 7996 B9R0.34 CCCC(=O)CC(=O)OC Amb6608869 [0,2,0,0,0,0|0,0,1]=3 7997 B9R0.34 CCCC(=O)CS(=O)CC Amb27838994 [0,2,0,0,0,0|1,0,1]=4 7998 B9R0.34 CCCC(=O)C\C(C)=C\Cl Amb27954180 [0,2,0,0,0,0|1,0,1]=4 7999 B9R0.34 CCCC(=O)NC(=O)NC Amb27881301 [0,2,0,0,0,0|1,0,1]=4 8000 B9R0.34 CCCC(=O)OC(=O)CC Amb33483466 [0,2,0,0,0,0|1,0,1]=4 8001 B9R0.34 CCCC(Br)CC(C)CC Amb28320357 [0,2,0,0,0,0|1,0,1]=4 8002 B9R0.34 CCCC(C)CC(=O)NC Amb24478965 [0,2,0,0,0,0|0,0,0]=2 8003 B9R0.34 CCCC(C)CC(=O)NO Amb27604245 [0,2,0,0,0,0|1,0,0]=3 8004 B9R0.34 CCCC(C)CC(=O)OC Amb25125122 [0,2,0,0,0,0|0,0,0]=2 8005 B9R0.34 CCCC(C)CC(C)CBr Amb26876493 [0,2,0,0,0,0|1,0,1]=4 8006 B9R0.34 CCCC(C)CC(C)CCl Amb25853124 [0,2,0,0,0,0|1,0,1]=4 8007 B9R0.34 CCCC(C)CC(C)CO Amb27869680 [0,2,0,0,0,0|0,0,2]=4 8008 B9R0.34 CCCC(C)CC(N)CO Amb27770369 [0,2,0,0,0,0|1,0,1]=4 8009 B9R0.34 CCCC(C)CC(O)CC Amb27946318 [0,2,0,0,0,0|0,0,2]=4 8010 B9R0.34 CCCC(C)CC(O)CN Amb24718688 [0,2,0,0,0,0|0,0,2]=4 8011 B9R0.34 CCCC(C)C\C(N)=N\O Amb27814878 [0,2,0,0,0,0|1,0,1]=4 8012 B9R0.34 CCCC(C)NC(=N)NC Amb27656302 [0,2,0,0,0,0|2,0,0]=4 8013 B9R0.34 CCCC(C)NC(=O)CCl Amb371574 [0,2,0,0,0,0|1,0,0]=3 8014 B9R0.34 CCCC(C)OC(=O)CCl Amb27234645 [0,2,0,0,0,0|1,0,0]=3 8015 B9R0.34 CCCC(C)OC(=O)CN Amb28422290 [0,2,0,0,0,0|1,0,0]=3 8016 B9R0.34 CCCC(C)\C=C(/C)C=O Amb24381942 [0,2,0,0,0,0|0,0,1]=3 8017 B9R0.34 CCCC(C)\C=C(\C)CCl Amb27785145 [0,2,0,0,0,0|1,0,1]=4 8018 B9R0.34 CCCC(C)\C=C(\C)CO Amb27171160 [0,2,0,0,0,0|0,0,2]=4 8019 B9R0.34 CCCC(Cl)CC(=O)OC Amb27233458 [0,2,0,0,0,0|0,0,0]=2 8020 B9R0.34 CCCC(Cl)CC(C)CC Amb27779055 [0,2,0,0,0,0|1,0,1]=4 8021 B9R0.34 CCCC(Cl)OC(=O)CCl Amb27983612 [0,2,0,0,0,0|1,0,0]=3 8022 B9R0.34 CCCC(N)CC(=O)OC Amb22059489 [0,2,0,0,0,0|0,0,0]=2 8023 B9R0.34 CCCC(N)CC(=O)OC Amb28555525 [0,2,0,0,0,0|0,0,0]=2 8024 B9R0.34 CCCC(N)CC(C)CC Amb27667483 [0,2,0,0,0,0|1,0,1]=4 8025 B9R0.34 CCCC(N)CN(C)CC Amb9515280 [0,2,0,0,0,0|2,0,0]=4 8026 B9R0.34 CCCC(N)CS(=O)CC Amb27838977 [0,2,0,0,0,0|1,0,0]=3 8027 B9R0.34 CCCC(O)CC(=O)CC Amb28204050 [0,2,0,0,0,0|0,0,0]=2 8028 B9R0.34 CCCC(O)CC(=O)OC Amb21928831 [0,2,0,0,0,0|0,0,0]=2 8029 B9R0.34 CCCC(O)CC(=S)SC Amb27808749 [0,2,0,0,0,0|0,1,0]=3 8030 B9R0.34 CCCC(O)CC(C)OC Amb27617002 [0,2,0,0,0,0|0,0,2]=4 8031 B9R0.34 CCCC(O)CC(O)CC Amb9134757 [0,2,0,0,0,0|0,0,2]=4 8032 B9R0.34 CCCC(O)C[C@@H](C)CC Amb27470864 [0,2,0,0,0,0|1,0,1]=4 8033 B9R0.34 CCCC(O)\C=C(\C)OC Amb27424758 [0,2,0,0,0,0|0,0,2]=4 8034 B9R0.34 CCC[C@@H](C)C[C@@H](C)CO Amb26920680 [0,2,0,0,0,0|0,0,2]=4 8035 B9R0.34 CCC[C@@H](C)C[C@H](C)CO Amb26632583 [0,2,0,0,0,0|0,0,2]=4 8036 B9R0.34 CCC[C@@H](N)CC(=O)OC Amb26034917 [0,2,0,0,0,0|0,0,0]=2 8037 B9R0.34 CCC[C@@H](N)CC(=O)OC Amb33456865 [0,2,0,0,0,0|0,0,0]=2 8038 B9R0.34 CCC[C@@H](N)CC(C)OC Amb27880809 [0,2,0,0,0,0|0,0,2]=4 8039 B9R0.34 CCC[C@@H](N)CN(C)OC Amb28369372 [0,2,0,0,0,0|1,0,1]=4 8040 B9R0.34 CCC[C@@H](O)CC(=O)NC Amb27949385 [0,2,0,0,0,0|0,0,0]=2 8041 B9R0.34 CCC[C@@H](O)CC(=O)OC Amb26516817 [0,2,0,0,0,0|0,0,0]=2 8042 B9R0.34 CCC[C@@H](O)CN(C)N=O Amb27766549 [0,2,0,0,0,0|1,0,0]=3 8043 B9R0.34 CCC[C@H](N)CC(=O)OC Amb25147500 [0,2,0,0,0,0|0,0,0]=2 8044 B9R0.34 CCC[C@H](N)CC(=O)OC Amb33457265 [0,2,0,0,0,0|0,0,0]=2 8045 B9R0.34 CCC[C@H](O)CC(=O)NC Amb27389947 [0,2,0,0,0,0|0,0,0]=2 8046 B9R0.34 CCC[C@H](O)CC(=O)NN Amb27770510 [0,2,0,0,0,0|1,0,0]=3 8047 B9R0.34 CCC[C@H](O)CC(=O)OC Amb26357957 [0,2,0,0,0,0|0,0,0]=2 8048 B9R0.34 CCC\C(N)=C\C(=O)OC Amb27615138 [0,2,0,0,0,0|0,0,2]=4 8049 B9R0.34 CCNC(=O)CC(=O)OC Amb17399890 [0,2,0,0,0,0|1,0,1]=4 8050 B9R0.34 CCNC(C)CC(=O)OC Amb9398370 [0,2,0,0,0,0|1,0,0]=3 8051 B9R0.34 CCOC(=N)CC(=O)OC Amb27259055 [0,2,0,0,0,0|1,0,1]=4 8052 B9R0.34 CCOC(=O)CC(=O)CBr Amb8384387 [0,2,0,0,0,0|1,0,1]=4 8053 B9R0.34 CCOC(=O)CC(=O)CC Amb4477016 [0,2,0,0,0,0|1,0,1]=4 8054 B9R0.34 CCOC(=O)CC(=O)CCl Amb932839 [0,2,0,0,0,0|1,0,1]=4 8055 B9R0.34 CCOC(=O)CC(=O)CF Amb25140068 [0,2,0,0,0,0|1,0,1]=4 8056 B9R0.34 CCOC(=O)CC(=O)CI Amb10070790 [0,2,0,0,0,0|1,0,1]=4 8057 B9R0.34 CCOC(=O)CC(=O)CN Amb18636481 [0,2,0,0,0,0|1,0,1]=4 8058 B9R0.34 CCOC(=O)CC(=O)CO Amb25759916 [0,2,0,0,0,0|1,0,1]=4 8059 B9R0.34 CCOC(=O)CC(=O)CS Amb20623663 [0,2,0,0,0,0|1,0,1]=4 8060 B9R0.34 CCOC(=O)CC(=O)NC Amb8387120 [0,2,0,0,0,0|1,0,1]=4 8061 B9R0.34 CCOC(=O)CC(=O)OC Amb27628258 [0,2,0,0,0,0|1,0,1]=4 8062 B9R0.34 CCOC(O)CC(=O)CCl Amb28255324 [0,2,0,0,0,0|1,0,0]=3 8063 B9R0.34 CCS(=O)CC(O)CCN Amb28367866 [0,2,0,0,0,0|2,0,0]=4 8064 B9R0.34 CCS(=O)CC(O)CNC Amb28078014 [0,2,0,0,0,0|2,0,0]=4 8065 B9R0.34 CNC(=O)CS(=O)CCCl Amb27666883 [0,2,0,0,0,0|2,0,0]=4 8066 B9R0.34 CNC(=O)NC(C)CSC Amb27466781 [0,2,0,0,0,0|2,0,0]=4 8067 B9R0.34 CNCC(C)NC(=O)NC Amb27464336 [0,2,0,0,0,0|2,0,0]=4 8068 B9R0.34 CNCC(C)OC(=O)OC Amb27635719 [0,2,0,0,0,0|2,0,0]=4 8069 B9R0.34 CNC[C@H](O)CC(=O)OC Amb28315995 [0,2,0,0,0,0|1,0,0]=3 8070 B9R0.34 COC(=O)CC(=O)CCF Amb33196430 [0,2,0,0,0,0|1,0,1]=4 8071 B9R0.34 COC(=O)CC(=O)CSC Amb24441248 [0,2,0,0,0,0|1,0,1]=4 8072 B9R0.34 COC(=O)CC(C)CCN Amb24546678 [0,2,0,0,0,0|1,0,0]=3 8073 B9R0.34 COC(=O)CC(N)CCO Amb27250761 [0,2,0,0,0,0|1,0,0]=3 8074 B9R0.34 COC(=O)CC(O)CCF Amb33196113 [0,2,0,0,0,0|1,0,0]=3 8075 B9R0.34 COC(=O)CC(O)CSC Amb24412887 [0,2,0,0,0,0|1,0,0]=3 8076 B9R0.34 COC(=O)CN(C)CCN Amb22059127 [0,2,0,0,0,0|2,0,0]=4 8077 B9R0.34 COC(=O)CN(C)CCN Amb32686889 [0,2,0,0,0,0|2,0,0]=4 8078 B9R0.34 COC(=O)CN(C)CCO Amb27837585 [0,2,0,0,0,0|2,0,0]=4 8079 B9R0.34 COC(=O)C[C@@H](C)CCO Amb27946901 [0,2,0,0,0,0|1,0,0]=3 8080 B9R0.34 COC(=O)C[C@@H](O)CC#N Amb27838940 [0,2,0,0,0,0|1,0,1]=4 8081 B9R0.34 COC(=O)C[C@@H](O)CCF Amb33196115 [0,2,0,0,0,0|1,0,0]=3 8082 B9R0.34 COC(=O)C[C@@H](O)CSC Amb25266160 [0,2,0,0,0,0|1,0,0]=3 8083 B9R0.34 COC(=O)C[C@H](O)CC#N Amb26319177 [0,2,0,0,0,0|1,0,1]=4 8084 B9R0.34 COC(=O)C[C@H](O)CCF Amb33196104 [0,2,0,0,0,0|1,0,0]=3 8085 B9R0.34 COC(=O)C[C@H](O)CSC Amb33271735 [0,2,0,0,0,0|1,0,0]=3 8086 B9R0.34 COC(=O)NC(C)CCN Amb28429790 [0,2,0,0,0,0|2,0,0]=4 8087 B9R0.34 COC(=O)NC(C)CSC Amb27254674 [0,2,0,0,0,0|2,0,0]=4 8088 B9R0.34 COC(=O)N[C@H](C)CCO Amb27261062 [0,2,0,0,0,0|2,0,0]=4 8089 B9R0.34 COC(=O)OC(C)CCO Amb28065268 [0,2,0,0,0,0|2,0,0]=4 8090 B9R0.34 COCC(=O)CC(=O)OC Amb2694679 [0,2,0,0,0,0|1,0,1]=4 8091 B9R0.34 COCC(C)CC(=O)CN Amb28206071 [0,2,0,0,0,0|1,0,0]=3 8092 B9R0.34 COCC(C)CC(=O)NO Amb27485247 [0,2,0,0,0,0|2,0,0]=4 8093 B9R0.34 COCC(C)CC(C)C=O Amb27765630 [0,2,0,0,0,0|1,0,1]=4 8094 B9R0.34 COCC(C)CN(C)C=O Amb28049825 [0,2,0,0,0,0|2,0,0]=4 8095 B9R0.34 COCC(C)NC(=O)CBr Amb17327377 [0,2,0,0,0,0|2,0,0]=4 8096 B9R0.34 COCC(C)NC(=O)CCl Amb1204382 [0,2,0,0,0,0|2,0,0]=4 8097 B9R0.34 COCC(C)NC(=O)CN Amb6258707 [0,2,0,0,0,0|2,0,0]=4 8098 B9R0.34 COCC(C)NC(=O)CS Amb28124284 [0,2,0,0,0,0|2,0,0]=4 8099 B9R0.34 COCC(C)OC(=O)CCl Amb27250711 [0,2,0,0,0,0|2,0,0]=4 8100 B9R0.34 COCC(C)OC(=O)CN Amb18114762 [0,2,0,0,0,0|2,0,0]=4 8101 B9R0.34 COCC(C)\C=C(\C)C=O Amb27881826 [0,2,0,0,0,0|1,0,1]=4 8102 B9R0.34 COCC(N)CC(=O)OC Amb24393406 [0,2,0,0,0,0|1,0,0]=3 8103 B9R0.34 COCC(N)CC(=O)OC Amb32753354 [0,2,0,0,0,0|1,0,0]=3 8104 B9R0.34 COCC(O)CC(=O)OC Amb26613027 [0,2,0,0,0,0|1,0,0]=3 8105 B9R0.34 COC[C@@H](N)CC(=O)OC Amb25118860 [0,2,0,0,0,0|1,0,0]=3 8106 B9R0.34 COC[C@@H](N)CC(=O)OC Amb32674883 [0,2,0,0,0,0|1,0,0]=3 8107 B9R0.34 COC[C@@H](O)CC(=O)OC Amb27664269 [0,2,0,0,0,0|1,0,0]=3 8108 B9R0.34 COC[C@H](N)CC(=O)OC Amb24518573 [0,2,0,0,0,0|1,0,0]=3 8109 B9R0.34 COC[C@H](N)CC(=O)OC Amb33330971 [0,2,0,0,0,0|1,0,0]=3 8110 B9R0.34 COC[C@H](O)CC(=O)OC Amb26035488 [0,2,0,0,0,0|1,0,0]=3 8111 B9R0.34 CONC(C)CC(=O)OC Amb28322749 [0,2,0,0,0,0|2,0,0]=4 8112 B9R0.34 CSCC(C)NC(=O)CBr Amb27984508 [0,2,0,0,0,0|2,0,0]=4 8113 B9R0.34 CSCC(C)NC(=O)CCl Amb27806679 [0,2,0,0,0,0|2,0,0]=4 8114 B9R0.34 CSCC(C)NC(=O)CN Amb27164701 [0,2,0,0,0,0|2,0,0]=4 8115 B9R0.34 C\C=C\C(O)CC(=O)OC Amb27171766 [0,2,0,0,0,0|0,0,2]=4 8116 B9R0.34 C\C=C\[C@@H](N)CC(=O)OC Amb27394449 [0,2,0,0,0,0|0,0,2]=4 8117 B9R0.34 C\C=C\[C@H](O)CC(=O)OC Amb27980361 [0,2,0,0,0,0|0,0,2]=4 8118 B9R0.44 CC(CCN)CS(C)(=O)=O Amb33056372 [0,2,0,0,0,0|2,0,0]=4 8119 B9R0.44 CCCC(C)CC(C)(C)C Amb26567408 [0,2,0,0,0,0|1,0,1]=4 8120 B9R0.44 CCCC(C)CC(C)(C)N Amb19026064 [0,2,0,0,0,0|1,0,1]=4 8121 B9R0.44 CCCC(C)CC(C)(C)O Amb27633139 [0,2,0,0,0,0|0,0,2]=4 8122 B9R0.44 CCCC(C)CS(=O)(=O)Cl Amb18325512 [0,2,0,0,0,0|2,0,0]=4 8123 B9R0.44 CCCC(C)CS(=O)(=O)F Amb19515127 [0,2,0,0,0,0|2,0,0]=4 8124 B9R0.44 CCCC(C)CS(N)(=O)=O Amb18800966 [0,2,0,0,0,0|2,0,0]=4 8125 B9R0.44 CCCC(C)NS(C)(=O)=O Amb3886667 [0,2,0,0,0,0|2,0,0]=4 8126 B9R0.44 CCCC(N)CS(=O)(=O)Cl Amb27838077 [0,2,0,0,0,0|2,0,0]=4 8127 B9R0.44 CCCC(O)C[N+](C)(C)C Amb27764769 [0,2,0,0,0,0|2,0,0]=4 8128 B9R0.44 CCNC(C)CS(C)(=O)=O Amb19029792 [0,2,0,0,0,0|2,0,0]=4 8129 B9R0.44 CNCC(O)CS(C)(=O)=O Amb17082868 [0,2,0,0,0,0|2,0,0]=4 8130 B9R0.44 CP(=O)(O)CC(O)CCN Amb27950547 [0,2,0,0,0,0|2,0,0]=4 8131 B9R0.44 CS(=O)(=O)CC(F)CCN Amb33055793 [0,2,0,0,0,0|2,0,0]=4 8132 B9R0.44 CS(=O)(=O)CC(N)CCO Amb26605528 [0,2,0,0,0,0|2,0,0]=4 8133 B9R0.44 CS(=O)(=O)CC(O)CCN Amb24435108 [0,2,0,0,0,0|2,0,0]=4 8134 B9R0.44 CS(=O)(=O)C[C@@H](O)CCN Amb33055792 [0,2,0,0,0,0|2,0,0]=4 8135 B9R0.44 CS(=O)(=O)C[C@H](O)CCN Amb33055781 [0,2,0,0,0,0|2,0,0]=4 8136 B9R0.53 C=C(C)CC(C)CC(C)=O Amb28206391 [0,2,0,0,0,0|0,0,1]=3 8137 B9R0.53 C=C(C)CC(C)CC(C)C Amb27391628 [0,2,0,0,0,0|1,0,0]=3 8138 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,2,0,0,0,0|1,0,1]=4 8139 B9R0.53 C=C(C)CC(O)CC(=C)C Amb4011928 [0,2,0,0,0,0|1,0,1]=4 8140 B9R0.53 C=C(C)CC(O)CN(C)C Amb27871979 [0,2,0,0,0,0|2,0,0]=4 8141 B9R0.53 C=C(C)CN(C)C[C@H](C)N Amb28135561 [0,2,0,0,0,0|2,0,0]=4 8142 B9R0.53 C=C(C)C[C@@H](O)CC(C)C Amb28050778 [0,2,0,0,0,0|1,0,0]=3 8143 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,2,0,0,0,0|1,0,1]=4 8144 B9R0.53 CC(=N)NC(C)CC(C)C Amb27613701 [0,2,0,0,0,0|2,0,0]=4 8145 B9R0.53 CC(=O)CC(=O)CC(C)=O Amb4018226 [0,2,0,0,0,0|0,0,2]=4 8146 B9R0.53 CC(=O)CC(=O)CC(C)C Amb8516702 [0,2,0,0,0,0|0,0,1]=3 8147 B9R0.53 CC(=O)CC(=O)OC(C)C Amb6608870 [0,2,0,0,0,0|1,0,1]=4 8148 B9R0.53 CC(=O)CC(C)CC(C)C Amb20621119 [0,2,0,0,0,0|0,0,0]=2 8149 B9R0.53 CC(=O)CC(C)CN(C)C Amb28252208 [0,2,0,0,0,0|1,0,0]=3 8150 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [0,2,0,0,0,0|0,0,0]=2 8151 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [0,2,0,0,0,0|1,0,1]=4 8152 B9R0.53 CC(=O)C[C@@H](O)CC(C)C Amb27471828 [0,2,0,0,0,0|0,0,0]=2 8153 B9R0.53 CC(=O)C[C@H](C)OC(C)=O Amb25863249 [0,2,0,0,0,0|1,0,1]=4 8154 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [0,2,0,0,0,0|0,0,0]=2 8155 B9R0.53 CC(=O)C\C(C)=N\C(C)O Amb27640588 [0,2,0,0,0,0|1,0,1]=4 8156 B9R0.53 CC(=O)NC(C)CC(C)Br Amb28255391 [0,2,0,0,0,0|1,0,0]=3 8157 B9R0.53 CC(=O)NC(C)CC(C)Cl Amb27851051 [0,2,0,0,0,0|1,0,0]=3 8158 B9R0.53 CC(=O)NC(C)CS(C)=O Amb27243706 [0,2,0,0,0,0|2,0,0]=4 8159 B9R0.53 CC(=O)NC(C)OC(C)C Amb22729317 [0,2,0,0,0,0|2,0,0]=4 8160 B9R0.53 CC(=O)N[C@H](C)CN(C)C Amb27198150 [0,2,0,0,0,0|2,0,0]=4 8161 B9R0.53 CC(=O)OC(C)CC(C)Br Amb27257886 [0,2,0,0,0,0|1,0,0]=3 8162 B9R0.53 CC(=O)OC(C)CC(C)C Amb22733405 [0,2,0,0,0,0|1,0,0]=3 8163 B9R0.53 CC(=O)OC(C)CC(C)Cl Amb28119662 [0,2,0,0,0,0|1,0,0]=3 8164 B9R0.53 CC(=O)OC(C)CN(C)C Amb4020548 [0,2,0,0,0,0|2,0,0]=4 8165 B9R0.53 CC(=O)O[C@H](C)C[C@@H](C)Cl Amb27945614 [0,2,0,0,0,0|1,0,0]=3 8166 B9R0.53 CC(=O)O[C@H](C)C[C@H](C)Cl Amb27433810 [0,2,0,0,0,0|1,0,0]=3 8167 B9R0.53 CC(=O)\C=C(/C)CC(C)C Amb28063284 [0,2,0,0,0,0|0,0,2]=4 8168 B9R0.53 CC(=O)\C=C(/O)CC(C)C Amb28288330 [0,2,0,0,0,0|0,0,2]=4 8169 B9R0.53 CC(C)=CC(O)CC(C)N Amb29875644 [0,2,0,0,0,0|1,0,1]=4 8170 B9R0.53 CC(C)CC(=N)CC(N)=O Amb27827487 [0,2,0,0,0,0|1,0,1]=4 8171 B9R0.53 CC(C)CC(Br)CC(C)C Amb27851363 [0,2,0,0,0,0|1,0,1]=4 8172 B9R0.53 CC(C)CC(Br)NC(N)=O Amb27635818 [0,2,0,0,0,0|2,0,0]=4 8173 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,2,0,0,0,0|1,0,0]=3 8174 B9R0.53 CC(C)CC(C)CC(C)C Amb10069382 [0,2,0,0,0,0|1,0,1]=4 8175 B9R0.53 CC(C)CC(C)CC(C)O Amb33546273 [0,2,0,0,0,0|0,0,2]=4 8176 B9R0.53 CC(C)CC(C)NC(=O)Cl Amb35625633 [0,2,0,0,0,0|2,0,0]=4 8177 B9R0.53 CC(C)CC(C)OC(=O)Cl Amb33531475 [0,2,0,0,0,0|2,0,0]=4 8178 B9R0.53 CC(C)CC(Cl)OC(=O)Cl Amb27618475 [0,2,0,0,0,0|2,0,0]=4 8179 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,2,0,0,0,0|1,0,0]=3 8180 B9R0.53 CC(C)CC(N)CC(C)C Amb19373200 [0,2,0,0,0,0|1,0,1]=4 8181 B9R0.53 CC(C)CC(N)CC(C)C Amb6718929 [0,2,0,0,0,0|1,0,1]=4 8182 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,2,0,0,0,0|1,0,0]=3 8183 B9R0.53 CC(C)CC(N)CN(C)C Amb6715642 [0,2,0,0,0,0|2,0,0]=4 8184 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,2,0,0,0,0|1,0,0]=3 8185 B9R0.53 CC(C)CC(O)CC(C)C Amb9273985 [0,2,0,0,0,0|1,0,1]=4 8186 B9R0.53 CC(C)CC(O)CN(C)C Amb28369135 [0,2,0,0,0,0|2,0,0]=4 8187 B9R0.53 CC(C)CC(S)CC(C)C Amb25056368 [0,2,0,0,0,0|1,0,1]=4 8188 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,2,0,0,0,0|2,0,0]=4 8189 B9R0.53 CC(C)CN(C)CC(N)=O Amb28204122 [0,2,0,0,0,0|2,0,0]=4 8190 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,2,0,0,0,0|1,0,0]=3 8191 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,2,0,0,0,0|1,0,0]=3 8192 B9R0.53 CC(C)C[C@@H](N)CN(C)C Amb26603723 [0,2,0,0,0,0|2,0,0]=4 8193 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,2,0,0,0,0|1,0,0]=3 8194 B9R0.53 CC(C)C[C@@H](O)C[C@H](C)O Amb27594620 [0,2,0,0,0,0|0,0,2]=4 8195 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,2,0,0,0,0|1,0,0]=3 8196 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,2,0,0,0,0|1,0,0]=3 8197 B9R0.53 CC(C)C[C@H](N)CC(N)=O Amb28120875 [0,2,0,0,0,0|1,0,0]=3 8198 B9R0.53 CC(C)C[C@H](N)CN(C)C Amb24435743 [0,2,0,0,0,0|2,0,0]=4 8199 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,2,0,0,0,0|1,0,0]=3 8200 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,2,0,0,0,0|2,0,0]=4 8201 B9R0.53 CC(C)NC(C)CC(N)=O Amb17231987 [0,2,0,0,0,0|2,0,0]=4 8202 B9R0.53 CC(C)NC(C)CS(C)=O Amb28434480 [0,2,0,0,0,0|2,0,0]=4 8203 B9R0.53 CC(CC(=O)O)CN(C)C Amb27948144 [0,2,0,0,0,0|2,0,0]=4 8204 B9R0.53 CC(CC(=O)O)CN(C)C Amb32680754 [0,2,0,0,0,0|2,0,0]=4 8205 B9R0.53 CC(C[C@H](C)Cl)C[C@@H](C)Cl Amb28128433 [0,2,0,0,0,0|1,0,1]=4 8206 B9R0.53 CC(C[C@H](C)O)C[C@@H](C)O Amb28453488 [0,2,0,0,0,0|0,0,2]=4 8207 B9R0.53 CC(Cl)CC(Cl)CC(=O)O Amb28436914 [0,2,0,0,0,0|1,0,0]=3 8208 B9R0.53 CC(Cl)CC(Cl)CC(C)Cl Amb28049988 [0,2,0,0,0,0|1,0,1]=4 8209 B9R0.53 CC(N)CC(Cl)CC(C)N Amb27756403 [0,2,0,0,0,0|1,0,1]=4 8210 B9R0.53 CC(O)CC(C)NC(N)=O Amb27227923 [0,2,0,0,0,0|2,0,0]=4 8211 B9R0.53 CC(O)CC(C)NS(C)=O Amb28319318 [0,2,0,0,0,0|2,0,0]=4 8212 B9R0.53 CC(O)CC(O)C[C@H](C)O Amb28050707 [0,2,0,0,0,0|0,0,2]=4 8213 B9R0.53 CN(C)CC(O)CC(=O)O Amb4477325 [0,2,0,0,0,0|2,0,0]=4 8214 B9R0.53 CN(C)C[C@H](O)CC(=O)O Amb10069803 [0,2,0,0,0,0|2,0,0]=4 8215 B9R0.53 CS(=O)C[C@H](N)CC(=O)O Amb27776743 [0,2,0,0,0,0|2,0,0]=4 8216 B9R0.53 C[C@@H](O)CN(C)CC(N)=O Amb27979416 [0,2,0,0,0,0|2,0,0]=4 8217 B9R0.53 C[C@H](Cl)C[C@H](Cl)C[C@@H](C)Cl Amb27799510 [0,2,0,0,0,0|1,0,1]=4 8218 B9R0.53 C[C@H](O)CC(O)C[C@@H](C)O Amb28189156 [0,2,0,0,0,0|0,0,2]=4 8219 B9R0.58 C#CCC(C)(C)CC(C)=O Amb17593505 [0,2,0,0,0,0|0,0,2]=4 8220 B9R0.58 C=C(C)CC(C)(C)CCC Amb27392068 [0,2,0,0,0,0|1,0,0]=3 8221 B9R0.58 C=C(C)CC(C)(C)CCN Amb27622643 [0,2,0,0,0,0|2,0,0]=4 8222 B9R0.58 C=C(C)CC(C)(O)CCC Amb27594008 [0,2,0,0,0,0|1,0,0]=3 8223 B9R0.58 C=C(C)C[C@@](C)(O)CCO Amb27839202 [0,2,0,0,0,0|2,0,0]=4 8224 B9R0.58 C=CC[C@@](C)(O)CC(C)=O Amb28399049 [0,2,0,0,0,0|0,0,2]=4 8225 B9R0.58 CC(=O)CC(C)(C)CCBr Amb28057686 [0,2,0,0,0,0|1,0,0]=3 8226 B9R0.58 CC(=O)NC(C)(C)CCBr Amb27835446 [0,2,0,0,0,0|2,0,0]=4 8227 B9R0.58 CC(=O)NC(C)(C)CCO Amb28245776 [0,2,0,0,0,0|2,0,0]=4 8228 B9R0.58 CC(=O)OC(C)(C)CCCl Amb27770359 [0,2,0,0,0,0|2,0,0]=4 8229 B9R0.58 CC(C)(CCCl)CC(=O)O Amb18646188 [0,2,0,0,0,0|2,0,0]=4 8230 B9R0.58 CC(C)(CCF)CC(=O)O Amb33196450 [0,2,0,0,0,0|2,0,0]=4 8231 B9R0.58 CC(O)(CCCl)CC(=O)O Amb28134781 [0,2,0,0,0,0|2,0,0]=4 8232 B9R0.58 CC(O)(CCS)CC(=O)O Amb27232619 [0,2,0,0,0,0|2,0,0]=4 8233 B9R0.58 CCCC(C)(C)CC(=O)O Amb22229019 [0,2,0,0,0,0|1,0,0]=3 8234 B9R0.58 CCCC(C)(C)CC(C)Cl Amb27982182 [0,2,0,0,0,0|1,0,1]=4 8235 B9R0.58 CCCC(C)(C)CC(C)N Amb27839062 [0,2,0,0,0,0|1,0,1]=4 8236 B9R0.58 CCCC(C)(C)CC(C)O Amb27981022 [0,2,0,0,0,0|0,0,2]=4 8237 B9R0.58 CCCC(C)(C)NC(=O)Cl Amb35625899 [0,2,0,0,0,0|2,0,0]=4 8238 B9R0.58 CCCC(C)(C)NC(N)=O Amb28050043 [0,2,0,0,0,0|2,0,0]=4 8239 B9R0.58 CCCC(C)(C)OC(C)=O Amb27875922 [0,2,0,0,0,0|1,0,0]=3 8240 B9R0.58 CCCC(C)(N)CC(=O)O Amb27489892 [0,2,0,0,0,0|1,0,0]=3 8241 B9R0.58 CCCC(C)(N)CC(C)C Amb27623802 [0,2,0,0,0,0|1,0,1]=4 8242 B9R0.58 CCCC(C)(N)CC(N)=O Amb33255835 [0,2,0,0,0,0|1,0,0]=3 8243 B9R0.58 CCCC(C)(O)CC(=O)O Amb18310709 [0,2,0,0,0,0|1,0,0]=3 8244 B9R0.58 CCCC(C)(O)CC(C)C Amb27815481 [0,2,0,0,0,0|1,0,1]=4 8245 B9R0.58 CCCC(F)(F)CC(=O)O Amb24482478 [0,2,0,0,0,0|1,0,0]=3 8246 B9R0.58 CCCS(=O)(=O)CC(=O)O Amb6256569 [0,2,0,0,0,0|2,0,0]=4 8247 B9R0.58 CCCS(=O)(=O)CC(C)=O Amb26971329 [0,2,0,0,0,0|1,0,0]=3 8248 B9R0.58 CCCS(=O)(=O)CC(N)=O Amb27401358 [0,2,0,0,0,0|2,0,0]=4 8249 B9R0.58 CCNC(C)(C)CC(=O)O Amb27622447 [0,2,0,0,0,0|2,0,0]=4 8250 B9R0.58 CCNC(C)(C)CC(N)=O Amb28184404 [0,2,0,0,0,0|2,0,0]=4 8251 B9R0.58 CCOC(C)(C)CC(C)=O Amb27409443 [0,2,0,0,0,0|1,0,0]=3 8252 B9R0.58 CCSC(C)(C)CC(=O)O Amb27406310 [0,2,0,0,0,0|2,0,0]=4 8253 B9R0.58 CNCC(C)(C)CC(=O)O Amb24116872 [0,2,0,0,0,0|2,0,0]=4 8254 B9R0.58 CNCC(F)(F)CC(=O)O Amb33347090 [0,2,0,0,0,0|2,0,0]=4 8255 B9R0.58 COCC(C)(C)CC(=O)O Amb33551195 [0,2,0,0,0,0|2,0,0]=4 8256 B9R0.58 COCC(C)(N)CC(=O)O Amb27158999 [0,2,0,0,0,0|2,0,0]=4 8257 B9R0.58 COCC(C)(N)CC(=O)O Amb33620555 [0,2,0,0,0,0|2,0,0]=4 8258 B9R0.58 COCC(C)(N)CC(N)=O Amb33254819 [0,2,0,0,0,0|2,0,0]=4 8259 B9R0.58 COCC(C)(O)CC(=O)O Amb18312293 [0,2,0,0,0,0|2,0,0]=4 8260 B9R0.58 COCC(F)(F)CC(=O)O Amb33337739 [0,2,0,0,0,0|2,0,0]=4 8261 B9R0.58 CSCC(C)(C)CC(=O)O Amb33272052 [0,2,0,0,0,0|2,0,0]=4 8262 B9R0.58 CSCC(C)(N)CC(=O)O Amb33254915 [0,2,0,0,0,0|2,0,0]=4 8263 B9R0.58 CSCC(C)(N)CC(N)=O Amb32787422 [0,2,0,0,0,0|2,0,0]=4 8264 B9R0.58 CSCC(C)(O)CC(=O)O Amb33036115 [0,2,0,0,0,0|2,0,0]=4 8265 B9R0.58 CSCC(F)(F)CC(=O)O Amb33413045 [0,2,0,0,0,0|2,0,0]=4 8266 B9R0.58 C\N=N\C(C)(C)CC(C)=O Amb28202069 [0,2,0,0,0,0|2,0,0]=4 8267 B9R0.58 O=C(O)CC(F)(F)CCF Amb33399980 [0,2,0,0,0,0|2,0,0]=4 8268 B9R0.1 C#CC(=O)CSCC(C)C Amb27468346 [0,2,0,0,0,0|1,0,1]=4 8269 B9R0.1 C#CC(=O)NCC[C@H](C)O Amb28049725 [0,2,0,0,0,0|1,0,1]=4 8270 B9R0.1 C#CC(C)CCCC(=O)O Amb27273525 [0,2,0,0,0,0|1,0,0]=3 8271 B9R0.1 C#CC(C)CCCC(C)=O Amb26936323 [0,2,0,0,0,0|0,0,0]=2 8272 B9R0.1 C#CC(C)OCCC(=O)O Amb28041173 [0,2,0,0,0,0|2,0,0]=4 8273 B9R0.1 C=C(Br)CCCC(=O)OC Amb24717516 [0,2,0,0,0,0|0,0,2]=4 8274 B9R0.1 C=C(Br)CNC[C@@H](O)CC Amb27770561 [0,2,0,0,0,0|1,0,1]=4 8275 B9R0.1 C=C(Br)CSCC(C)CC Amb27457594 [0,2,0,0,0,0|1,0,1]=4 8276 B9R0.1 C=C(C)CCCC(=O)OC Amb25995990 [0,2,0,0,0,0|0,0,1]=3 8277 B9R0.1 C=C(C)CCCC(C)CCl Amb27761160 [0,2,0,0,0,0|1,0,0]=3 8278 B9R0.1 C=C(C)CCCC(C)CO Amb25888306 [0,2,0,0,0,0|1,0,0]=3 8279 B9R0.1 C=C(C)CCC[C@H](C)C=O Amb27230540 [0,2,0,0,0,0|1,0,0]=3 8280 B9R0.1 C=C(C)CCC[C@H](C)CO Amb28369841 [0,2,0,0,0,0|1,0,0]=3 8281 B9R0.1 C=C(C)CCNC(=O)CCl Amb27974797 [0,2,0,0,0,0|1,0,1]=4 8282 B9R0.1 C=C(C)CCNC(=O)CS Amb28144813 [0,2,0,0,0,0|1,0,1]=4 8283 B9R0.1 C=C(C)CCNC(=O)OC Amb27247131 [0,2,0,0,0,0|1,0,1]=4 8284 B9R0.1 C=C(C)CCNC(C)CN Amb28069099 [0,2,0,0,0,0|2,0,0]=4 8285 B9R0.1 C=C(C)CCOC(=O)CC Amb27770403 [0,2,0,0,0,0|1,0,1]=4 8286 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,2,0,0,0,0|1,0,1]=4 8287 B9R0.1 C=C(C)CCSC(C)CO Amb27268746 [0,2,0,0,0,0|2,0,0]=4 8288 B9R0.1 C=C(C)CC\C=C(/C)C=O Amb27872349 [0,2,0,0,0,0|0,0,2]=4 8289 B9R0.1 C=C(C)CC\C=C(\C)C=O Amb28062454 [0,2,0,0,0,0|0,0,2]=4 8290 B9R0.1 C=C(C)CNCC(=O)NC Amb27407164 [0,2,0,0,0,0|1,0,1]=4 8291 B9R0.1 C=C(C)CNCC(C)C#N Amb28240828 [0,2,0,0,0,0|2,0,0]=4 8292 B9R0.1 C=C(C)CNCC(O)CC Amb27857305 [0,2,0,0,0,0|1,0,0]=3 8293 B9R0.1 C=C(C)COCC(N)CC Amb18111719 [0,2,0,0,0,0|1,0,0]=3 8294 B9R0.1 C=C(C)COCC(O)CO Amb27657435 [0,2,0,0,0,0|2,0,0]=4 8295 B9R0.1 C=C(C)CONC(C)CC Amb27628403 [0,2,0,0,0,0|2,0,0]=4 8296 B9R0.1 C=C(C)CSCC(=C)CC Amb27424939 [0,2,0,0,0,0|1,0,1]=4 8297 B9R0.1 C=C(C)CSCC(F)CC Amb28126249 [0,2,0,0,0,0|1,0,0]=3 8298 B9R0.1 C=C(C)CSCC(N)CC Amb27210754 [0,2,0,0,0,0|1,0,0]=3 8299 B9R0.1 C=C(C)CSCC(O)CCl Amb27165778 [0,2,0,0,0,0|2,0,0]=4 8300 B9R0.1 C=C(C=O)CCCC(C)=O Amb8392635 [0,2,0,0,0,0|0,0,2]=4 8301 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,2,0,0,0,0|1,0,1]=4 8302 B9R0.1 C=C(CC)CSCC(C)C Amb27756996 [0,2,0,0,0,0|2,0,0]=4 8303 B9R0.1 C=C(CO)CCOC(C)=O Amb28322751 [0,2,0,0,0,0|1,0,1]=4 8304 B9R0.1 C=C(CO)SCCC(C)C Amb27972273 [0,2,0,0,0,0|2,0,0]=4 8305 B9R0.1 C=C(CS)CSCC(C)C Amb28123804 [0,2,0,0,0,0|2,0,0]=4 8306 B9R0.1 C=C(Cl)CNC[C@@H](O)CC Amb28323805 [0,2,0,0,0,0|1,0,1]=4 8307 B9R0.1 C=C(Cl)CSCC(F)CC Amb28126887 [0,2,0,0,0,0|1,0,1]=4 8308 B9R0.1 C=C(Cl)CSCC(N)CC Amb27221513 [0,2,0,0,0,0|1,0,1]=4 8309 B9R0.1 C=CC(=O)CCCC(C)=O Amb27409542 [0,2,0,0,0,0|0,0,2]=4 8310 B9R0.1 C=CC(=O)CCCN(C)C Amb27234807 [0,2,0,0,0,0|1,0,1]=4 8311 B9R0.1 C=CC(=O)CCOC(C)C Amb27850742 [0,2,0,0,0,0|1,0,1]=4 8312 B9R0.1 C=CC(=O)NCCC(C)N Amb27617254 [0,2,0,0,0,0|1,0,1]=4 8313 B9R0.1 C=CC(=O)NCCC(C)O Amb27479091 [0,2,0,0,0,0|1,0,1]=4 8314 B9R0.1 C=CC(=O)OCCC(C)C Amb17933945 [0,2,0,0,0,0|1,0,1]=4 8315 B9R0.1 C=CC(C)CCCC(C)=O Amb27596967 [0,2,0,0,0,0|0,0,0]=2 8316 B9R0.1 C=CC(C)CCCC(C)C Amb22229110 [0,2,0,0,0,0|1,0,1]=4 8317 B9R0.1 C=CC(C)CCCC(C)O Amb27164172 [0,2,0,0,0,0|0,0,2]=4 8318 B9R0.1 C=CC(C)CCOC(C)=O Amb27249442 [0,2,0,0,0,0|1,0,0]=3 8319 B9R0.1 C=CC(C)COCC(=O)O Amb27831618 [0,2,0,0,0,0|2,0,0]=4 8320 B9R0.1 C=CC(C)NCCS(C)=O Amb28280356 [0,2,0,0,0,0|2,0,0]=4 8321 B9R0.1 C=CC(C)OCCC(=O)O Amb27404617 [0,2,0,0,0,0|2,0,0]=4 8322 B9R0.1 C=CC(O)CCCC(=C)C Amb28069719 [0,2,0,0,0,0|1,0,1]=4 8323 B9R0.1 C=C[C@@H](C)CCC=C(C)C Amb22353105 [0,2,0,0,0,0|1,0,1]=4 8324 B9R0.1 C=C[C@@H](C)CCCC(C)=O Amb24379305 [0,2,0,0,0,0|0,0,0]=2 8325 B9R0.1 C=C[C@H](C)CCC=C(C)C Amb22353149 [0,2,0,0,0,0|1,0,1]=4 8326 B9R0.1 CC(=O)CCCC(=N)NN Amb25146305 [0,2,0,0,0,0|1,0,1]=4 8327 B9R0.1 CC(=O)CCCC(=O)NO Amb27980256 [0,2,0,0,0,0|1,0,1]=4 8328 B9R0.1 CC(=O)CCCC(C)C#N Amb18124539 [0,2,0,0,0,0|0,0,0]=2 8329 B9R0.1 CC(=O)CCC[C@@H](C)CO Amb26391997 [0,2,0,0,0,0|0,0,0]=2 8330 B9R0.1 CC(=O)CCC[C@@H](Cl)C=O Amb28396498 [0,2,0,0,0,0|0,0,1]=3 8331 B9R0.1 CC(=O)CCC\C(C)=N\O Amb28434847 [0,2,0,0,0,0|0,0,1]=3 8332 B9R0.1 CC(=O)CCNC(C)CO Amb32675833 [0,2,0,0,0,0|1,0,0]=3 8333 B9R0.1 CC(=O)CC\C=C(/C)C#N Amb26498925 [0,2,0,0,0,0|0,0,2]=4 8334 B9R0.1 CC(=O)CC\C=C(/C)C=O Amb18124577 [0,2,0,0,0,0|0,0,2]=4 8335 B9R0.1 CC(=O)CC\C=C(\C)C#N Amb26045659 [0,2,0,0,0,0|0,0,2]=4 8336 B9R0.1 CC(=O)CC\C=C(\C)C=O Amb27195922 [0,2,0,0,0,0|0,0,2]=4 8337 B9R0.1 CC(=O)CSCC(O)CO Amb28049681 [0,2,0,0,0,0|1,0,0]=3 8338 B9R0.1 CC(=O)NCCC(C)CO Amb28203991 [0,2,0,0,0,0|1,0,0]=3 8339 B9R0.1 CC(=O)NCCC(N)CN Amb27838083 [0,2,0,0,0,0|1,0,0]=3 8340 B9R0.1 CC(=O)NCCC(O)CO Amb32645132 [0,2,0,0,0,0|1,0,0]=3 8341 B9R0.1 CC(=O)NCC[C@@H](N)CN Amb28073891 [0,2,0,0,0,0|1,0,0]=3 8342 B9R0.1 CC(=O)OCCC(C)C=O Amb28387659 [0,2,0,0,0,0|1,0,0]=3 8343 B9R0.1 CC(=O)OCCC(C)CBr Amb27866079 [0,2,0,0,0,0|1,0,0]=3 8344 B9R0.1 CC(=O)OCCC(Cl)C=O Amb28050881 [0,2,0,0,0,0|1,0,1]=4 8345 B9R0.1 CC(=O)OCCC(O)CO Amb27171870 [0,2,0,0,0,0|1,0,0]=3 8346 B9R0.1 CC(=O)OCC[C@H](O)CO Amb27588999 [0,2,0,0,0,0|1,0,0]=3 8347 B9R0.1 CC(=O)OCC\C(C)=C/Cl Amb27659295 [0,2,0,0,0,0|1,0,1]=4 8348 B9R0.1 CC(=O)OCO[C@@H](C)C=O Amb27768711 [0,2,0,0,0,0|2,0,0]=4 8349 B9R0.1 CC(=O)SCCC(=O)CCl Amb24436675 [0,2,0,0,0,0|1,0,1]=4 8350 B9R0.1 CC(C#N)CCCC(=O)O Amb18643710 [0,2,0,0,0,0|1,0,0]=3 8351 B9R0.1 CC(C#N)CCCN(C)C Amb27602164 [0,2,0,0,0,0|2,0,0]=4 8352 B9R0.1 CC(C#N)CSCC(N)=O Amb28205326 [0,2,0,0,0,0|2,0,0]=4 8353 B9R0.1 CC(C)=CCCC(=O)CCl Amb27173844 [0,2,0,0,0,0|0,0,2]=4 8354 B9R0.1 CC(C)=CCCC(=O)CF Amb28249661 [0,2,0,0,0,0|0,0,2]=4 8355 B9R0.1 CC(C)=CCCC(C)C=O Amb3940426 [0,2,0,0,0,0|1,0,1]=4 8356 B9R0.1 CC(C)=CCCC(C)CBr Amb24548827 [0,2,0,0,0,0|1,0,1]=4 8357 B9R0.1 CC(C)=CCCC(C)CCl Amb27810893 [0,2,0,0,0,0|1,0,1]=4 8358 B9R0.1 CC(C)=CCCC(C)CN Amb26571754 [0,2,0,0,0,0|1,0,1]=4 8359 B9R0.1 CC(C)=CCC[C@@H](O)CCl Amb27494073 [0,2,0,0,0,0|1,0,1]=4 8360 B9R0.1 CC(C)=CCC[C@H](C)C=O Amb27876463 [0,2,0,0,0,0|1,0,1]=4 8361 B9R0.1 CC(C)=CCC[C@H](C)CO Amb27603484 [0,2,0,0,0,0|1,0,1]=4 8362 B9R0.1 CC(C)=CCC[C@H](O)CO Amb28050222 [0,2,0,0,0,0|1,0,1]=4 8363 B9R0.1 CC(C)CCCC(=O)CCl Amb32677818 [0,2,0,0,0,0|0,0,0]=2 8364 B9R0.1 CC(C)CCCC(=O)CN Amb28197069 [0,2,0,0,0,0|0,0,0]=2 8365 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,2,0,0,0,0|0,0,0]=2 8366 B9R0.1 CC(C)CCCC(=O)NN Amb28429070 [0,2,0,0,0,0|1,0,0]=3 8367 B9R0.1 CC(C)CCCC(C)CBr Amb27485270 [0,2,0,0,0,0|1,0,1]=4 8368 B9R0.1 CC(C)CCCC(C)CCl Amb25056436 [0,2,0,0,0,0|1,0,1]=4 8369 B9R0.1 CC(C)CCCC(C)CN Amb18644042 [0,2,0,0,0,0|1,0,1]=4 8370 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|0,0,2]=4 8371 B9R0.1 CC(C)CCCC(C)NN Amb27799223 [0,2,0,0,0,0|1,0,1]=4 8372 B9R0.1 CC(C)CCCC(F)CN Amb27489384 [0,2,0,0,0,0|1,0,1]=4 8373 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [0,2,0,0,0,0|1,0,1]=4 8374 B9R0.1 CC(C)CCC[C@@H](C)CBr Amb28424339 [0,2,0,0,0,0|1,0,1]=4 8375 B9R0.1 CC(C)CCC[C@@H](C)CCl Amb28054799 [0,2,0,0,0,0|1,0,1]=4 8376 B9R0.1 CC(C)CCC[C@@H](C)CN Amb25147597 [0,2,0,0,0,0|1,0,1]=4 8377 B9R0.1 CC(C)CCC[C@@H](C)CO Amb26336716 [0,2,0,0,0,0|0,0,2]=4 8378 B9R0.1 CC(C)CCC[C@H](C)CN Amb28132685 [0,2,0,0,0,0|1,0,1]=4 8379 B9R0.1 CC(C)CCC[C@H](C)CO Amb33730882 [0,2,0,0,0,0|0,0,2]=4 8380 B9R0.1 CC(C)CCNC(=O)CBr Amb17325046 [0,2,0,0,0,0|1,0,0]=3 8381 B9R0.1 CC(C)CCNC(=O)CCl Amb1643484 [0,2,0,0,0,0|1,0,0]=3 8382 B9R0.1 CC(C)CCNC(=O)CI Amb27839136 [0,2,0,0,0,0|1,0,0]=3 8383 B9R0.1 CC(C)CCNC(=O)CN Amb5783141 [0,2,0,0,0,0|1,0,0]=3 8384 B9R0.1 CC(C)CCNC(=O)CO Amb9421652 [0,2,0,0,0,0|1,0,0]=3 8385 B9R0.1 CC(C)CCNC(=O)NN Amb8853939 [0,2,0,0,0,0|2,0,0]=4 8386 B9R0.1 CC(C)CCOC(=O)C=O Amb27762562 [0,2,0,0,0,0|1,0,1]=4 8387 B9R0.1 CC(C)CCOC(=O)CN Amb17569860 [0,2,0,0,0,0|1,0,0]=3 8388 B9R0.1 CC(C)CCOC(=O)CO Amb27626229 [0,2,0,0,0,0|1,0,0]=3 8389 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,2,0,0,0,0|1,0,0]=3 8390 B9R0.1 CC(C)CNCC(=O)CN Amb27781669 [0,2,0,0,0,0|1,0,0]=3 8391 B9R0.1 CC(C)CONC(=O)CBr Amb27233116 [0,2,0,0,0,0|2,0,0]=4 8392 B9R0.1 CC(C)CSCC(=O)NN Amb28422592 [0,2,0,0,0,0|2,0,0]=4 8393 B9R0.1 CC(C)NCCC(=O)NO Amb27948303 [0,2,0,0,0,0|2,0,0]=4 8394 B9R0.1 CC(C)OCCN(C)C=O Amb28315774 [0,2,0,0,0,0|2,0,0]=4 8395 B9R0.1 CC(C=O)CCCC(=O)O Amb27173621 [0,2,0,0,0,0|1,0,0]=3 8396 B9R0.1 CC(C=O)CCCS(C)=O Amb28142475 [0,2,0,0,0,0|1,0,0]=3 8397 B9R0.1 CC(C=O)CCOC(C)C Amb27833048 [0,2,0,0,0,0|1,0,1]=4 8398 B9R0.1 CC(CBr)CCCS(C)=O Amb27879970 [0,2,0,0,0,0|1,0,0]=3 8399 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,2,0,0,0,0|1,0,0]=3 8400 B9R0.1 CC(CN)CCCS(C)=O Amb27815622 [0,2,0,0,0,0|1,0,0]=3 8401 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,2,0,0,0,0|2,0,0]=4 8402 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,2,0,0,0,0|2,0,0]=4 8403 B9R0.1 CC(CN)OCCS(C)=O Amb27397178 [0,2,0,0,0,0|2,0,0]=4 8404 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,2,0,0,0,0|2,0,0]=4 8405 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,2,0,0,0,0|2,0,0]=4 8406 B9R0.1 CC(CO)CNCC(N)=O Amb27463837 [0,2,0,0,0,0|2,0,0]=4 8407 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,2,0,0,0,0|2,0,0]=4 8408 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,2,0,0,0,0|2,0,0]=4 8409 B9R0.1 CC(CO)CSCC(N)=O Amb27649504 [0,2,0,0,0,0|2,0,0]=4 8410 B9R0.1 CC(CO)NCCS(C)=O Amb28205542 [0,2,0,0,0,0|2,0,0]=4 8411 B9R0.1 CC(N)CCCC(=O)NO Amb28122781 [0,2,0,0,0,0|1,0,0]=3 8412 B9R0.1 CC(N)CCCC(C)CN Amb28424147 [0,2,0,0,0,0|1,0,1]=4 8413 B9R0.1 CC(N)CCCC(C)CO Amb27226928 [0,2,0,0,0,0|0,0,2]=4 8414 B9R0.1 CC(N)CSCC(=O)NN Amb27221925 [0,2,0,0,0,0|2,0,0]=4 8415 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,2,0,0,0,0|1,0,0]=3 8416 B9R0.1 CC(O)CCNC(=O)CS Amb28120401 [0,2,0,0,0,0|1,0,0]=3 8417 B9R0.1 CCC(=N)NCCC(N)=O Amb27181001 [0,2,0,0,0,0|1,0,1]=4 8418 B9R0.1 CCC(=N)NCCS(C)=O Amb27604700 [0,2,0,0,0,0|1,0,1]=4 8419 B9R0.1 CCC(=O)CCCC(C)C Amb9031663 [0,2,0,0,0,0|0,0,0]=2 8420 B9R0.1 CCC(=O)CCCN(C)C Amb27960845 [0,2,0,0,0,0|1,0,0]=3 8421 B9R0.1 CCC(=O)CCC[N+](=O)[O-] Amb27636062 [0,2,0,0,0,0|2,0,0]=4 8422 B9R0.1 CCC(=O)CCNC(C)C Amb28050476 [0,2,0,0,0,0|1,0,0]=3 8423 B9R0.1 CCC(=O)CSCC(C)C Amb18800475 [0,2,0,0,0,0|1,0,0]=3 8424 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,2,0,0,0,0|1,0,1]=4 8425 B9R0.1 CCC(=O)NCCC(C)=O Amb17102869 [0,2,0,0,0,0|0,0,1]=3 8426 B9R0.1 CCC(=O)NCCC(N)=O Amb17231982 [0,2,0,0,0,0|1,0,1]=4 8427 B9R0.1 CCC(=O)NOCC(C)C Amb27606898 [0,2,0,0,0,0|2,0,0]=4 8428 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,2,0,0,0,0|1,0,1]=4 8429 B9R0.1 CCC(=O)OCCC(C)F Amb28293863 [0,2,0,0,0,0|1,0,0]=3 8430 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,2,0,0,0,0|1,0,1]=4 8431 B9R0.1 CCC(=S)NCCC(C)C Amb27866037 [0,2,0,0,0,0|1,1,0]=4 8432 B9R0.1 CCC(Br)CCCS(C)=O Amb27653510 [0,2,0,0,0,0|1,0,0]=3 8433 B9R0.1 CCC(C)CC#CC(=O)O Amb24661749 [0,2,0,0,0,0|1,0,1]=4 8434 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,2,0,0,0,0|1,0,0]=3 8435 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,2,0,0,0,0|1,0,0]=3 8436 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,2,0,0,0,0|0,0,0]=2 8437 B9R0.1 CCC(C)CCCC(C)Br Amb28313037 [0,2,0,0,0,0|1,0,1]=4 8438 B9R0.1 CCC(C)CCCC(C)C Amb4036389 [0,2,0,0,0,0|1,0,1]=4 8439 B9R0.1 CCC(C)CCCC(C)N Amb26516233 [0,2,0,0,0,0|1,0,1]=4 8440 B9R0.1 CCC(C)CCC[C@@H](C)N Amb33731287 [0,2,0,0,0,0|1,0,1]=4 8441 B9R0.1 CCC(C)CCC[C@H](C)N Amb33729331 [0,2,0,0,0,0|1,0,1]=4 8442 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,2,0,0,0,0|0,0,0]=2 8443 B9R0.1 CCC(C)CNCC(C)C Amb6719710 [0,2,0,0,0,0|1,0,1]=4 8444 B9R0.1 CCC(C)CNCC(C)N Amb27261520 [0,2,0,0,0,0|1,0,1]=4 8445 B9R0.1 CCC(C)CNCC(N)=O Amb6718890 [0,2,0,0,0,0|1,0,0]=3 8446 B9R0.1 CCC(C)CNC[C@H](C)N Amb28135566 [0,2,0,0,0,0|1,0,1]=4 8447 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,2,0,0,0,0|1,0,0]=3 8448 B9R0.1 CCC(C)CONC(N)=O Amb27448732 [0,2,0,0,0,0|2,0,0]=4 8449 B9R0.1 CCC(C)CSCC(C)=O Amb27590937 [0,2,0,0,0,0|0,0,0]=2 8450 B9R0.1 CCC(C)NCC=C(C)C Amb27489470 [0,2,0,0,0,0|1,0,1]=4 8451 B9R0.1 CCC(C)NCCC(C)=O Amb28321451 [0,2,0,0,0,0|0,0,0]=2 8452 B9R0.1 CCC(C)NCCC(C)Cl Amb28246887 [0,2,0,0,0,0|1,0,1]=4 8453 B9R0.1 CCC(C)NCCC(C)N Amb27185683 [0,2,0,0,0,0|1,0,1]=4 8454 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,2,0,0,0,0|1,0,0]=3 8455 B9R0.1 CCC(C)NCCC(N)=O Amb8841100 [0,2,0,0,0,0|1,0,0]=3 8456 B9R0.1 CCC(C)NCCN(C)C Amb6248724 [0,2,0,0,0,0|2,0,0]=4 8457 B9R0.1 CCC(C)NOCC(N)=O Amb28383310 [0,2,0,0,0,0|2,0,0]=4 8458 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,2,0,0,0,0|1,0,0]=3 8459 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,2,0,0,0,0|0,0,0]=2 8460 B9R0.1 CCC(C)OCCC(N)=O Amb27412703 [0,2,0,0,0,0|1,0,0]=3 8461 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,2,0,0,0,0|1,1,0]=4 8462 B9R0.1 CCC(Cl)CCOC(C)=O Amb27984879 [0,2,0,0,0,0|0,0,0]=2 8463 B9R0.1 CCC(F)CSCC(C)=O Amb27804706 [0,2,0,0,0,0|0,0,0]=2 8464 B9R0.1 CCC(F)CSCC(C)C Amb28126923 [0,2,0,0,0,0|1,0,1]=4 8465 B9R0.1 CCC(N)CCCN(C)C Amb18202383 [0,2,0,0,0,0|2,0,0]=4 8466 B9R0.1 CCC(N)CCNC(N)=O Amb27842050 [0,2,0,0,0,0|1,0,0]=3 8467 B9R0.1 CCC(N)CCSC(C)C Amb27603085 [0,2,0,0,0,0|1,0,1]=4 8468 B9R0.1 CCC(N)CNCC(C)C Amb25083649 [0,2,0,0,0,0|1,0,1]=4 8469 B9R0.1 CCC(N)CSCC(C)C Amb28050870 [0,2,0,0,0,0|1,0,1]=4 8470 B9R0.1 CCC(N)CSCC(C)O Amb27867791 [0,2,0,0,0,0|0,0,2]=4 8471 B9R0.1 CCC(O)CC#CC(=O)O Amb27461426 [0,2,0,0,0,0|1,0,1]=4 8472 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,2,0,0,0,0|1,0,0]=3 8473 B9R0.1 CCC(O)CCNC(N)=O Amb27262212 [0,2,0,0,0,0|1,0,0]=3 8474 B9R0.1 CCC(O)CNCC(C)O Amb28344778 [0,2,0,0,0,0|0,0,2]=4 8475 B9R0.1 CCC(O)CNC[C@H](C)O Amb27772022 [0,2,0,0,0,0|0,0,2]=4 8476 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,2,0,0,0,0|1,0,0]=3 8477 B9R0.1 CCC(O)CSCC(C)C Amb18792450 [0,2,0,0,0,0|1,0,1]=4 8478 B9R0.1 CCN(C)CCCC(C)=O Amb9659156 [0,2,0,0,0,0|0,0,0]=2 8479 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [0,2,0,0,0,0|1,0,0]=3 8480 B9R0.1 CCS(=O)CCCC(C)C Amb27802443 [0,2,0,0,0,0|1,0,0]=3 8481 B9R0.1 CCS(=O)CCNC(C)=N Amb28435075 [0,2,0,0,0,0|2,0,0]=4 8482 B9R0.1 CCS(=O)CCNC(C)=O Amb27616407 [0,2,0,0,0,0|1,0,0]=3 8483 B9R0.1 CCS(=O)CCNC(N)=O Amb27806812 [0,2,0,0,0,0|2,0,0]=4 8484 B9R0.1 CCS(=O)CCOC(C)C Amb27982644 [0,2,0,0,0,0|2,0,0]=4 8485 B9R0.1 CC[C@@H](O)CCC=C(C)C Amb27472423 [0,2,0,0,0,0|1,0,0]=3 8486 B9R0.1 CC[C@@H](O)CCCC(C)=O Amb27227255 [0,2,0,0,0,0|0,0,0]=2 8487 B9R0.1 CC[C@@H](O)CNCC(C)O Amb27770562 [0,2,0,0,0,0|0,0,2]=4 8488 B9R0.1 CC[C@@H](O)CNCC(N)=O Amb27226499 [0,2,0,0,0,0|1,0,0]=3 8489 B9R0.1 CC[C@@H](O)CSCC(C)C Amb28381554 [0,2,0,0,0,0|1,0,1]=4 8490 B9R0.1 CC[C@@H](O)CSCC(N)=O Amb28202586 [0,2,0,0,0,0|1,0,0]=3 8491 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,2,0,0,0,0|1,0,0]=3 8492 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [0,2,0,0,0,0|1,0,1]=4 8493 B9R0.1 CC[C@H](N)CCOC(C)C Amb27776078 [0,2,0,0,0,0|1,0,1]=4 8494 B9R0.1 CC[C@H](N)CSCC(C)C Amb27771983 [0,2,0,0,0,0|1,0,1]=4 8495 B9R0.1 CC[C@H](O)CCC=C(C)C Amb28050675 [0,2,0,0,0,0|1,0,0]=3 8496 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,2,0,0,0,0|1,0,1]=4 8497 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,2,0,0,0,0|0,0,1]=3 8498 B9R0.1 CC\C(C)=C\CCC(C)Br Amb28287338 [0,2,0,0,0,0|1,0,1]=4 8499 B9R0.1 CN(C#N)CCCC(=O)O Amb28281828 [0,2,0,0,0,0|2,0,0]=4 8500 B9R0.1 CN(C)CCCC(N)CO Amb18202279 [0,2,0,0,0,0|2,0,0]=4 8501 B9R0.1 CN(C)CCCC(O)CN Amb24760011 [0,2,0,0,0,0|2,0,0]=4 8502 B9R0.1 CN(C)CCNC(=O)CBr Amb17331884 [0,2,0,0,0,0|2,0,0]=4 8503 B9R0.1 CN(C)CCNC(=O)CCl Amb1137595 [0,2,0,0,0,0|2,0,0]=4 8504 B9R0.1 CN(C)CCNC(=O)CCl Amb13951935 [0,2,0,0,0,0|2,0,0]=4 8505 B9R0.1 CN(C)CCNC(=O)CN Amb5783037 [0,2,0,0,0,0|2,0,0]=4 8506 B9R0.1 CN(C)CCNC(=O)CO Amb5798178 [0,2,0,0,0,0|2,0,0]=4 8507 B9R0.1 CN(C)CCOC(=O)CO Amb33016861 [0,2,0,0,0,0|2,0,0]=4 8508 B9R0.1 CN(CCCC(=O)O)N=O Amb17618588 [0,2,0,0,0,0|2,0,0]=4 8509 B9R0.1 CNC(=O)CCCC(=O)[O-] Amb24271120 [0,2,0,0,0,0|1,0,1]=4 8510 B9R0.1 CNC(=O)CCCC(C)N Amb27261578 [0,2,0,0,0,0|0,0,0]=2 8511 B9R0.1 CNC(=O)CCNN(C)C Amb27401745 [0,2,0,0,0,0|2,0,0]=4 8512 B9R0.1 CNC(=O)CNCC(C)=O Amb27789643 [0,2,0,0,0,0|1,0,1]=4 8513 B9R0.1 CNC(=O)CNC[C@@H](C)O Amb28188407 [0,2,0,0,0,0|1,0,0]=3 8514 B9R0.1 CNC(=O)CSCC(C)C Amb27982678 [0,2,0,0,0,0|1,0,0]=3 8515 B9R0.1 CNC(=O)CSC[C@@H](C)N Amb27485191 [0,2,0,0,0,0|1,0,0]=3 8516 B9R0.1 CNC(=O)CSC[C@@H](C)O Amb27790534 [0,2,0,0,0,0|1,0,0]=3 8517 B9R0.1 CNC(=O)CSC[C@H](C)N Amb27591048 [0,2,0,0,0,0|1,0,0]=3 8518 B9R0.1 CNC(=O)NCCC(C)O Amb27971912 [0,2,0,0,0,0|1,0,0]=3 8519 B9R0.1 CNC(=S)NCCC(C)=O Amb27408306 [0,2,0,0,0,0|1,0,1]=4 8520 B9R0.1 CNC(C)CCC=C(C)C Amb17593577 [0,2,0,0,0,0|1,0,1]=4 8521 B9R0.1 CNC(C)CCCC(C)C Amb25683551 [0,2,0,0,0,0|1,0,1]=4 8522 B9R0.1 CNC(C)CCNC(N)=O Amb28067069 [0,2,0,0,0,0|2,0,0]=4 8523 B9R0.1 COC(=N)CCOC(C)C Amb27613351 [0,2,0,0,0,0|2,0,0]=4 8524 B9R0.1 COC(=N)CSCC(C)C Amb27877661 [0,2,0,0,0,0|2,0,0]=4 8525 B9R0.1 COC(=O)C#CCC(C)C Amb25915710 [0,2,0,0,0,0|0,0,2]=4 8526 B9R0.1 COC(=O)CCCB(O)O Amb25676456 [0,2,0,0,0,0|2,0,0]=4 8527 B9R0.1 COC(=O)CCCC(=O)Cl Amb3939328 [0,2,0,0,0,0|1,0,1]=4 8528 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,2,0,0,0,0|1,0,1]=4 8529 B9R0.1 COC(=O)CCCC(=O)[O-] Amb33948529 [0,2,0,0,0,0|1,0,1]=4 8530 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,2,0,0,0,0|0,0,1]=3 8531 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,2,0,0,0,0|0,0,0]=2 8532 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,2,0,0,0,0|0,0,0]=2 8533 B9R0.1 COC(=O)CCCC(C)N Amb27759913 [0,2,0,0,0,0|0,0,0]=2 8534 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,2,0,0,0,0|0,0,0]=2 8535 B9R0.1 COC(=O)CCCC(N)=O Amb27882411 [0,2,0,0,0,0|1,0,1]=4 8536 B9R0.1 COC(=O)CCCC(N)=S Amb25360938 [0,2,0,0,0,0|1,0,1]=4 8537 B9R0.1 COC(=O)CCCS(=O)Cl Amb26409514 [0,2,0,0,0,0|2,0,0]=4 8538 B9R0.1 COC(=O)CCCS(=O)[O-] Amb25914636 [0,2,0,0,0,0|2,0,0]=4 8539 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,2,0,0,0,0|1,0,0]=3 8540 B9R0.1 COC(=O)CCCS(N)=O Amb32720319 [0,2,0,0,0,0|2,0,0]=4 8541 B9R0.1 COC(=O)CCC[C@H](C)O Amb27839593 [0,2,0,0,0,0|0,0,0]=2 8542 B9R0.1 COC(=O)CCC[N+](=O)[O-] Amb1073683 [0,2,0,0,0,0|2,0,0]=4 8543 B9R0.1 COC(=O)CCNC(C)=O Amb15691935 [0,2,0,0,0,0|1,0,1]=4 8544 B9R0.1 COC(=O)CCNC(C)C Amb9203616 [0,2,0,0,0,0|1,0,0]=3 8545 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,2,0,0,0,0|2,0,0]=4 8546 B9R0.1 COC(=O)CCOC(C)=O Amb27972208 [0,2,0,0,0,0|1,0,1]=4 8547 B9R0.1 COC(=O)CCOC(C)C Amb9206383 [0,2,0,0,0,0|1,0,0]=3 8548 B9R0.1 COC(=O)CC\N=C(/C)N Amb27826068 [0,2,0,0,0,0|1,0,1]=4 8549 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,2,0,0,0,0|1,0,0]=3 8550 B9R0.1 COC(=O)CNCC(C)O Amb9247006 [0,2,0,0,0,0|1,0,0]=3 8551 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,2,0,0,0,0|2,0,0]=4 8552 B9R0.1 COC(=O)CNCC(F)F Amb33204438 [0,2,0,0,0,0|2,0,0]=4 8553 B9R0.1 COC(=O)CNCN(C)C Amb28041215 [0,2,0,0,0,0|2,0,0]=4 8554 B9R0.1 COC(=O)COCC(C)=O Amb8392403 [0,2,0,0,0,0|1,0,1]=4 8555 B9R0.1 COC(=O)COCC(C)C Amb9206382 [0,2,0,0,0,0|1,0,0]=3 8556 B9R0.1 COC(=O)CSCC(C)=O Amb2444691 [0,2,0,0,0,0|1,0,1]=4 8557 B9R0.1 COC(=O)CSCC(C)C Amb839626 [0,2,0,0,0,0|1,0,0]=3 8558 B9R0.1 COC(=O)CSCC(C)N Amb27770371 [0,2,0,0,0,0|1,0,0]=3 8559 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,2,0,0,0,0|1,0,0]=3 8560 B9R0.1 COC(=O)C\C=C\C(C)O Amb27756374 [0,2,0,0,0,0|0,0,2]=4 8561 B9R0.1 COC(=O)C\C=C\[C@@H](C)O Amb28321357 [0,2,0,0,0,0|0,0,2]=4 8562 B9R0.1 COC(=O)NCC[C@H](C)O Amb27663109 [0,2,0,0,0,0|1,0,0]=3 8563 B9R0.1 COC(=O)OCCC(C)=O Amb28049880 [0,2,0,0,0,0|1,0,1]=4 8564 B9R0.1 COC(=O)OCCC(C)C Amb27777595 [0,2,0,0,0,0|1,0,0]=3 8565 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,2,0,0,0,0|0,0,2]=4 8566 B9R0.1 COC(=O)\C=C\CC(C)C Amb2689517 [0,2,0,0,0,0|0,0,2]=4 8567 B9R0.1 COC(=O)\C=C\CC(C)C Amb33714772 [0,2,0,0,0,0|0,0,2]=4 8568 B9R0.1 COC(C)CCCC(C)O Amb27833630 [0,2,0,0,0,0|0,0,2]=4 8569 B9R0.1 COC(C)CCNC(C)=O Amb27260083 [0,2,0,0,0,0|1,0,0]=3 8570 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,2,0,0,0,0|1,0,0]=3 8571 B9R0.1 COC(C)CONC(C)=O Amb27856871 [0,2,0,0,0,0|2,0,0]=4 8572 B9R0.1 COC(C)OCCC(C)=O Amb27267196 [0,2,0,0,0,0|1,0,0]=3 8573 B9R0.1 CON(C)CCCC(=O)O Amb28126925 [0,2,0,0,0,0|2,0,0]=4 8574 B9R0.1 CON(C)CCNC(C)=O Amb27822674 [0,2,0,0,0,0|2,0,0]=4 8575 B9R0.1 CS(=O)CCNC(=O)CCl Amb27852973 [0,2,0,0,0,0|2,0,0]=4 8576 B9R0.1 CS(=O)CCNC(=O)CN Amb27451738 [0,2,0,0,0,0|2,0,0]=4 8577 B9R0.1 CS(=O)CSCC(N)CO Amb27607883 [0,2,0,0,0,0|2,0,0]=4 8578 B9R0.1 CSC(C)CCNC(C)=O Amb27964419 [0,2,0,0,0,0|1,0,0]=3 8579 B9R0.1 CSC(C)CCOC(=O)Cl Amb28199680 [0,2,0,0,0,0|2,0,0]=4 8580 B9R0.1 C[C@@H](CF)NCCC(N)=O Amb28315929 [0,2,0,0,0,0|2,0,0]=4 8581 B9R0.1 C\C(=C/Cl)CNCC(C)O Amb27205444 [0,2,0,0,0,0|2,0,0]=4 8582 B9R0.1 C\C(=C/Cl)CSCC(C)N Amb27600464 [0,2,0,0,0,0|2,0,0]=4 8583 B9R0.1 C\C(=C\CCC(C)C)CN Amb28145079 [0,2,0,0,0,0|1,0,1]=4 8584 B9R0.1 C\C(C=O)=C/CCC(C)O Amb27598642 [0,2,0,0,0,0|0,0,1]=3 8585 B9R0.1 C\C(C=O)=C/COC(C)C Amb28398385 [0,2,0,0,0,0|1,0,1]=4 8586 B9R0.1 C\C(C=O)=C\CCC(C)O Amb27841297 [0,2,0,0,0,0|0,0,1]=3 8587 B9R0.1 C\C(C=O)=C\COC(C)C Amb28052700 [0,2,0,0,0,0|1,0,1]=4 8588 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,2,0,0,0,0|1,0,1]=4 8589 B9R0.1 C\C(CSCC(C)C)=N/N Amb27980210 [0,2,0,0,0,0|2,0,0]=4 8590 B9R0.1 C\C=C(\C)CCCC(C)O Amb28050786 [0,2,0,0,0,0|1,0,0]=3 8591 B9R0.1 NC(=O)CCC[C@H](N)CS Amb28251296 [0,2,0,0,0,0|1,0,0]=3 8592 B9R0.1 NC(=O)CNCC(O)CF Amb27859350 [0,2,0,0,0,0|2,0,0]=4 8593 B9R0.1 NC(=O)CSCC(O)CF Amb27249405 [0,2,0,0,0,0|2,0,0]=4 8594 B9R0.1 NC(=O)CSCC(O)CO Amb27593990 [0,2,0,0,0,0|2,0,0]=4 8595 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [0,2,0,0,0,0|1,0,0]=3 8596 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,2,0,0,0,0|1,0,1]=4 8597 B9R0.1 NCC(=O)NCCC(F)F Amb27760867 [0,2,0,0,0,0|2,0,0]=4 8598 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [0,2,0,0,0,0|1,0,0]=3 8599 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [0,2,0,0,0,0|1,0,0]=3 8600 B9R0.1 O=C(CCl)NCCC(F)F Amb28119518 [0,2,0,0,0,0|2,0,0]=4 8601 B9R0.1 O=C(CCl)OCCC(Cl)Cl Amb27180862 [0,2,0,0,0,0|2,0,0]=4 8602 B9R0.1 O=C(CS)NCCC(F)F Amb28316096 [0,2,0,0,0,0|2,0,0]=4 8603 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,2,0,0,0,0|1,0,1]=4 8604 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [0,2,0,0,0,0|1,0,0]=3 8605 B9R0.1 O=C(O)CSCC(O)CCl Amb27858669 [0,2,0,0,0,0|2,0,0]=4 8606 B9R0.1 [C-]#[N+]C(C)CCCC(C)C Amb19944628 [0,2,0,0,0,0|1,0,1]=4 8607 B9R0.5 C#CCC(=O)CCCNC Amb28196973 [0,2,0,0,0,0|1,0,0]=3 8608 B9R0.5 C#CCC(=O)CCCOC Amb27244928 [0,2,0,0,0,0|1,0,0]=3 8609 B9R0.5 C#CCC(=O)CSCCN Amb28192589 [0,2,0,0,0,0|2,0,0]=4 8610 B9R0.5 C#CCC(=O)NCCNC Amb28194658 [0,2,0,0,0,0|2,0,0]=4 8611 B9R0.5 C#CCCCC(=O)CC=C Amb27770500 [0,2,0,0,0,0|0,0,2]=4 8612 B9R0.5 C#CCCCC(=O)CCN Amb28074139 [0,2,0,0,0,0|0,0,2]=4 8613 B9R0.5 C#CCCCC(=O)CNC Amb28050467 [0,2,0,0,0,0|0,0,2]=4 8614 B9R0.5 C#CCCCC(=O)COC Amb28041300 [0,2,0,0,0,0|0,0,2]=4 8615 B9R0.5 C#CCCCC(=O)CSC Amb27594998 [0,2,0,0,0,0|0,0,2]=4 8616 B9R0.5 C#CCCCC(=O)OCC Amb18115788 [0,2,0,0,0,0|0,0,2]=4 8617 B9R0.5 C#CCCC\C(C)=C\C=O Amb27770379 [0,2,0,0,0,0|0,0,2]=4 8618 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [0,2,0,0,0,0|2,0,0]=4 8619 B9R0.5 C=C(CCO)CCCCN Amb28193274 [0,2,0,0,0,0|2,0,0]=4 8620 B9R0.5 C=C(CNC)COCCC Amb27982049 [0,2,0,0,0,0|2,0,0]=4 8621 B9R0.5 C=CCC(=O)CCC#CC Amb27770499 [0,2,0,0,0,0|0,0,2]=4 8622 B9R0.5 C=CCC(=O)CCCC#N Amb27614843 [0,2,0,0,0,0|1,0,1]=4 8623 B9R0.5 C=CCC(=O)CCCCCl Amb27254167 [0,2,0,0,0,0|1,0,0]=3 8624 B9R0.5 C=CCC(=O)CCCCN Amb27251890 [0,2,0,0,0,0|1,0,0]=3 8625 B9R0.5 C=CCC(=O)CCCNC Amb27196074 [0,2,0,0,0,0|1,0,0]=3 8626 B9R0.5 C=CCC(=O)CNCCC Amb27190835 [0,2,0,0,0,0|1,0,0]=3 8627 B9R0.5 C=CCC(=O)COCCC Amb28457139 [0,2,0,0,0,0|1,0,0]=3 8628 B9R0.5 C=CCC(=O)NCCCN Amb27628630 [0,2,0,0,0,0|2,0,0]=4 8629 B9R0.5 C=CCC(=O)OCCCC Amb28049467 [0,2,0,0,0,0|1,0,0]=3 8630 B9R0.5 C=CCC(=O)OCCSC Amb28365396 [0,2,0,0,0,0|2,0,0]=4 8631 B9R0.5 C=CCCCC(=O)CCO Amb27262946 [0,2,0,0,0,0|0,0,2]=4 8632 B9R0.5 C=CCCCC(=O)CSC Amb28182451 [0,2,0,0,0,0|0,0,2]=4 8633 B9R0.5 C=CCCC\C(C)=C/C=O Amb27489044 [0,2,0,0,0,0|0,0,2]=4 8634 B9R0.5 C=CCS(=O)CCCNC Amb27185646 [0,2,0,0,0,0|2,0,0]=4 8635 B9R0.5 C=CC[C@H](O)CCCCC Amb27839428 [0,2,0,0,0,0|0,0,2]=4 8636 B9R0.5 C=C\C=C(\C)CCCCN Amb27466086 [0,2,0,0,0,0|2,0,0]=4 8637 B9R0.5 CC#CC(=O)NCCCC Amb28207015 [0,2,0,0,0,0|1,0,0]=3 8638 B9R0.5 CC#CCCC(=O)CCC Amb28186245 [0,2,0,0,0,0|0,0,2]=4 8639 B9R0.5 CC#CCCC(=O)\C=C\C Amb27849911 [0,2,0,0,0,0|0,0,2]=4 8640 B9R0.5 CC#CCC\C(C)=C\C=O Amb28129797 [0,2,0,0,0,0|0,0,2]=4 8641 B9R0.5 CCCC#CC(=O)OCC Amb2721493 [0,2,0,0,0,0|0,0,2]=4 8642 B9R0.5 CCCC(=O)CCCCN Amb28058184 [0,2,0,0,0,0|1,0,0]=3 8643 B9R0.5 CCCC(=O)CCCSC Amb27758287 [0,2,0,0,0,0|1,0,0]=3 8644 B9R0.5 CCCC(=O)COCCCl Amb27244905 [0,2,0,0,0,0|2,0,0]=4 8645 B9R0.5 CCCC(=O)COCCN Amb27413187 [0,2,0,0,0,0|2,0,0]=4 8646 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|2,0,0]=4 8647 B9R0.5 CCCC(=O)NCCSC Amb8504701 [0,2,0,0,0,0|2,0,0]=4 8648 B9R0.5 CCCC(=O)OCCCN Amb27272615 [0,2,0,0,0,0|2,0,0]=4 8649 B9R0.5 CCCC(=O)OCCCO Amb28292589 [0,2,0,0,0,0|2,0,0]=4 8650 B9R0.5 CCCCCC(=O)CCC Amb2720457 [0,2,0,0,0,0|0,0,0]=2 8651 B9R0.5 CCCCCC(=O)CCO Amb27627789 [0,2,0,0,0,0|0,0,0]=2 8652 B9R0.5 CCCCCC(=O)COC Amb27171123 [0,2,0,0,0,0|0,0,0]=2 8653 B9R0.5 CCCCCC(=O)NC#N Amb28204647 [0,2,0,0,0,0|0,0,1]=3 8654 B9R0.5 CCCCCC(=O)NCC Amb3373540 [0,2,0,0,0,0|0,0,0]=2 8655 B9R0.5 CCCCCC(=O)\C=C\Cl Amb26411947 [0,2,0,0,0,0|0,0,1]=3 8656 B9R0.5 CCCCCC(=O)\C=C\I Amb26013833 [0,2,0,0,0,0|0,0,1]=3 8657 B9R0.5 CCCCCC(Br)CCC Amb28318288 [0,2,0,0,0,0|1,0,1]=4 8658 B9R0.5 CCCCCC(Br)COC Amb27849558 [0,2,0,0,0,0|1,0,1]=4 8659 B9R0.5 CCCCCC(C)CC=O Amb21953169 [0,2,0,0,0,0|0,0,1]=3 8660 B9R0.5 CCCCCC(C)CCBr Amb26637488 [0,2,0,0,0,0|1,0,1]=4 8661 B9R0.5 CCCCCC(C)CCC Amb4035718 [0,2,0,0,0,0|1,0,1]=4 8662 B9R0.5 CCCCCC(C)CCCl Amb27392063 [0,2,0,0,0,0|1,0,1]=4 8663 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|1,0,1]=4 8664 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|0,0,2]=4 8665 B9R0.5 CCCCCC(C)N=C=O Amb24476932 [0,2,0,0,0,0|0,0,1]=3 8666 B9R0.5 CCCCCC(C)N=C=S Amb839070 [0,2,0,0,0,0|0,1,1]=4 8667 B9R0.5 CCCCCC(C)NC=O Amb27615073 [0,2,0,0,0,0|0,0,1]=3 8668 B9R0.5 CCCCCC(Cl)CCCl Amb27831205 [0,2,0,0,0,0|1,0,1]=4 8669 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|1,0,1]=4 8670 B9R0.5 CCCCCC(N)CCC Amb8869705 [0,2,0,0,0,0|1,0,1]=4 8671 B9R0.5 CCCCCC(N)COC Amb27206898 [0,2,0,0,0,0|1,0,1]=4 8672 B9R0.5 CCCCCC(O)CC#N Amb18643749 [0,2,0,0,0,0|0,0,2]=4 8673 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|0,0,2]=4 8674 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|0,0,2]=4 8675 B9R0.5 CCCCCC(O)CNC Amb27973914 [0,2,0,0,0,0|0,0,2]=4 8676 B9R0.5 CCCCCC(S)CC=O Amb27424790 [0,2,0,0,0,0|0,1,1]=4 8677 B9R0.5 CCCCCN(C)CCCl Amb17334595 [0,2,0,0,0,0|2,0,0]=4 8678 B9R0.5 CCCCCN(C)CCO Amb3204759 [0,2,0,0,0,0|1,0,1]=4 8679 B9R0.5 CCCCCN(C)CCS Amb27834912 [0,2,0,0,0,0|1,1,0]=4 8680 B9R0.5 CCCCCS(=O)CCN Amb27954729 [0,2,0,0,0,0|1,0,0]=3 8681 B9R0.5 CCCCC[C@@H](C)N=C=O Amb10807374 [0,2,0,0,0,0|0,0,1]=3 8682 B9R0.5 CCCCC[C@@H](C)N=C=S Amb10807444 [0,2,0,0,0,0|0,1,1]=4 8683 B9R0.5 CCCCC[C@@H](O)CCO Amb27946548 [0,2,0,0,0,0|0,0,2]=4 8684 B9R0.5 CCCCC[C@H](C)CCO Amb26861853 [0,2,0,0,0,0|0,0,2]=4 8685 B9R0.5 CCCCC[C@H](C)N=C=O Amb22053846 [0,2,0,0,0,0|0,0,1]=3 8686 B9R0.5 CCCCC[C@H](C)N=C=S Amb22045293 [0,2,0,0,0,0|0,1,1]=4 8687 B9R0.5 CCCCC[C@H](O)CCC Amb27652271 [0,2,0,0,0,0|0,0,2]=4 8688 B9R0.5 CCCCC\C(C)=C\C#N Amb27476930 [0,2,0,0,0,0|1,0,0]=3 8689 B9R0.5 CCCCC\C(C)=C\C=O Amb27841277 [0,2,0,0,0,0|0,0,0]=2 8690 B9R0.5 CCCCC\C(Cl)=C\CCl Amb27749688 [0,2,0,0,0,0|1,0,0]=3 8691 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [0,2,0,0,0,0|1,0,0]=3 8692 B9R0.5 CCCCNC(=N)NCC Amb28118745 [0,2,0,0,0,0|2,0,0]=4 8693 B9R0.5 CCCCNC(=O)C#CBr Amb28068776 [0,2,0,0,0,0|1,0,1]=4 8694 B9R0.5 CCCCNC(=O)C#CI Amb26641834 [0,2,0,0,0,0|1,0,1]=4 8695 B9R0.5 CCCCNC(=O)CC#N Amb1203319 [0,2,0,0,0,0|1,0,0]=3 8696 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [0,2,0,0,0,0|1,0,0]=3 8697 B9R0.5 CCCCNC(=O)CCC Amb5797594 [0,2,0,0,0,0|1,0,0]=3 8698 B9R0.5 CCCCNC(=O)CCCl Amb6248093 [0,2,0,0,0,0|1,0,0]=3 8699 B9R0.5 CCCCNC(=O)CCN Amb5784977 [0,2,0,0,0,0|1,0,0]=3 8700 B9R0.5 CCCCNC(=O)CNC Amb6280977 [0,2,0,0,0,0|1,0,0]=3 8701 B9R0.5 CCCCNC(=O)CSC Amb27877947 [0,2,0,0,0,0|1,0,0]=3 8702 B9R0.5 CCCCNC(=O)NC#N Amb27458564 [0,2,0,0,0,0|1,0,1]=4 8703 B9R0.5 CCCCNC(=O)NCC Amb4018863 [0,2,0,0,0,0|1,0,0]=3 8704 B9R0.5 CCCCNC(=O)OCC Amb10552892 [0,2,0,0,0,0|1,0,0]=3 8705 B9R0.5 CCCCNC(=S)NOC Amb28290368 [0,2,0,0,0,0|1,1,0]=4 8706 B9R0.5 CCCCNC(=S)OCC Amb27235690 [0,2,0,0,0,0|1,1,0]=4 8707 B9R0.5 CCCCOC(=O)CC#N Amb8383765 [0,2,0,0,0,0|1,0,0]=3 8708 B9R0.5 CCCCOC(=O)CCCl Amb2722788 [0,2,0,0,0,0|1,0,0]=3 8709 B9R0.5 CCCCOC(=O)CCO Amb27211287 [0,2,0,0,0,0|1,0,0]=3 8710 B9R0.5 CCCCOC(=O)CCS Amb8516995 [0,2,0,0,0,0|1,0,0]=3 8711 B9R0.5 CCCCOC(=O)CNN Amb27768106 [0,2,0,0,0,0|1,0,0]=3 8712 B9R0.5 CCCCOC(=O)COC Amb20620642 [0,2,0,0,0,0|1,0,0]=3 8713 B9R0.5 CCCCOC(=O)CON Amb25691107 [0,2,0,0,0,0|1,0,0]=3 8714 B9R0.5 CCCCOC(=O)NCC Amb27412996 [0,2,0,0,0,0|1,0,0]=3 8715 B9R0.5 CCCCOC(=O)OCCl Amb26509700 [0,2,0,0,0,0|1,0,0]=3 8716 B9R0.5 CCCCOC(=S)NCC Amb27393051 [0,2,0,0,0,0|1,1,0]=4 8717 B9R0.5 CCCCOC(C)CC=O Amb27838097 [0,2,0,0,0,0|1,0,1]=4 8718 B9R0.5 CCCCSC(=O)N=C=O Amb28240337 [0,2,0,0,0,0|1,0,1]=4 8719 B9R0.5 CCCCSC(=O)NCC Amb27462695 [0,2,0,0,0,0|1,0,0]=3 8720 B9R0.5 CCCCS\C(C)=C\CO Amb27651728 [0,2,0,0,0,0|1,0,1]=4 8721 B9R0.5 CCCC\C=C(\C)CCO Amb27662306 [0,2,0,0,0,0|0,0,2]=4 8722 B9R0.5 CCCC\N=C(/N)SCC Amb24660507 [0,2,0,0,0,0|2,0,0]=4 8723 B9R0.5 CCCNCC(=O)NOC Amb27401608 [0,2,0,0,0,0|1,0,0]=3 8724 B9R0.5 CCCNCC(=O)OCC Amb6714488 [0,2,0,0,0,0|1,0,0]=3 8725 B9R0.5 CCCOCC(=N)OCC Amb27399250 [0,2,0,0,0,0|2,0,0]=4 8726 B9R0.5 CCCOCC(=O)N=C=S Amb27426831 [0,2,0,0,0,0|1,0,1]=4 8727 B9R0.5 CCCOCC(=O)NC#N Amb27165469 [0,2,0,0,0,0|1,0,1]=4 8728 B9R0.5 CCCOCC(=O)NOC Amb27471682 [0,2,0,0,0,0|1,0,0]=3 8729 B9R0.5 CCCOCC(C)N=C=O Amb27792954 [0,2,0,0,0,0|1,0,1]=4 8730 B9R0.5 CCCONC(=O)CCCl Amb27666370 [0,2,0,0,0,0|2,0,0]=4 8731 B9R0.5 CCCONC(=O)COC Amb28075232 [0,2,0,0,0,0|2,0,0]=4 8732 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,0,0]=3 8733 B9R0.5 CCC\C=C\C(=O)CCC Amb17593554 [0,2,0,0,0,0|0,0,2]=4 8734 B9R0.5 CCC\C=C\C(=O)CCN Amb33327175 [0,2,0,0,0,0|0,0,2]=4 8735 B9R0.5 CCC\C=C\C(=O)CNC Amb33327172 [0,2,0,0,0,0|0,0,2]=4 8736 B9R0.5 CCNC(=N)CCOCC Amb27965191 [0,2,0,0,0,0|2,0,0]=4 8737 B9R0.5 CCNC(=O)CCCC#N Amb28063756 [0,2,0,0,0,0|1,0,1]=4 8738 B9R0.5 CCNC(=O)CCCCBr Amb17239684 [0,2,0,0,0,0|1,0,0]=3 8739 B9R0.5 CCNC(=O)CCCNC Amb28126927 [0,2,0,0,0,0|1,0,0]=3 8740 B9R0.5 CCNC(=O)CCCOC Amb27179856 [0,2,0,0,0,0|1,0,0]=3 8741 B9R0.5 CCNC(=O)CNCCF Amb27962781 [0,2,0,0,0,0|2,0,0]=4 8742 B9R0.5 CCNC(=O)CNCCO Amb9246603 [0,2,0,0,0,0|2,0,0]=4 8743 B9R0.5 CCNC(=O)CNOCC Amb27400119 [0,2,0,0,0,0|2,0,0]=4 8744 B9R0.5 CCNC(=O)COCCN Amb27837714 [0,2,0,0,0,0|2,0,0]=4 8745 B9R0.5 CCNC(=O)CSCCBr Amb27249104 [0,2,0,0,0,0|2,0,0]=4 8746 B9R0.5 CCNC(=O)NCCCF Amb27458114 [0,2,0,0,0,0|2,0,0]=4 8747 B9R0.5 CCNC(=O)NCCCO Amb4018873 [0,2,0,0,0,0|2,0,0]=4 8748 B9R0.5 CCNC(=O)NCCNC Amb19027447 [0,2,0,0,0,0|2,0,0]=4 8749 B9R0.5 CCNC(=O)NCCOC Amb4018874 [0,2,0,0,0,0|2,0,0]=4 8750 B9R0.5 CCNC(=O)OCCCCl Amb27805521 [0,2,0,0,0,0|2,0,0]=4 8751 B9R0.5 CCNC(=O)OCCNC Amb27777734 [0,2,0,0,0,0|2,0,0]=4 8752 B9R0.5 CCNC(=O)OCCOC Amb26558291 [0,2,0,0,0,0|2,0,0]=4 8753 B9R0.5 CCNCCC(=O)OCC Amb9026175 [0,2,0,0,0,0|1,0,0]=3 8754 B9R0.5 CCOC(=N)CCCCBr Amb25890174 [0,2,0,0,0,0|2,0,0]=4 8755 B9R0.5 CCOC(=N)CCCCCl Amb26392208 [0,2,0,0,0,0|2,0,0]=4 8756 B9R0.5 CCOC(=N)CCCOC Amb28141924 [0,2,0,0,0,0|2,0,0]=4 8757 B9R0.5 CCOC(=O)CCCC#N Amb16233123 [0,2,0,0,0,0|1,0,1]=4 8758 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [0,2,0,0,0,0|1,0,1]=4 8759 B9R0.5 CCOC(=O)CCCCBr Amb3940221 [0,2,0,0,0,0|1,0,0]=3 8760 B9R0.5 CCOC(=O)CCCCI Amb4006406 [0,2,0,0,0,0|1,0,0]=3 8761 B9R0.5 CCOC(=O)CCCCN Amb10807401 [0,2,0,0,0,0|1,0,0]=3 8762 B9R0.5 CCOC(=O)CCCCN Amb33527726 [0,2,0,0,0,0|1,0,0]=3 8763 B9R0.5 CCOC(=O)CCCNC Amb9204023 [0,2,0,0,0,0|1,0,0]=3 8764 B9R0.5 CCOC(=O)CCCOC Amb27837737 [0,2,0,0,0,0|1,0,0]=3 8765 B9R0.5 CCOC(=O)CCCSC Amb25058939 [0,2,0,0,0,0|1,0,0]=3 8766 B9R0.5 CCOC(=O)CCNOC Amb27838886 [0,2,0,0,0,0|2,0,0]=4 8767 B9R0.5 CCOC(=O)CCSCC Amb9026307 [0,2,0,0,0,0|1,0,0]=3 8768 B9R0.5 CCOC(=O)CNCCF Amb27754664 [0,2,0,0,0,0|2,0,0]=4 8769 B9R0.5 CCOC(=O)CNCCN Amb30868135 [0,2,0,0,0,0|2,0,0]=4 8770 B9R0.5 CCOC(=O)COCCBr Amb8394720 [0,2,0,0,0,0|2,0,0]=4 8771 B9R0.5 CCOC(=O)COCCCl Amb19958740 [0,2,0,0,0,0|2,0,0]=4 8772 B9R0.5 CCOC(=O)COCCN Amb25850783 [0,2,0,0,0,0|2,0,0]=4 8773 B9R0.5 CCOC(=O)COCCN Amb28555601 [0,2,0,0,0,0|2,0,0]=4 8774 B9R0.5 CCOC(=O)COCCO Amb24113532 [0,2,0,0,0,0|2,0,0]=4 8775 B9R0.5 CCOC(=O)COCOC Amb27624738 [0,2,0,0,0,0|2,0,0]=4 8776 B9R0.5 CCOC(=O)CSCSC Amb28144787 [0,2,0,0,0,0|2,0,0]=4 8777 B9R0.5 CCOC(=O)NCCCF Amb27770329 [0,2,0,0,0,0|2,0,0]=4 8778 B9R0.5 CCOC(=O)NCCNC Amb28126929 [0,2,0,0,0,0|2,0,0]=4 8779 B9R0.5 CCOC(=O)OCCCBr Amb27231554 [0,2,0,0,0,0|2,0,0]=4 8780 B9R0.5 CCOC(=O)OCCCCl Amb27594095 [0,2,0,0,0,0|2,0,0]=4 8781 B9R0.5 CCOC(=O)OCCCF Amb24088656 [0,2,0,0,0,0|2,0,0]=4 8782 B9R0.5 CCOC(=O)OCCCO Amb28050600 [0,2,0,0,0,0|2,0,0]=4 8783 B9R0.5 CCOCCC(=O)CCCl Amb27214166 [0,2,0,0,0,0|1,0,0]=3 8784 B9R0.5 CCOCCC(=O)COC Amb27246058 [0,2,0,0,0,0|1,0,0]=3 8785 B9R0.5 CCOCCC(=O)NOC Amb27839068 [0,2,0,0,0,0|1,0,0]=3 8786 B9R0.5 CCOCCC(=O)OCC Amb6608774 [0,2,0,0,0,0|1,0,0]=3 8787 B9R0.5 CCOCCC(=O)ONN Amb28423241 [0,2,0,0,0,0|2,0,0]=4 8788 B9R0.5 CCONCC(=O)NOC Amb28315685 [0,2,0,0,0,0|2,0,0]=4 8789 B9R0.5 CCSCCC(C)N=C=O Amb27434959 [0,2,0,0,0,0|1,0,1]=4 8790 B9R0.5 CC\C=C(/C)CCCCC Amb27666327 [0,2,0,0,0,0|1,0,0]=3 8791 B9R0.5 CN(CC=O)CCCCO Amb28191923 [0,2,0,0,0,0|2,0,0]=4 8792 B9R0.5 CNCC(=O)NCCCN Amb27217696 [0,2,0,0,0,0|2,0,0]=4 8793 B9R0.5 CNCC(=O)NCCCS Amb27637747 [0,2,0,0,0,0|2,0,0]=4 8794 B9R0.5 CNCC(=O)NCCOC Amb21957446 [0,2,0,0,0,0|2,0,0]=4 8795 B9R0.5 CNCC(=O)NCCOC Amb446156 [0,2,0,0,0,0|2,0,0]=4 8796 B9R0.5 CNCC(=O)NCCSC Amb27978960 [0,2,0,0,0,0|2,0,0]=4 8797 B9R0.5 CNCC(=O)OCCOC Amb27770571 [0,2,0,0,0,0|2,0,0]=4 8798 B9R0.5 CNCCNC(=O)CCN Amb27255965 [0,2,0,0,0,0|2,0,0]=4 8799 B9R0.5 CNCCNC(=O)CNC Amb27255966 [0,2,0,0,0,0|2,0,0]=4 8800 B9R0.5 CNCCNC(=O)CSC Amb18798163 [0,2,0,0,0,0|2,0,0]=4 8801 B9R0.5 CNCCOC(=O)COC Amb27214682 [0,2,0,0,0,0|2,0,0]=4 8802 B9R0.5 COCC(=O)CCCCN Amb28050471 [0,2,0,0,0,0|1,0,0]=3 8803 B9R0.5 COCC(=O)CSCCN Amb28255042 [0,2,0,0,0,0|2,0,0]=4 8804 B9R0.5 COCC(=O)NCCCN Amb33527047 [0,2,0,0,0,0|2,0,0]=4 8805 B9R0.5 COCC(=O)NCCCN Amb6259229 [0,2,0,0,0,0|2,0,0]=4 8806 B9R0.5 COCC(=O)OCCCO Amb26408081 [0,2,0,0,0,0|2,0,0]=4 8807 B9R0.5 COCCCC(=O)CC#N Amb28242340 [0,2,0,0,0,0|1,0,0]=3 8808 B9R0.5 COCCCS(=O)CC=O Amb27830933 [0,2,0,0,0,0|2,0,0]=4 8809 B9R0.5 COCCCS(=O)CCO Amb28349796 [0,2,0,0,0,0|2,0,0]=4 8810 B9R0.5 COCCC\C(C)=C\CO Amb27826189 [0,2,0,0,0,0|1,0,1]=4 8811 B9R0.5 COCCNC(=O)CC#N Amb1103427 [0,2,0,0,0,0|2,0,0]=4 8812 B9R0.5 COCCNC(=O)CCBr Amb17325830 [0,2,0,0,0,0|2,0,0]=4 8813 B9R0.5 COCCNC(=O)CCCl Amb1141903 [0,2,0,0,0,0|2,0,0]=4 8814 B9R0.5 COCCNC(=O)CCF Amb27451126 [0,2,0,0,0,0|2,0,0]=4 8815 B9R0.5 COCCNC(=O)CCN Amb1127290 [0,2,0,0,0,0|2,0,0]=4 8816 B9R0.5 COCCOC(=O)CC#N Amb6608773 [0,2,0,0,0,0|2,0,0]=4 8817 B9R0.5 COCCOC(=O)CCS Amb27272878 [0,2,0,0,0,0|2,0,0]=4 8818 B9R0.5 COCCOC(=O)OCCl Amb28314274 [0,2,0,0,0,0|2,0,0]=4 8819 B9R0.5 CONC(=O)CCCCBr Amb27823947 [0,2,0,0,0,0|1,0,0]=3 8820 B9R0.5 CONC(=O)COCCN Amb27614874 [0,2,0,0,0,0|2,0,0]=4 8821 B9R0.5 CO\C=C(\C)CCCCO Amb27427194 [0,2,0,0,0,0|1,0,1]=4 8822 B9R0.5 CSCCNC(=O)CCBr Amb17330723 [0,2,0,0,0,0|2,0,0]=4 8823 B9R0.5 CSCCNC(=O)CCCl Amb9387314 [0,2,0,0,0,0|2,0,0]=4 8824 B9R0.5 CSCCNC(=O)CSC Amb27469802 [0,2,0,0,0,0|2,0,0]=4 8825 B9R0.5 CSCCOC(=O)CSC Amb28049701 [0,2,0,0,0,0|2,0,0]=4 8826 B9R0.5 C\C(=C/CO)CCCCCl Amb27254213 [0,2,0,0,0,0|1,0,1]=4 8827 B9R0.5 C\C(=C/CO)CCCCO Amb27594384 [0,2,0,0,0,0|1,0,1]=4 8828 B9R0.5 C\C=C\C(=O)CCCC#N Amb26981073 [0,2,0,0,0,0|1,0,1]=4 8829 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [0,2,0,0,0,0|1,0,1]=4 8830 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [0,2,0,0,0,0|0,0,0]=2 8831 B9R0.5 C\C=C\C(=O)CCCCF Amb27652289 [0,2,0,0,0,0|1,0,0]=3 8832 B9R0.5 C\C=C\C(=O)CCCOC Amb27235499 [0,2,0,0,0,0|1,0,0]=3 8833 B9R0.5 C\C=C\C(=O)COCCC Amb28312884 [0,2,0,0,0,0|1,0,0]=3 8834 B9R0.5 C\C=C\C(=O)NCCCC Amb27474050 [0,2,0,0,0,0|1,0,0]=3 8835 B9R0.5 C\C=C\C(=O)NCCCN Amb27984514 [0,2,0,0,0,0|2,0,0]=4 8836 B9R0.5 C\C=C\C(=O)OCCCC Amb17940289 [0,2,0,0,0,0|1,0,0]=3 8837 B9R0.5 C\C=C\C(=O)OCCOC Amb24404476 [0,2,0,0,0,0|2,0,0]=4 8838 B9R0.5 C\C=C\C(=O)\C=C\CCC Amb28126812 [0,2,0,0,0,0|0,0,2]=4 8839 B9R0.5 C\C=C\C(O)CCCCC Amb28139884 [0,2,0,0,0,0|0,0,2]=4 8840 B9R0.5 C\C=C\CCC(=O)COC Amb27424966 [0,2,0,0,0,0|0,0,2]=4 8841 B9R0.5 C\C=C\CCC(=O)NCC Amb25338258 [0,2,0,0,0,0|0,0,2]=4 8842 B9R0.5 C\C=C\CC\C(C)=C/C=O Amb27643406 [0,2,0,0,0,0|0,0,2]=4 8843 B9R0.5 C\C=C\CC\C(C)=C\C=O Amb18643316 [0,2,0,0,0,0|0,0,2]=4 8844 B9R0.5 ClC\C=C(/Cl)CCCCCl Amb27872281 [0,2,0,0,0,0|2,0,0]=4 8845 B9R0.5 N#CCC(=O)NCCCO Amb5781537 [0,2,0,0,0,0|2,0,0]=4 8846 B9R0.5 NCCC(=O)NCCCCl Amb28122933 [0,2,0,0,0,0|2,0,0]=4 8847 B9R0.5 NCCC(=O)NCCCF Amb27265917 [0,2,0,0,0,0|2,0,0]=4 8848 B9R0.5 NCCC(=O)NCCCS Amb27985973 [0,2,0,0,0,0|2,0,0]=4 8849 B9R0.5 NCCC(=O)OCCCO Amb27482412 [0,2,0,0,0,0|2,0,0]=4 8850 B9R0.5 O=C(CCBr)NCCCO Amb17331230 [0,2,0,0,0,0|2,0,0]=4 8851 B9R0.5 O=C(CCCl)NCCCCl Amb2125612 [0,2,0,0,0,0|2,0,0]=4 8852 B9R0.5 O=C(CCCl)NCCCO Amb17327508 [0,2,0,0,0,0|2,0,0]=4 8853 B9R0.5 O=C(CCCl)OCCCCl Amb27477838 [0,2,0,0,0,0|2,0,0]=4 8854 B9R0.5 O=C(CCO)OCCCO Amb27652860 [0,2,0,0,0,0|2,0,0]=4 8855 B9R0.5 O=NOC(=O)CCCCCl Amb27214641 [0,2,0,0,0,0|2,0,0]=4 8856 B9R0.5 [C-]#[N+]CCCC(=O)OCC Amb2235706 [0,2,0,0,0,0|1,0,1]=4 8857 B9R0.8 C#CC(=O)C(N)CCOC Amb27404711 [0,2,0,0,0,0|1,0,1]=4 8858 B9R0.8 C#CC(=O)N(C)CCCC Amb27970751 [0,2,0,0,0,0|1,0,1]=4 8859 B9R0.8 C#CCCC(N)C(=O)OC Amb28135954 [0,2,0,0,0,0|0,0,2]=4 8860 B9R0.8 C#CCC[C@H](N)C(=O)OC Amb27640594 [0,2,0,0,0,0|0,0,2]=4 8861 B9R0.8 C=C(C#N)C(O)CCCC Amb18643442 [0,2,0,0,0,0|1,0,1]=4 8862 B9R0.8 C=C(CO)C(O)CCCC Amb27839533 [0,2,0,0,0,0|1,0,0]=3 8863 B9R0.8 C=C(COCC)C(=O)CN Amb27244254 [0,2,0,0,0,0|1,0,1]=4 8864 B9R0.8 C=C(COCC)C(=O)OC Amb27228285 [0,2,0,0,0,0|1,0,1]=4 8865 B9R0.8 C=C(CSCC)C(=O)OC Amb28050304 [0,2,0,0,0,0|1,0,1]=4 8866 B9R0.8 C=C=C(C)C(=O)CCCC Amb28126633 [0,2,0,0,0,0|1,0,1]=4 8867 B9R0.8 C=CC(=O)C(=O)CCCC Amb27617179 [0,2,0,0,0,0|0,0,2]=4 8868 B9R0.8 C=CC(=O)C(N)CCCC Amb28050432 [0,2,0,0,0,0|0,0,1]=3 8869 B9R0.8 C=CC(=O)C(N)CCOC Amb27252812 [0,2,0,0,0,0|1,0,1]=4 8870 B9R0.8 C=CC(C)C(C)CCCC Amb27493593 [0,2,0,0,0,0|1,0,1]=4 8871 B9R0.8 C=CC(C)C(O)CCCC Amb17593607 [0,2,0,0,0,0|1,0,1]=4 8872 B9R0.8 C=CCCC(N)C(=O)OC Amb27866671 [0,2,0,0,0,0|0,0,2]=4 8873 B9R0.8 C=CCCC(N)C(=O)OC Amb32794772 [0,2,0,0,0,0|0,0,2]=4 8874 B9R0.8 C=CCCC(O)C(=O)OC Amb27669786 [0,2,0,0,0,0|0,0,2]=4 8875 B9R0.8 C=CCC[C@@H](N)C(=O)OC Amb27389875 [0,2,0,0,0,0|0,0,2]=4 8876 B9R0.8 C=CCC[C@H](N)C(=O)OC Amb28134398 [0,2,0,0,0,0|0,0,2]=4 8877 B9R0.8 C=C[C@@H](C)[C@@H](N)CCCC Amb27873896 [0,2,0,0,0,0|1,0,1]=4 8878 B9R0.8 C=C[C@@H](C)[C@H](O)CCCC Amb27857168 [0,2,0,0,0,0|1,0,1]=4 8879 B9R0.8 C=C[C@H](C)[C@H](N)CCCC Amb27424985 [0,2,0,0,0,0|1,0,1]=4 8880 B9R0.8 C=C[C@H](C)[C@H](O)CCCC Amb27198444 [0,2,0,0,0,0|1,0,1]=4 8881 B9R0.8 CC#CCC(C)C(=O)CC Amb27859606 [0,2,0,0,0,0|0,0,2]=4 8882 B9R0.8 CC#CCC(C)C(=O)CCl Amb27422908 [0,2,0,0,0,0|0,0,2]=4 8883 B9R0.8 CC#CCC(N)C(=O)OC Amb25076019 [0,2,0,0,0,0|0,0,2]=4 8884 B9R0.8 CC(CCCN)C(=O)NN Amb27593191 [0,2,0,0,0,0|2,0,0]=4 8885 B9R0.8 CCC(=O)C(=O)CCCO Amb27618249 [0,2,0,0,0,0|1,0,1]=4 8886 B9R0.8 CCC(=O)C(C)CCCO Amb28314429 [0,2,0,0,0,0|1,0,0]=3 8887 B9R0.8 CCC(=O)C(C)CCOC Amb28254753 [0,2,0,0,0,0|1,0,0]=3 8888 B9R0.8 CCC(=O)C(C)SCCCl Amb27955804 [0,2,0,0,0,0|2,0,0]=4 8889 B9R0.8 CCC(=O)C(N)CCOC Amb28423088 [0,2,0,0,0,0|1,0,0]=3 8890 B9R0.8 CCC(=O)N(C)CCNC Amb27984418 [0,2,0,0,0,0|2,0,0]=4 8891 B9R0.8 CCC(=O)N(C)CCOC Amb25291328 [0,2,0,0,0,0|2,0,0]=4 8892 B9R0.8 CCCCC(=O)C(=O)OC Amb22755702 [0,2,0,0,0,0|0,0,1]=3 8893 B9R0.8 CCCCC(Br)C(=O)CBr Amb26444150 [0,2,0,0,0,0|0,0,0]=2 8894 B9R0.8 CCCCC(Br)C(=O)OC Amb19514695 [0,2,0,0,0,0|0,0,0]=2 8895 B9R0.8 CCCCC(C)C(=N)NO Amb28388768 [0,2,0,0,0,0|1,0,1]=4 8896 B9R0.8 CCCCC(C)C(=O)CC Amb25359211 [0,2,0,0,0,0|0,0,0]=2 8897 B9R0.8 CCCCC(C)C(=O)NC Amb27627834 [0,2,0,0,0,0|0,0,0]=2 8898 B9R0.8 CCCCC(C)C(C)NC Amb27605555 [0,2,0,0,0,0|1,0,1]=4 8899 B9R0.8 CCCCC(C)C(F)CO Amb27261654 [0,2,0,0,0,0|1,0,1]=4 8900 B9R0.8 CCCCC(C)N(C)C=O Amb28325442 [0,2,0,0,0,0|1,0,0]=3 8901 B9R0.8 CCCCC(C)\C(C)=N\O Amb26370042 [0,2,0,0,0,0|0,0,1]=3 8902 B9R0.8 CCCCC(Cl)C(=O)CC Amb28322143 [0,2,0,0,0,0|0,0,0]=2 8903 B9R0.8 CCCCC(Cl)C(Cl)CC Amb26948736 [0,2,0,0,0,0|1,0,1]=4 8904 B9R0.8 CCCCC(Cl)\C(Cl)=N\O Amb27233549 [0,2,0,0,0,0|1,0,1]=4 8905 B9R0.8 CCCCC(F)C(=O)CC Amb27212037 [0,2,0,0,0,0|0,0,0]=2 8906 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|0,0,2]=4 8907 B9R0.8 CCCCC(N)C(=O)NN Amb27654302 [0,2,0,0,0,0|1,0,0]=3 8908 B9R0.8 CCCCC(N)C(=O)NO Amb22059372 [0,2,0,0,0,0|1,0,0]=3 8909 B9R0.8 CCCCC(N)C(=O)OC Amb9330294 [0,2,0,0,0,0|0,0,0]=2 8910 B9R0.8 CCCCC(N)C(=O)OC Amb9825492 [0,2,0,0,0,0|0,0,0]=2 8911 B9R0.8 CCCCC(N)\C(O)=N\O Amb20669518 [0,2,0,0,0,0|1,0,1]=4 8912 B9R0.8 CCCCC(O)C(=O)CO Amb27434084 [0,2,0,0,0,0|0,0,0]=2 8913 B9R0.8 CCCCC(O)C(C)CC Amb4020074 [0,2,0,0,0,0|1,0,1]=4 8914 B9R0.8 CCCCC(O)C(C)CN Amb26392245 [0,2,0,0,0,0|1,0,1]=4 8915 B9R0.8 CCCCC(O)C(C)NC Amb27252118 [0,2,0,0,0,0|1,0,1]=4 8916 B9R0.8 CCCCC(O)C(C)OC Amb28049582 [0,2,0,0,0,0|0,0,2]=4 8917 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [0,2,0,0,0,0|1,0,1]=4 8918 B9R0.8 CCCCC(O)C(O)CO Amb8514775 [0,2,0,0,0,0|0,0,2]=4 8919 B9R0.8 CCCCC(O)\C(F)=C\F Amb28050743 [0,2,0,0,0,0|1,0,1]=4 8920 B9R0.8 CCCCC(S)C(=O)OC Amb24745120 [0,2,0,0,0,0|0,0,0]=2 8921 B9R0.8 CCCCN(C)C(=N)NC Amb27222838 [0,2,0,0,0,0|2,0,0]=4 8922 B9R0.8 CCCCN(C)C(=O)CCl Amb6272027 [0,2,0,0,0,0|1,0,0]=3 8923 B9R0.8 CCCCN(C)C(=O)CN Amb5783143 [0,2,0,0,0,0|1,0,0]=3 8924 B9R0.8 CCCCN(C)C(=O)CO Amb17334237 [0,2,0,0,0,0|1,0,0]=3 8925 B9R0.8 CCCCN(C)C(=O)CS Amb33548706 [0,2,0,0,0,0|1,0,0]=3 8926 B9R0.8 CCCCN(N)C(=O)CC Amb33191485 [0,2,0,0,0,0|1,0,0]=3 8927 B9R0.8 CCCCN(N)C(=O)OC Amb33191487 [0,2,0,0,0,0|1,0,0]=3 8928 B9R0.8 CCCC[C@@H](C)C(=O)OC Amb27172534 [0,2,0,0,0,0|0,0,0]=2 8929 B9R0.8 CCCC[C@@H](C)[C@@H](O)CC Amb27981905 [0,2,0,0,0,0|0,0,2]=4 8930 B9R0.8 CCCC[C@@H](C)[C@H](O)CC Amb27980692 [0,2,0,0,0,0|0,0,2]=4 8931 B9R0.8 CCCC[C@@H](Cl)[C@H](C)CO Amb27843309 [0,2,0,0,0,0|0,0,2]=4 8932 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb16183949 [0,2,0,0,0,0|0,0,0]=2 8933 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb22745342 [0,2,0,0,0,0|0,0,0]=2 8934 B9R0.8 CCCC[C@@H](N)[C@@H](C)CC Amb27240864 [0,2,0,0,0,0|1,0,1]=4 8935 B9R0.8 CCCC[C@@H](O)[C@@H](C)CC Amb27839219 [0,2,0,0,0,0|1,0,1]=4 8936 B9R0.8 CCCC[C@@H](O)[C@@H](C)CO Amb28125795 [0,2,0,0,0,0|0,0,2]=4 8937 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [0,2,0,0,0,0|1,0,1]=4 8938 B9R0.8 CCCC[C@@H](O)[C@H](C)CO Amb27756413 [0,2,0,0,0,0|0,0,2]=4 8939 B9R0.8 CCCC[C@H](Cl)C(=O)OC Amb27823590 [0,2,0,0,0,0|0,0,0]=2 8940 B9R0.8 CCCC[C@H](N)C(=O)OC Amb22169631 [0,2,0,0,0,0|0,0,0]=2 8941 B9R0.8 CCCC[C@H](N)C(=O)OC Amb26391986 [0,2,0,0,0,0|0,0,0]=2 8942 B9R0.8 CCCC[C@H](O)C(=O)OC Amb27589932 [0,2,0,0,0,0|0,0,0]=2 8943 B9R0.8 CCCC[C@H](O)[C@@H](C)C=O Amb27770429 [0,2,0,0,0,0|0,0,1]=3 8944 B9R0.8 CCCC[C@H](O)[C@@H](C)CO Amb27775544 [0,2,0,0,0,0|0,0,2]=4 8945 B9R0.8 CCCC\C(F)=C(/F)CO Amb28069334 [0,2,0,0,0,0|1,0,1]=4 8946 B9R0.8 CCCNC(=O)C(=O)NC Amb3607686 [0,2,0,0,0,0|1,0,1]=4 8947 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [0,2,0,0,0,0|1,0,0]=3 8948 B9R0.8 CCCNC(C)C(=O)OC Amb32751764 [0,2,0,0,0,0|1,0,0]=3 8949 B9R0.8 CCCN[C@H](C)C(=O)OC Amb27812247 [0,2,0,0,0,0|1,0,0]=3 8950 B9R0.8 CCCOC(=O)C(=O)CF Amb27616563 [0,2,0,0,0,0|1,0,1]=4 8951 B9R0.8 CCCON(Cl)C(=O)NC Amb27799788 [0,2,0,0,0,0|2,0,0]=4 8952 B9R0.8 CCCO[C@@H](C)C(=O)CC Amb27433171 [0,2,0,0,0,0|1,0,0]=3 8953 B9R0.8 CCCO[C@H](C)C(=O)OC Amb28145144 [0,2,0,0,0,0|1,0,0]=3 8954 B9R0.8 CCCSC(C)C(=O)NC Amb24420363 [0,2,0,0,0,0|1,0,0]=3 8955 B9R0.8 CCC\C=C(\C)C(=O)CC Amb27854893 [0,2,0,0,0,0|0,0,2]=4 8956 B9R0.8 CCC\C=C(\C)C(=O)CO Amb27844148 [0,2,0,0,0,0|0,0,2]=4 8957 B9R0.8 CCNCC(C)C(=O)NN Amb27864683 [0,2,0,0,0,0|2,0,0]=4 8958 B9R0.8 CCNCC(C)C(=O)OC Amb9400286 [0,2,0,0,0,0|1,0,0]=3 8959 B9R0.8 CCNCC(I)C(=O)OC Amb27839610 [0,2,0,0,0,0|1,0,0]=3 8960 B9R0.8 CCOCC(Br)C(=O)OC Amb27443366 [0,2,0,0,0,0|1,0,0]=3 8961 B9R0.8 CCOCC(Cl)C(=O)CCl Amb27657708 [0,2,0,0,0,0|1,0,0]=3 8962 B9R0.8 CCOCC(N)C(=O)OC Amb26578258 [0,2,0,0,0,0|1,0,0]=3 8963 B9R0.8 CCOC[C@@H](N)C(=O)OC Amb24478281 [0,2,0,0,0,0|1,0,0]=3 8964 B9R0.8 CCOC[C@H](N)C(=O)OC Amb26047386 [0,2,0,0,0,0|1,0,0]=3 8965 B9R0.8 CCONC(C)C(=O)NC Amb27483948 [0,2,0,0,0,0|2,0,0]=4 8966 B9R0.8 CCSCC(Br)C(=O)OC Amb28424307 [0,2,0,0,0,0|1,0,0]=3 8967 B9R0.8 CCSCC(C)C(=O)NN Amb27815660 [0,2,0,0,0,0|2,0,0]=4 8968 B9R0.8 CCSCC(Cl)C(=O)OC Amb27454062 [0,2,0,0,0,0|1,0,0]=3 8969 B9R0.8 CCSCC(N)C(=O)NC Amb27199796 [0,2,0,0,0,0|1,0,0]=3 8970 B9R0.8 CCSCC(N)C(=O)OC Amb18788226 [0,2,0,0,0,0|1,0,0]=3 8971 B9R0.8 CCSCC(O)C(=O)OC Amb27881455 [0,2,0,0,0,0|1,0,0]=3 8972 B9R0.8 CC\C=C\C(N)C(=O)OC Amb33268687 [0,2,0,0,0,0|0,0,2]=4 8973 B9R0.8 CC\C=C\C(O)C(=O)OC Amb32663237 [0,2,0,0,0,0|0,0,2]=4 8974 B9R0.8 CN(CCCO)C(=O)CS Amb27982262 [0,2,0,0,0,0|2,0,0]=4 8975 B9R0.8 CNC(=O)C(Br)CCCBr Amb27632799 [0,2,0,0,0,0|1,0,0]=3 8976 B9R0.8 CNC(=O)C(C)CCCN Amb27167461 [0,2,0,0,0,0|1,0,0]=3 8977 B9R0.8 CNC(=O)C(C)NCCF Amb27239508 [0,2,0,0,0,0|2,0,0]=4 8978 B9R0.8 CNC(=O)C(N)CCOC Amb18311406 [0,2,0,0,0,0|1,0,0]=3 8979 B9R0.8 CNC(=O)C(N)CCSC Amb23443538 [0,2,0,0,0,0|1,0,0]=3 8980 B9R0.8 CNC(=O)C(N)CCSC Amb32666291 [0,2,0,0,0,0|1,0,0]=3 8981 B9R0.8 CNC(=O)N(C)CCCBr Amb27971575 [0,2,0,0,0,0|2,0,0]=4 8982 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb17232422 [0,2,0,0,0,0|1,0,0]=3 8983 B9R0.8 CNC(=O)[C@@H](N)CCSC Amb32653153 [0,2,0,0,0,0|1,0,0]=3 8984 B9R0.8 CNC(=O)[C@H](N)CCSC Amb27600839 [0,2,0,0,0,0|1,0,0]=3 8985 B9R0.8 CNCCC(N)C(=O)OC Amb32993440 [0,2,0,0,0,0|1,0,0]=3 8986 B9R0.8 CNCCN(C)C(=O)OC Amb25853559 [0,2,0,0,0,0|2,0,0]=4 8987 B9R0.8 COC(=O)C(=O)CCCBr Amb24440505 [0,2,0,0,0,0|1,0,1]=4 8988 B9R0.8 COC(=O)C(=O)CCCCl Amb28287936 [0,2,0,0,0,0|1,0,1]=4 8989 B9R0.8 COC(=O)C(Br)CCCBr Amb10071878 [0,2,0,0,0,0|1,0,0]=3 8990 B9R0.8 COC(=O)C(C)CCCCl Amb27626035 [0,2,0,0,0,0|1,0,0]=3 8991 B9R0.8 COC(=O)C(C)CCCN Amb25904967 [0,2,0,0,0,0|1,0,0]=3 8992 B9R0.8 COC(=O)C(C)CSSC Amb27969893 [0,2,0,0,0,0|2,0,0]=4 8993 B9R0.8 COC(=O)C(C)NCCF Amb25032140 [0,2,0,0,0,0|2,0,0]=4 8994 B9R0.8 COC(=O)C(C)NCCN Amb27426861 [0,2,0,0,0,0|2,0,0]=4 8995 B9R0.8 COC(=O)C(C)NCCO Amb28137392 [0,2,0,0,0,0|2,0,0]=4 8996 B9R0.8 COC(=O)C(Cl)CCSC Amb18327893 [0,2,0,0,0,0|1,0,0]=3 8997 B9R0.8 COC(=O)C(N)CCC#N Amb28076162 [0,2,0,0,0,0|1,0,1]=4 8998 B9R0.8 COC(=O)C(N)CCCF Amb26857313 [0,2,0,0,0,0|1,0,0]=3 8999 B9R0.8 COC(=O)C(N)CCCN Amb9871379 [0,2,0,0,0,0|1,0,0]=3 9000 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,2,0,0,0,0|1,0,0]=3 9001 B9R0.8 COC(=O)C(N)CCCS Amb27974600 [0,2,0,0,0,0|1,0,0]=3 9002 B9R0.8 COC(=O)C(N)CCSC Amb1152979 [0,2,0,0,0,0|1,0,0]=3 9003 B9R0.8 COC(=O)C(N)CCSC Amb2720119 [0,2,0,0,0,0|1,0,0]=3 9004 B9R0.8 COC(=O)C(O)CCCBr Amb24759864 [0,2,0,0,0,0|1,0,0]=3 9005 B9R0.8 COC(=O)C(O)CCCCl Amb24480606 [0,2,0,0,0,0|1,0,0]=3 9006 B9R0.8 COC(=O)C(O)CCCF Amb33196109 [0,2,0,0,0,0|1,0,0]=3 9007 B9R0.8 COC(=O)C(O)CCSC Amb18800831 [0,2,0,0,0,0|1,0,0]=3 9008 B9R0.8 COC(=O)C(S)CCCCl Amb27984780 [0,2,0,0,0,0|1,0,0]=3 9009 B9R0.8 COC(=O)N(C)CCCCl Amb27494070 [0,2,0,0,0,0|2,0,0]=4 9010 B9R0.8 COC(=O)N(C)CCCN Amb6670337 [0,2,0,0,0,0|2,0,0]=4 9011 B9R0.8 COC(=O)[C@@H](N)CCCN Amb16236222 [0,2,0,0,0,0|1,0,0]=3 9012 B9R0.8 COC(=O)[C@@H](N)CCCO Amb27260220 [0,2,0,0,0,0|1,0,0]=3 9013 B9R0.8 COC(=O)[C@@H](N)CCON Amb27856127 [0,2,0,0,0,0|2,0,0]=4 9014 B9R0.8 COC(=O)[C@@H](N)CCSC Amb533934 [0,2,0,0,0,0|1,0,0]=3 9015 B9R0.8 COC(=O)[C@@H](N)CCSC Amb8390413 [0,2,0,0,0,0|1,0,0]=3 9016 B9R0.8 COC(=O)[C@@H](O)CCSC Amb28066926 [0,2,0,0,0,0|1,0,0]=3 9017 B9R0.8 COC(=O)[C@H](N)CCSC Amb3939028 [0,2,0,0,0,0|1,0,0]=3 9018 B9R0.8 COC(=O)[C@H](N)CCSC Amb9826085 [0,2,0,0,0,0|1,0,0]=3 9019 B9R0.8 COC(=O)[C@H](O)CCCO Amb27766582 [0,2,0,0,0,0|1,0,0]=3 9020 B9R0.8 COC(=O)[C@H](O)CCSC Amb28207376 [0,2,0,0,0,0|1,0,0]=3 9021 B9R0.8 COCCC(N)C(=O)OC Amb24053179 [0,2,0,0,0,0|1,0,0]=3 9022 B9R0.8 COCCC(N)C(=O)OC Amb28555457 [0,2,0,0,0,0|1,0,0]=3 9023 B9R0.8 COCCC(O)C(=O)OC Amb26933750 [0,2,0,0,0,0|1,0,0]=3 9024 B9R0.8 COCCN(C)C(=O)CBr Amb27971849 [0,2,0,0,0,0|2,0,0]=4 9025 B9R0.8 COCCN(C)C(=O)CCl Amb17232571 [0,2,0,0,0,0|2,0,0]=4 9026 B9R0.8 COCCN(C)C(=O)CN Amb17232010 [0,2,0,0,0,0|2,0,0]=4 9027 B9R0.8 COCC[C@H](N)C(=O)OC Amb27880632 [0,2,0,0,0,0|1,0,0]=3 9028 B9R0.8 COCNC(C)C(=O)OC Amb27838101 [0,2,0,0,0,0|2,0,0]=4 9029 B9R0.8 COCSC(C)C(=O)OC Amb27204212 [0,2,0,0,0,0|2,0,0]=4 9030 B9R0.8 CONC[C@@H](O)C(=O)OC Amb28078805 [0,2,0,0,0,0|2,0,0]=4 9031 B9R0.8 CSCCC(N)C(=O)NN Amb27982597 [0,2,0,0,0,0|2,0,0]=4 9032 B9R0.8 CSCCC(N)C(=O)NO Amb22349956 [0,2,0,0,0,0|2,0,0]=4 9033 B9R0.8 CSCCC(N)C(=O)[SH]=O Amb27437886 [0,2,0,0,0,0|2,0,0]=4 9034 B9R0.8 CSCCC(O)C(=O)NO Amb28188916 [0,2,0,0,0,0|2,0,0]=4 9035 B9R0.8 CSCC[C@@H](N)C(=O)NO Amb27592841 [0,2,0,0,0,0|2,0,0]=4 9036 B9R0.8 CSCC[C@@H](N)C(=O)[SH]=O Amb28291640 [0,2,0,0,0,0|2,0,0]=4 9037 B9R0.8 CSCC[C@H](N)C(=O)NN Amb28290232 [0,2,0,0,0,0|2,0,0]=4 9038 B9R0.8 CSCC[C@H](N)C(=O)NO Amb26846759 [0,2,0,0,0,0|2,0,0]=4 9039 B9R0.8 CSCC[C@H](N)C(=O)O[Zn+] Amb20241025 [0,2,0,0,0,0|2,0,0]=4 9040 B9R0.8 C\C=C(/C)C(=O)CCCC Amb27614929 [0,2,0,0,0,0|1,0,1]=4 9041 B9R0.8 C\C=C(/C)C(O)CCCC Amb27946271 [0,2,0,0,0,0|1,0,0]=3 9042 B9R0.8 C\C=C(/Cl)C(O)CCCC Amb27455885 [0,2,0,0,0,0|1,0,0]=3 9043 B9R0.8 C\C=C(/Cl)C(O)COCC Amb27220167 [0,2,0,0,0,0|2,0,0]=4 9044 B9R0.8 C\C=C\CC(N)C(=O)OC Amb26348150 [0,2,0,0,0,0|0,0,2]=4 9045 B9R0.8 C\C=C\CC(O)C(=O)OC Amb27588872 [0,2,0,0,0,0|0,0,2]=4 9046 B9R0.8 C\C=C\C[C@@H](N)C(=O)OC Amb27169570 [0,2,0,0,0,0|0,0,2]=4 9047 B9R0.8 O=C(CO)[C@H](O)CCCO Amb27427126 [0,2,0,0,0,0|1,0,0]=3 9048 B9R0.20 C#CC(C)(O)CCCCC Amb2721696 [0,2,0,0,0,0|0,0,2]=4 9049 B9R0.20 C=CC(C)(O)CCCCC Amb28049696 [0,2,0,0,0,0|0,0,2]=4 9050 B9R0.20 C=CP(C)(=O)OCCCC Amb4297404 [0,2,0,0,0,0|2,0,0]=4 9051 B9R0.20 CC(C)(C=O)CCCCO Amb27650761 [0,2,0,0,0,0|1,0,1]=4 9052 B9R0.20 CCCCCC(C)(C)C#N Amb27494226 [0,2,0,0,0,0|1,0,1]=4 9053 B9R0.20 CCCCCC(C)(C)CBr Amb26353944 [0,2,0,0,0,0|1,0,1]=4 9054 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|1,0,1]=4 9055 B9R0.20 CCCCCC(C)(C)CCl Amb25804367 [0,2,0,0,0,0|1,0,1]=4 9056 B9R0.20 CCCCCC(C)(C)CN Amb20632202 [0,2,0,0,0,0|1,0,1]=4 9057 B9R0.20 CCCCCC(C)(C)CO Amb26369679 [0,2,0,0,0,0|0,0,2]=4 9058 B9R0.20 CCCCCC(C)(C)NC Amb26958534 [0,2,0,0,0,0|1,0,1]=4 9059 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|1,0,1]=4 9060 B9R0.20 CCCCCC(C)(N)CC Amb27799493 [0,2,0,0,0,0|1,0,1]=4 9061 B9R0.20 CCCCCC(C)(N)CO Amb28049699 [0,2,0,0,0,0|0,0,2]=4 9062 B9R0.20 CCCCCC(C)(O)C#N Amb28049694 [0,2,0,0,0,0|0,0,2]=4 9063 B9R0.20 CCCCCC(C)(O)CC Amb4017959 [0,2,0,0,0,0|0,0,2]=4 9064 B9R0.20 CCCCCC(C)(O)CCl Amb25084549 [0,2,0,0,0,0|0,0,2]=4 9065 B9R0.20 CCCCCC(Cl)(Cl)C=O Amb27838067 [0,2,0,0,0,0|1,0,1]=4 9066 B9R0.20 CCCCCS(=O)(=O)CC Amb4018849 [0,2,0,0,0,0|1,0,0]=3 9067 B9R0.20 CCCCCS(=O)(=O)CCl Amb28345146 [0,2,0,0,0,0|1,0,0]=3 9068 B9R0.20 CCCCCS(=O)(=O)NC Amb26504748 [0,2,0,0,0,0|1,0,0]=3 9069 B9R0.20 CCCCC[C@@](C)(O)C#N Amb26967574 [0,2,0,0,0,0|0,0,2]=4 9070 B9R0.20 CCCCC[Si](C)(C)CCl Amb19883903 [0,2,0,0,0,0|1,1,0]=4 9071 B9R0.20 CCCCOC(C)(C)C=O Amb27490093 [0,2,0,0,0,0|1,0,1]=4 9072 B9R0.20 CCCCOP(=O)(O)CCl Amb27955777 [0,2,0,0,0,0|2,0,0]=4 9073 B9R0.20 CCCCOS(=O)(=O)CC Amb27839376 [0,2,0,0,0,0|2,0,0]=4 9074 B9R0.20 CCCNCP(=O)(O)CC Amb27424768 [0,2,0,0,0,0|2,0,0]=4 9075 B9R0.20 CCCOCC(C)(O)C=O Amb27432311 [0,2,0,0,0,0|1,0,1]=4 9076 B9R0.20 CCOCCC(C)(C)C=O Amb28048808 [0,2,0,0,0,0|1,0,1]=4 9077 B9R0.20 CCS(=O)(=O)CCCCBr Amb9303361 [0,2,0,0,0,0|2,0,0]=4 9078 B9R0.20 CCS(=O)(=O)CCCCCl Amb17139105 [0,2,0,0,0,0|2,0,0]=4 9079 B9R0.20 CCS(=O)(=O)CCCCF Amb27466999 [0,2,0,0,0,0|2,0,0]=4 9080 B9R0.20 CCS(=O)(=O)CCCCN Amb17138599 [0,2,0,0,0,0|2,0,0]=4 9081 B9R0.20 CCSCCS(=O)(=O)CC Amb10669631 [0,2,0,0,0,0|2,0,0]=4 9082 B9R0.20 CNCCCS(=O)(=O)CF Amb28251675 [0,2,0,0,0,0|2,0,0]=4 9083 B9R0.20 CNS(=O)(=O)CCCCO Amb27440675 [0,2,0,0,0,0|2,0,0]=4 9084 B9R0.24 C#CC(=O)NCC(C)CC Amb35715065 [0,2,0,0,0,0|1,0,1]=4 9085 B9R0.24 C#CC(=O)OCC(Br)CC Amb33050566 [0,2,0,0,0,0|1,0,1]=4 9086 B9R0.24 C#CC(=O)OCC(O)CC Amb28065085 [0,2,0,0,0,0|1,0,1]=4 9087 B9R0.24 C#CC(O)CCC(=O)OC Amb27851096 [0,2,0,0,0,0|0,0,2]=4 9088 B9R0.24 C#C[C@@H](O)CCC(=O)OC Amb28207270 [0,2,0,0,0,0|0,0,2]=4 9089 B9R0.24 C=C(CC)CCC(=O)CC Amb27760965 [0,2,0,0,0,0|0,0,1]=3 9090 B9R0.24 C=C(CC)CNC(=O)CN Amb27792144 [0,2,0,0,0,0|1,0,1]=4 9091 B9R0.24 C=CC(=O)CCC(C)CC Amb27227030 [0,2,0,0,0,0|0,0,1]=3 9092 B9R0.24 C=CC(=O)CSC(C)CC Amb27251841 [0,2,0,0,0,0|1,0,1]=4 9093 B9R0.24 C=CC(=O)OCC(C)CC Amb17934097 [0,2,0,0,0,0|1,0,1]=4 9094 B9R0.24 C=CC(C)CCC(=O)CC Amb28141338 [0,2,0,0,0,0|0,0,2]=4 9095 B9R0.24 C=CC(N)CCC(=O)OC Amb18124639 [0,2,0,0,0,0|0,0,2]=4 9096 B9R0.24 C=C[C@@H](N)CCC(=O)OC Amb27247194 [0,2,0,0,0,0|0,0,2]=4 9097 B9R0.24 CC(CO)CCC(=O)NN Amb28350052 [0,2,0,0,0,0|2,0,0]=4 9098 B9R0.24 CC(CO)CNC(=O)CBr Amb27175197 [0,2,0,0,0,0|2,0,0]=4 9099 B9R0.24 CC(CO)CNC(=O)CCl Amb27833178 [0,2,0,0,0,0|2,0,0]=4 9100 B9R0.24 CC(CO)CNC(=O)CN Amb27197708 [0,2,0,0,0,0|2,0,0]=4 9101 B9R0.24 CC(CO)CNC(=O)CS Amb27401279 [0,2,0,0,0,0|2,0,0]=4 9102 B9R0.24 CCC(=O)CCC(=O)CC Amb8391992 [0,2,0,0,0,0|0,0,1]=3 9103 B9R0.24 CCC(=O)CCC(C)C=O Amb27424839 [0,2,0,0,0,0|0,0,2]=4 9104 B9R0.24 CCC(=O)CCC(C)CC Amb28348884 [0,2,0,0,0,0|0,0,0]=2 9105 B9R0.24 CCC(=O)CCC(C)CN Amb28060686 [0,2,0,0,0,0|1,0,0]=3 9106 B9R0.24 CCC(=O)CCC(N)CC Amb27454005 [0,2,0,0,0,0|0,0,0]=2 9107 B9R0.24 CCC(=O)CCC(O)CF Amb28437142 [0,2,0,0,0,0|1,0,0]=3 9108 B9R0.24 CCC(=O)CNC(=O)CCl Amb24725631 [0,2,0,0,0,0|1,0,1]=4 9109 B9R0.24 CCC(=O)CNC(=O)CO Amb27448700 [0,2,0,0,0,0|1,0,1]=4 9110 B9R0.24 CCC(=O)COC(=O)CC Amb27598340 [0,2,0,0,0,0|1,0,1]=4 9111 B9R0.24 CCC(=O)COC(C)CC Amb27395562 [0,2,0,0,0,0|1,0,0]=3 9112 B9R0.24 CCC(=O)CSC(C)CC Amb18800476 [0,2,0,0,0,0|1,0,0]=3 9113 B9R0.24 CCC(=O)NCC(Br)CC Amb27971757 [0,2,0,0,0,0|1,0,0]=3 9114 B9R0.24 CCC(=O)NCC(C)CBr Amb28249686 [0,2,0,0,0,0|2,0,0]=4 9115 B9R0.24 CCC(=O)NCC(C)CCl Amb28049464 [0,2,0,0,0,0|2,0,0]=4 9116 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,2,0,0,0,0|2,0,0]=4 9117 B9R0.24 CCC(=O)NCC(N)CC Amb27663327 [0,2,0,0,0,0|1,0,0]=3 9118 B9R0.24 CCC(=O)NCC(O)CC Amb27426269 [0,2,0,0,0,0|1,0,0]=3 9119 B9R0.24 CCC(=O)NC[C@@H](O)CO Amb33041812 [0,2,0,0,0,0|2,0,0]=4 9120 B9R0.24 CCC(=O)OCC(Br)CC Amb33276519 [0,2,0,0,0,0|1,0,0]=3 9121 B9R0.24 CCC(=O)OCC(C)CBr Amb27603933 [0,2,0,0,0,0|2,0,0]=4 9122 B9R0.24 CCC(=O)OCC(O)CCl Amb27959738 [0,2,0,0,0,0|2,0,0]=4 9123 B9R0.24 CCC(=O)OCC(O)CO Amb24740407 [0,2,0,0,0,0|2,0,0]=4 9124 B9R0.24 CCC(=O)OC[C@@H](O)CBr Amb28208346 [0,2,0,0,0,0|2,0,0]=4 9125 B9R0.24 CCC(Br)CCC(=O)OC Amb28049989 [0,2,0,0,0,0|0,0,0]=2 9126 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,2,0,0,0,0|0,0,2]=4 9127 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,0]=2 9128 B9R0.24 CCC(C)CCC(C)CCl Amb27838951 [0,2,0,0,0,0|1,0,1]=4 9129 B9R0.24 CCC(C)CCC(C)CN Amb27838972 [0,2,0,0,0,0|1,0,1]=4 9130 B9R0.24 CCC(C)CCC(N)CC Amb27436682 [0,2,0,0,0,0|1,0,1]=4 9131 B9R0.24 CCC(C)CCC(O)CCl Amb27770538 [0,2,0,0,0,0|0,0,2]=4 9132 B9R0.24 CCC(C)CNC(=O)CBr Amb23512819 [0,2,0,0,0,0|1,0,0]=3 9133 B9R0.24 CCC(C)COC(=O)CO Amb27425710 [0,2,0,0,0,0|1,0,0]=3 9134 B9R0.24 CCC(C)C\C=C(\C)C=O Amb27493317 [0,2,0,0,0,0|0,0,1]=3 9135 B9R0.24 CCC(C)NCC(=O)OC Amb6687134 [0,2,0,0,0,0|1,0,0]=3 9136 B9R0.24 CCC(C)NC\C(C)=C\Cl Amb27410124 [0,2,0,0,0,0|2,0,0]=4 9137 B9R0.24 CCC(C)OCC(=O)CCl Amb27250551 [0,2,0,0,0,0|1,0,0]=3 9138 B9R0.24 CCC(C)ONC(=O)NC Amb27456067 [0,2,0,0,0,0|2,0,0]=4 9139 B9R0.24 CCC(C)SCC(=N)NC Amb27463060 [0,2,0,0,0,0|2,0,0]=4 9140 B9R0.24 CCC(C)SCC(=O)NC Amb28138235 [0,2,0,0,0,0|1,0,0]=3 9141 B9R0.24 CCC(C)\C=C/C(=O)OC Amb27760361 [0,2,0,0,0,0|0,0,2]=4 9142 B9R0.24 CCC(C)\C=C\C(=O)OC Amb28049396 [0,2,0,0,0,0|0,0,2]=4 9143 B9R0.24 CCC(Cl)CCC(=O)OC Amb28076681 [0,2,0,0,0,0|0,0,0]=2 9144 B9R0.24 CCC(F)CSC(=S)OC Amb28074894 [0,2,0,0,0,0|1,1,0]=4 9145 B9R0.24 CCC(N)C#CC(=O)OC Amb33168797 [0,2,0,0,0,0|0,0,2]=4 9146 B9R0.24 CCC(N)CCC(=O)NC Amb27483390 [0,2,0,0,0,0|0,0,0]=2 9147 B9R0.24 CCC(N)CCC(=O)OC Amb26855249 [0,2,0,0,0,0|0,0,0]=2 9148 B9R0.24 CCC(N)CCC(=O)OC Amb33483211 [0,2,0,0,0,0|0,0,0]=2 9149 B9R0.24 CCC(N)CCC(N)CC Amb28388809 [0,2,0,0,0,0|1,0,1]=4 9150 B9R0.24 CCC(N)CNC(=O)NC Amb27172077 [0,2,0,0,0,0|1,0,0]=3 9151 B9R0.24 CCC(O)C#CC(=O)OC Amb22043388 [0,2,0,0,0,0|0,0,2]=4 9152 B9R0.24 CCC(O)CCC(=O)NN Amb6337544 [0,2,0,0,0,0|1,0,0]=3 9153 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,2,0,0,0,0|0,0,0]=2 9154 B9R0.24 CCC(O)CCC(O)CC Amb27218701 [0,2,0,0,0,0|0,0,2]=4 9155 B9R0.24 CCC(O)CNC(=O)CBr Amb28256000 [0,2,0,0,0,0|1,0,0]=3 9156 B9R0.24 CCC(O)CNC(=O)CN Amb27242062 [0,2,0,0,0,0|1,0,0]=3 9157 B9R0.24 CCN(C)CCC(=O)OC Amb8890963 [0,2,0,0,0,0|1,0,0]=3 9158 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,2,0,0,0,0|0,0,0]=2 9159 B9R0.24 CC[C@@H](O)CC[C@H](O)CC Amb8516406 [0,2,0,0,0,0|0,0,2]=4 9160 B9R0.24 CC[C@H](O)CC[C@@H](O)CC Amb8516407 [0,2,0,0,0,0|0,0,2]=4 9161 B9R0.24 CC[C@H](O)CNC(=O)NC Amb27945374 [0,2,0,0,0,0|1,0,0]=3 9162 B9R0.24 CC[C@H](O)CN\C(N)=N\C Amb27406622 [0,2,0,0,0,0|2,0,0]=4 9163 B9R0.24 CNC(=O)CCC(=O)NC Amb4017621 [0,2,0,0,0,0|1,0,1]=4 9164 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,1]=4 9165 B9R0.24 CNC(=O)CCC(C)C#N Amb28248720 [0,2,0,0,0,0|1,0,1]=4 9166 B9R0.24 CNC(=O)CCN(C)OC Amb27485562 [0,2,0,0,0,0|2,0,0]=4 9167 B9R0.24 CNC(=O)NCC(C)CO Amb28363662 [0,2,0,0,0,0|2,0,0]=4 9168 B9R0.24 CNC(=O)NC[C@@H](C)OC Amb35637593 [0,2,0,0,0,0|2,0,0]=4 9169 B9R0.24 CNC(=O)NC[C@H](C)OC Amb35641868 [0,2,0,0,0,0|2,0,0]=4 9170 B9R0.24 COC(=O)CCC(=O)CBr Amb33526898 [0,2,0,0,0,0|1,0,1]=4 9171 B9R0.24 COC(=O)CCC(=O)CCl Amb26649344 [0,2,0,0,0,0|1,0,1]=4 9172 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,1]=4 9173 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,2,0,0,0,0|1,0,1]=4 9174 B9R0.24 COC(=O)CCC(=O)OC Amb2793094 [0,2,0,0,0,0|1,0,1]=4 9175 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|1,0,1]=4 9176 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,2,0,0,0,0|1,0,0]=3 9177 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,2,0,0,0,0|1,0,0]=3 9178 B9R0.24 COC(=O)CCC(C)OC Amb26355788 [0,2,0,0,0,0|1,0,0]=3 9179 B9R0.24 COC(=O)CCC(Cl)C=O Amb27760397 [0,2,0,0,0,0|1,0,1]=4 9180 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,2,0,0,0,0|1,0,0]=3 9181 B9R0.24 COC(=O)CCN(C)OC Amb27206937 [0,2,0,0,0,0|2,0,0]=4 9182 B9R0.24 COC(=O)CCS(=O)OC Amb22728623 [0,2,0,0,0,0|2,0,0]=4 9183 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,2,0,0,0,0|1,0,0]=3 9184 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,2,0,0,0,0|1,0,0]=3 9185 B9R0.24 COC(=O)CC[C@@H](O)C#N Amb27763450 [0,2,0,0,0,0|1,0,1]=4 9186 B9R0.24 COC(=O)CC[C@@H](O)CO Amb27761525 [0,2,0,0,0,0|1,0,0]=3 9187 B9R0.24 COC(=O)CC[C@H](N)CF Amb27628411 [0,2,0,0,0,0|1,0,0]=3 9188 B9R0.24 COC(=O)CC[C@H](O)C#N Amb28050749 [0,2,0,0,0,0|1,0,1]=4 9189 B9R0.24 COC(=O)CC[C@H](O)CBr Amb27635803 [0,2,0,0,0,0|1,0,0]=3 9190 B9R0.24 COC(=O)NCC(C)CO Amb28286586 [0,2,0,0,0,0|2,0,0]=4 9191 B9R0.24 COC(=O)NCC(N)CO Amb27598507 [0,2,0,0,0,0|2,0,0]=4 9192 B9R0.24 COC(=O)NCC(O)CO Amb27876174 [0,2,0,0,0,0|2,0,0]=4 9193 B9R0.24 COC(=O)OCC(C)CBr Amb27391484 [0,2,0,0,0,0|2,0,0]=4 9194 B9R0.24 COC(=O)OCC(Cl)CCl Amb27483962 [0,2,0,0,0,0|2,0,0]=4 9195 B9R0.24 COC(C)CCC(=O)CN Amb27257316 [0,2,0,0,0,0|1,0,0]=3 9196 B9R0.24 COC(C)CCC(=O)NN Amb27232398 [0,2,0,0,0,0|2,0,0]=4 9197 B9R0.24 COC(C)CNC(=O)CN Amb27474446 [0,2,0,0,0,0|2,0,0]=4 9198 B9R0.24 COC(C)CNC(=O)CS Amb27656573 [0,2,0,0,0,0|2,0,0]=4 9199 B9R0.24 NCC(=O)CCC(=O)CCl Amb27767996 [0,2,0,0,0,0|1,0,1]=4 9200 B9R0.24 O=C(CBr)OC[C@@H](O)CO Amb27488630 [0,2,0,0,0,0|2,0,0]=4 9201 B9R0.24 O=C(CCl)NCC(O)CO Amb22754889 [0,2,0,0,0,0|2,0,0]=4 9202 B9R0.24 O=C(CCl)NC[C@H](O)CO Amb28072856 [0,2,0,0,0,0|2,0,0]=4 9203 B9R0.24 O=C(CCl)OCC(Br)CBr Amb22359777 [0,2,0,0,0,0|2,0,0]=4 9204 B9R0.24 O=C(CCl)OCC(O)CO Amb27599954 [0,2,0,0,0,0|2,0,0]=4 9205 B9R0.24 O=C(CCl)OCC(S)CS Amb27949678 [0,2,0,0,0,0|2,0,0]=4 9206 B9R0.24 O=C(CF)OCC(O)CO Amb27879504 [0,2,0,0,0,0|2,0,0]=4 9207 B9R0.24 O=C(CS)OC[C@@H](O)CO Amb33872511 [0,2,0,0,0,0|2,0,0]=4 9208 B9R0.46 C#CC(=O)COCCOC Amb27227579 [0,2,0,0,0,0|1,0,1]=4 9209 B9R0.46 C#CC(=O)NCCCCN Amb27617081 [0,2,0,0,0,0|1,0,1]=4 9210 B9R0.46 C#CC(=O)NCCCOC Amb27243177 [0,2,0,0,0,0|1,0,1]=4 9211 B9R0.46 C#CC(C)NCCCCC Amb26492885 [0,2,0,0,0,0|1,0,1]=4 9212 B9R0.46 C#CCCCCC(=O)NC Amb27173831 [0,2,0,0,0,0|0,0,1]=3 9213 B9R0.46 C#CCCCCC(=O)NN Amb28342637 [0,2,0,0,0,0|1,0,1]=4 9214 B9R0.46 C#CCCCCC(=O)NO Amb28049733 [0,2,0,0,0,0|1,0,1]=4 9215 B9R0.46 C#CCCCCC(=O)OC Amb18636156 [0,2,0,0,0,0|0,0,1]=3 9216 B9R0.46 C#CCCCNC(=O)CN Amb27175192 [0,2,0,0,0,0|0,0,2]=4 9217 B9R0.46 C#CCCCNC(=O)OC Amb28124676 [0,2,0,0,0,0|0,0,2]=4 9218 B9R0.46 C#CCCNCC(=O)NC Amb27431553 [0,2,0,0,0,0|0,0,2]=4 9219 B9R0.46 C#CCOCCC(=O)OC Amb9208651 [0,2,0,0,0,0|0,0,2]=4 9220 B9R0.46 C#C\C(C)=C/CCNCC Amb28049607 [0,2,0,0,0,0|1,0,1]=4 9221 B9R0.46 C=C(C=O)CCCCC=O Amb28049873 [0,2,0,0,0,0|0,0,2]=4 9222 B9R0.46 C=C(C=O)CCCCCC Amb8392631 [0,2,0,0,0,0|0,0,1]=3 9223 B9R0.46 C=C(C=O)CCCCCCl Amb27815104 [0,2,0,0,0,0|0,0,1]=3 9224 B9R0.46 C=C(C=O)CC\C=C/CC Amb26462856 [0,2,0,0,0,0|0,0,2]=4 9225 B9R0.46 C=C(C=O)CC\C=C\CC Amb27422502 [0,2,0,0,0,0|0,0,2]=4 9226 B9R0.46 C=C(CC)CNCCCN Amb27452800 [0,2,0,0,0,0|2,0,0]=4 9227 B9R0.46 C=C(CC)COCCCN Amb28064279 [0,2,0,0,0,0|2,0,0]=4 9228 B9R0.46 C=C(CC)COCCNC Amb27853310 [0,2,0,0,0,0|2,0,0]=4 9229 B9R0.46 C=C(CC)CSCCCC Amb28370393 [0,2,0,0,0,0|1,0,0]=3 9230 B9R0.46 C=C(CC)CSCCCF Amb27424941 [0,2,0,0,0,0|2,0,0]=4 9231 B9R0.46 C=C(CC)CSCCNC Amb27228403 [0,2,0,0,0,0|2,0,0]=4 9232 B9R0.46 C=C(CNCCCC)SC Amb27597601 [0,2,0,0,0,0|1,0,0]=3 9233 B9R0.46 C=C(CO)CCC\C=C\C Amb27603280 [0,2,0,0,0,0|1,0,1]=4 9234 B9R0.46 C=C(CS)COCCSC Amb27399947 [0,2,0,0,0,0|2,0,0]=4 9235 B9R0.46 C=C(CS)CSCCOC Amb27982089 [0,2,0,0,0,0|2,0,0]=4 9236 B9R0.46 C=C(CS)CSCCSC Amb27491703 [0,2,0,0,0,0|2,0,0]=4 9237 B9R0.46 C=CC(=O)CCCCCC Amb27410225 [0,2,0,0,0,0|0,0,1]=3 9238 B9R0.46 C=CC(=O)CC\C=C/CC Amb27945136 [0,2,0,0,0,0|0,0,2]=4 9239 B9R0.46 C=CC(=O)CNCCOC Amb27468403 [0,2,0,0,0,0|1,0,1]=4 9240 B9R0.46 C=CC(=O)COCCOC Amb28322489 [0,2,0,0,0,0|1,0,1]=4 9241 B9R0.46 C=CC(=O)NCCCCN Amb27754638 [0,2,0,0,0,0|1,0,1]=4 9242 B9R0.46 C=CC(=O)NCCCCO Amb27839560 [0,2,0,0,0,0|1,0,1]=4 9243 B9R0.46 C=CC(=O)NCCCOC Amb9480633 [0,2,0,0,0,0|1,0,1]=4 9244 B9R0.46 C=CC(=O)NCCSCC Amb27770559 [0,2,0,0,0,0|1,0,1]=4 9245 B9R0.46 C=CC(=O)OCCCCC Amb17933944 [0,2,0,0,0,0|0,0,1]=3 9246 B9R0.46 C=CC(=O)OCCCCCl Amb25934163 [0,2,0,0,0,0|1,0,1]=4 9247 B9R0.46 C=CC(=O)OCCNCC Amb28119985 [0,2,0,0,0,0|1,0,1]=4 9248 B9R0.46 C=CC(=O)OCCOCC Amb15692678 [0,2,0,0,0,0|1,0,1]=4 9249 B9R0.46 C=CC(=O)OCCSCC Amb25934756 [0,2,0,0,0,0|1,0,1]=4 9250 B9R0.46 C=CC(=O)SCCCCO Amb27775857 [0,2,0,0,0,0|1,0,1]=4 9251 B9R0.46 C=CC(C)CNCCCC Amb27785858 [0,2,0,0,0,0|1,0,1]=4 9252 B9R0.46 C=CC(C)NCCCCC Amb27857647 [0,2,0,0,0,0|1,0,1]=4 9253 B9R0.46 C=CCCCCC(=C)C=O Amb27622105 [0,2,0,0,0,0|0,0,2]=4 9254 B9R0.46 C=CCCCCC(=O)OC Amb27617093 [0,2,0,0,0,0|0,0,1]=3 9255 B9R0.46 C=CCCCNC(=O)CBr Amb28321467 [0,2,0,0,0,0|0,0,2]=4 9256 B9R0.46 C=CCCCNC(=O)CC Amb27835179 [0,2,0,0,0,0|0,0,2]=4 9257 B9R0.46 C=CCCCOC(=O)CN Amb27464435 [0,2,0,0,0,0|0,0,2]=4 9258 B9R0.46 C=CCCCOC(=O)CO Amb27765648 [0,2,0,0,0,0|0,0,2]=4 9259 B9R0.46 C=CCNCCC(=O)OC Amb33550492 [0,2,0,0,0,0|0,0,2]=4 9260 B9R0.46 C=CCOCCC(=O)OC Amb9208692 [0,2,0,0,0,0|0,0,2]=4 9261 B9R0.46 C=CCSCCC(=O)OC Amb27875920 [0,2,0,0,0,0|0,0,2]=4 9262 B9R0.46 C=C[C@H](C)CCCCCO Amb28138710 [0,2,0,0,0,0|1,0,1]=4 9263 B9R0.46 C=C\C(C)=C/CCNCC Amb28049610 [0,2,0,0,0,0|1,0,1]=4 9264 B9R0.46 CC#CCCNC(=O)CC Amb28076300 [0,2,0,0,0,0|0,0,2]=4 9265 B9R0.46 CC#CCCNC(=O)CO Amb27593816 [0,2,0,0,0,0|0,0,2]=4 9266 B9R0.46 CC#CCCNC(=O)CS Amb28119559 [0,2,0,0,0,0|0,0,2]=4 9267 B9R0.46 CC#CCCOC(=O)CO Amb27867952 [0,2,0,0,0,0|0,0,2]=4 9268 B9R0.46 CC(C=O)CCCCC=O Amb27614225 [0,2,0,0,0,0|0,0,2]=4 9269 B9R0.46 CCC(=O)CCCCC#N Amb27170911 [0,2,0,0,0,0|0,0,1]=3 9270 B9R0.46 CCC(=O)CCCCCO Amb27627259 [0,2,0,0,0,0|0,0,0]=2 9271 B9R0.46 CCC(=O)NCCCC#N Amb28186659 [0,2,0,0,0,0|1,0,1]=4 9272 B9R0.46 CCC(=O)NCCCCF Amb28313877 [0,2,0,0,0,0|1,0,0]=3 9273 B9R0.46 CCC(=O)NCCCCI Amb27839559 [0,2,0,0,0,0|1,0,0]=3 9274 B9R0.46 CCC(=O)NCCCCN Amb17053701 [0,2,0,0,0,0|1,0,0]=3 9275 B9R0.46 CCC(=O)NCCCNC Amb9464380 [0,2,0,0,0,0|1,0,0]=3 9276 B9R0.46 CCC(=O)NCCCOC Amb17775258 [0,2,0,0,0,0|1,0,0]=3 9277 B9R0.46 CCC(=O)NCCCON Amb17138412 [0,2,0,0,0,0|2,0,0]=4 9278 B9R0.46 CCC(=O)NCCCSC Amb28201200 [0,2,0,0,0,0|1,0,0]=3 9279 B9R0.46 CCC(=O)OCCCCBr Amb28120684 [0,2,0,0,0,0|1,0,0]=3 9280 B9R0.46 CCC(=O)OCCCCCl Amb27494048 [0,2,0,0,0,0|1,0,0]=3 9281 B9R0.46 CCC(=O)OCCCCO Amb26485117 [0,2,0,0,0,0|1,0,0]=3 9282 B9R0.46 CCC(=O)OCCCSC Amb28070380 [0,2,0,0,0,0|1,0,0]=3 9283 B9R0.46 CCC(=O)OCSCCO Amb27466870 [0,2,0,0,0,0|2,0,0]=4 9284 B9R0.46 CCC(=S)SCCCCCl Amb27477889 [0,2,0,0,0,0|1,1,0]=4 9285 B9R0.46 CCC(C)CCCCCBr Amb28428516 [0,2,0,0,0,0|1,0,1]=4 9286 B9R0.46 CCC(C)CCCCCN Amb28385774 [0,2,0,0,0,0|1,0,1]=4 9287 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|1,0,1]=4 9288 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|1,0,1]=4 9289 B9R0.46 CCC(N)CCCCCO Amb26865511 [0,2,0,0,0,0|1,0,1]=4 9290 B9R0.46 CCC(O)CCCCNC Amb28193277 [0,2,0,0,0,0|0,0,2]=4 9291 B9R0.46 CCCCC#CC(=O)OC Amb2721692 [0,2,0,0,0,0|0,0,1]=3 9292 B9R0.46 CCCCC=C=C(C)C=O Amb28074739 [0,2,0,0,0,0|0,0,1]=3 9293 B9R0.46 CCCCCCC(=N)NO Amb22733338 [0,2,0,0,0,0|1,0,1]=4 9294 B9R0.46 CCCCCCC(=O)C#N Amb22734561 [0,2,0,0,0,0|0,0,1]=3 9295 B9R0.46 CCCCCCC(=O)C=O Amb28422342 [0,2,0,0,0,0|0,0,1]=3 9296 B9R0.46 CCCCCCC(=O)CBr Amb24078361 [0,2,0,0,0,0|0,0,0]=2 9297 B9R0.46 CCCCCCC(=O)CC Amb2720775 [0,2,0,0,0,0|0,0,0]=2 9298 B9R0.46 CCCCCCC(=O)CF Amb27265611 [0,2,0,0,0,0|0,0,0]=2 9299 B9R0.46 CCCCCCC(=O)CO Amb28254622 [0,2,0,0,0,0|0,0,0]=2 9300 B9R0.46 CCCCCCC(=O)NN Amb2794470 [0,2,0,0,0,0|1,0,0]=3 9301 B9R0.46 CCCCCCC(=O)NN Amb31302345 [0,2,0,0,0,0|1,0,0]=3 9302 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,2,0,0,0,0|1,0,0]=3 9303 B9R0.46 CCCCCCC(=O)OC Amb9787230 [0,2,0,0,0,0|0,0,0]=2 9304 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|1,0,1]=4 9305 B9R0.46 CCCCCCC(Br)CN Amb27626902 [0,2,0,0,0,0|1,0,1]=4 9306 B9R0.46 CCCCCCC(Br)CO Amb28126801 [0,2,0,0,0,0|1,0,1]=4 9307 B9R0.46 CCCCCCC(C)C#N Amb8950096 [0,2,0,0,0,0|1,0,1]=4 9308 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|1,0,1]=4 9309 B9R0.46 CCCCCCC(C)CC Amb6366304 [0,2,0,0,0,0|1,0,1]=4 9310 B9R0.46 CCCCCCC(C)CCl Amb26403332 [0,2,0,0,0,0|1,0,1]=4 9311 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|0,0,2]=4 9312 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|1,0,1]=4 9313 B9R0.46 CCCCCCC(C)NN Amb7795640 [0,2,0,0,0,0|1,0,1]=4 9314 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [0,2,0,0,0,0|1,0,1]=4 9315 B9R0.46 CCCCCCC(Cl)CC Amb27872816 [0,2,0,0,0,0|1,0,1]=4 9316 B9R0.46 CCCCCCC(Cl)CCl Amb9787127 [0,2,0,0,0,0|1,0,1]=4 9317 B9R0.46 CCCCCCC(N)CBr Amb27614898 [0,2,0,0,0,0|1,0,1]=4 9318 B9R0.46 CCCCCCC(N)CO Amb27770563 [0,2,0,0,0,0|1,0,1]=4 9319 B9R0.46 CCCCCCC(O)CC Amb10068521 [0,2,0,0,0,0|0,0,2]=4 9320 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|0,0,2]=4 9321 B9R0.46 CCCCCCC(O)CO Amb8514191 [0,2,0,0,0,0|0,0,2]=4 9322 B9R0.46 CCCCCCC(O)CS Amb27823218 [0,2,0,0,0,0|0,0,2]=4 9323 B9R0.46 CCCCCCC(S)CS Amb16232249 [0,2,0,0,0,0|0,1,1]=4 9324 B9R0.46 CCCCCCN(C)C#N Amb27424944 [0,2,0,0,0,0|2,0,0]=4 9325 B9R0.46 CCCCCCN(C)N=O Amb24655838 [0,2,0,0,0,0|1,0,0]=3 9326 B9R0.46 CCCCCC[C@@H](C)CBr Amb27224123 [0,2,0,0,0,0|1,0,1]=4 9327 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [0,2,0,0,0,0|1,0,1]=4 9328 B9R0.46 CCCCCC[C@@H](Cl)CC Amb27185588 [0,2,0,0,0,0|1,0,1]=4 9329 B9R0.46 CCCCCC[C@@H](F)CBr Amb27872246 [0,2,0,0,0,0|1,0,1]=4 9330 B9R0.46 CCCCCC[C@@H](F)CO Amb27213919 [0,2,0,0,0,0|1,0,1]=4 9331 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [0,2,0,0,0,0|1,0,1]=4 9332 B9R0.46 CCCCCC[C@@H](O)CBr Amb27214043 [0,2,0,0,0,0|0,0,2]=4 9333 B9R0.46 CCCCCC[C@@H](O)CCl Amb27630055 [0,2,0,0,0,0|0,0,2]=4 9334 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|0,0,2]=4 9335 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|0,0,2]=4 9336 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [0,2,0,0,0,0|1,0,1]=4 9337 B9R0.46 CCCCCC[C@H](O)CF Amb27480605 [0,2,0,0,0,0|0,0,2]=4 9338 B9R0.46 CCCCCC[C@H](O)CN Amb27413021 [0,2,0,0,0,0|0,0,2]=4 9339 B9R0.46 CCCCCC\C(C)=C/Cl Amb28076526 [0,2,0,0,0,0|1,0,0]=3 9340 B9R0.46 CCCCCC\C(C)=N\N Amb27758039 [0,2,0,0,0,0|1,0,0]=3 9341 B9R0.46 CCCCCC\C(Cl)=C/Cl Amb28144709 [0,2,0,0,0,0|1,0,1]=4 9342 B9R0.46 CCCCCC\C(Cl)=C\Cl Amb27195843 [0,2,0,0,0,0|1,0,1]=4 9343 B9R0.46 CCCCCC\C(Cl)=N\O Amb27604397 [0,2,0,0,0,0|1,0,1]=4 9344 B9R0.46 CCCCCC\C(F)=C/Cl Amb27791805 [0,2,0,0,0,0|1,0,1]=4 9345 B9R0.46 CCCCCNC(=N)NN Amb22499249 [0,2,0,0,0,0|2,0,0]=4 9346 B9R0.46 CCCCCNC(=N)NN Amb8390921 [0,2,0,0,0,0|2,0,0]=4 9347 B9R0.46 CCCCCNC(=O)CBr Amb17331497 [0,2,0,0,0,0|0,0,0]=2 9348 B9R0.46 CCCCCNC(=O)CC Amb17736727 [0,2,0,0,0,0|0,0,0]=2 9349 B9R0.46 CCCCCNC(=O)CCl Amb1225540 [0,2,0,0,0,0|0,0,0]=2 9350 B9R0.46 CCCCCNC(=O)CN Amb5783142 [0,2,0,0,0,0|0,0,0]=2 9351 B9R0.46 CCCCCNC(=O)NN Amb8853866 [0,2,0,0,0,0|1,0,0]=3 9352 B9R0.46 CCCCCNC(=S)NC Amb4344700 [0,2,0,0,0,0|0,1,0]=3 9353 B9R0.46 CCCCCNC(=S)NN Amb1153021 [0,2,0,0,0,0|1,1,0]=4 9354 B9R0.46 CCCCCNC(C)CC Amb6688188 [0,2,0,0,0,0|1,0,1]=4 9355 B9R0.46 CCCCCNC(C)CCl Amb27805497 [0,2,0,0,0,0|1,0,1]=4 9356 B9R0.46 CCCCCN\C(N)=N\N Amb25251989 [0,2,0,0,0,0|2,0,0]=4 9357 B9R0.46 CCCCCOC(=O)C=O Amb26624671 [0,2,0,0,0,0|0,0,1]=3 9358 B9R0.46 CCCCCOC(=O)CBr Amb22036620 [0,2,0,0,0,0|0,0,0]=2 9359 B9R0.46 CCCCCOC(=O)CN Amb22277108 [0,2,0,0,0,0|0,0,0]=2 9360 B9R0.46 CCCCCOC(=O)CO Amb27839431 [0,2,0,0,0,0|0,0,0]=2 9361 B9R0.46 CCCCCOC(=O)NN Amb28421753 [0,2,0,0,0,0|1,0,0]=3 9362 B9R0.46 CCCCCOC(=O)OC Amb26480707 [0,2,0,0,0,0|0,0,0]=2 9363 B9R0.46 CCCCCOC(=S)S[Na] Amb27874690 [0,2,0,0,0,0|1,1,0]=4 9364 B9R0.46 CCCCCOC(C)CO Amb27857498 [0,2,0,0,0,0|0,0,2]=4 9365 B9R0.46 CCCCCO[C@@H](C)CO Amb27394892 [0,2,0,0,0,0|0,0,2]=4 9366 B9R0.46 CCCCCSC(=S)NN Amb27613114 [0,2,0,0,0,0|1,1,0]=4 9367 B9R0.46 CCCCCSC(=S)OC Amb27756971 [0,2,0,0,0,0|0,1,0]=3 9368 B9R0.46 CCCCCS\C(N)=N\N Amb27968815 [0,2,0,0,0,0|2,0,0]=4 9369 B9R0.46 CCCCC\C=C(/C)C=O Amb18643629 [0,2,0,0,0,0|0,0,0]=2 9370 B9R0.46 CCCCC\C=C(/Cl)C=O Amb27838082 [0,2,0,0,0,0|1,0,0]=3 9371 B9R0.46 CCCCC\C=C(\C)C=O Amb27489308 [0,2,0,0,0,0|0,0,0]=2 9372 B9R0.46 CCCCC\C=C(\C)CN Amb27249901 [0,2,0,0,0,0|1,0,0]=3 9373 B9R0.46 CCCCC\C=C(\Cl)CCl Amb27632425 [0,2,0,0,0,0|1,0,0]=3 9374 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [0,2,0,0,0,0|1,0,0]=3 9375 B9R0.46 CCCCNCC(=O)NN Amb28067634 [0,2,0,0,0,0|1,0,0]=3 9376 B9R0.46 CCCCNCC(C)CCl Amb27424764 [0,2,0,0,0,0|1,0,1]=4 9377 B9R0.46 CCCCNCC(Cl)CC Amb27242061 [0,2,0,0,0,0|1,0,1]=4 9378 B9R0.46 CCCCNCC(N)CC Amb27806280 [0,2,0,0,0,0|1,0,1]=4 9379 B9R0.46 CCCCNCC(O)CC Amb27591960 [0,2,0,0,0,0|0,0,2]=4 9380 B9R0.46 CCCCNCC(O)CO Amb17308645 [0,2,0,0,0,0|0,0,2]=4 9381 B9R0.46 CCCCNCC(S)CS Amb27487335 [0,2,0,0,0,0|0,1,1]=4 9382 B9R0.46 CCCCNC[C@H](O)CC Amb28144394 [0,2,0,0,0,0|0,0,2]=4 9383 B9R0.46 CCCCOCC(=O)CCl Amb27865684 [0,2,0,0,0,0|0,0,0]=2 9384 B9R0.46 CCCCOCC(C)CC Amb27803945 [0,2,0,0,0,0|1,0,1]=4 9385 B9R0.46 CCCCOCC(C)CCl Amb27228843 [0,2,0,0,0,0|1,0,1]=4 9386 B9R0.46 CCCCOCC(N)CC Amb17485997 [0,2,0,0,0,0|1,0,1]=4 9387 B9R0.46 CCCCOCC(N)CO Amb27839156 [0,2,0,0,0,0|1,0,1]=4 9388 B9R0.46 CCCCOCC(O)C=O Amb27646119 [0,2,0,0,0,0|1,0,1]=4 9389 B9R0.46 CCCCOCC(O)CCl Amb9787120 [0,2,0,0,0,0|0,0,2]=4 9390 B9R0.46 CCCCOCC(O)CN Amb8895238 [0,2,0,0,0,0|0,0,2]=4 9391 B9R0.46 CCCCOCC(O)CS Amb28050761 [0,2,0,0,0,0|0,0,2]=4 9392 B9R0.46 CCCCOC[C@@H](O)CC Amb27615814 [0,2,0,0,0,0|0,0,2]=4 9393 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [0,2,0,0,0,0|1,0,1]=4 9394 B9R0.46 CCCCSCC(=O)NN Amb5721976 [0,2,0,0,0,0|1,0,0]=3 9395 B9R0.46 CCCCSCC(=O)OC Amb9262932 [0,2,0,0,0,0|0,0,0]=2 9396 B9R0.46 CCCCSCC(C)C=O Amb27837938 [0,2,0,0,0,0|0,0,1]=3 9397 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|1,0,1]=4 9398 B9R0.46 CCCCSCC(O)CO Amb10669577 [0,2,0,0,0,0|0,0,2]=4 9399 B9R0.46 CCCCSC[C@H](O)CN Amb27221761 [0,2,0,0,0,0|0,0,2]=4 9400 B9R0.46 CCCCSC\C(C)=C\Cl Amb27397514 [0,2,0,0,0,0|1,0,0]=3 9401 B9R0.46 CCCC\C=C\C(=O)OC Amb25339041 [0,2,0,0,0,0|0,0,1]=3 9402 B9R0.46 CCCNCCC(=O)NO Amb28074897 [0,2,0,0,0,0|1,0,0]=3 9403 B9R0.46 CCCNCCC(C)CC Amb28124478 [0,2,0,0,0,0|1,0,1]=4 9404 B9R0.46 CCCNCCC(N)CC Amb28123553 [0,2,0,0,0,0|1,0,1]=4 9405 B9R0.46 CCCNCCC(O)CO Amb32645150 [0,2,0,0,0,0|0,0,2]=4 9406 B9R0.46 CCCNCCN(C)OC Amb27756456 [0,2,0,0,0,0|1,0,1]=4 9407 B9R0.46 CCCNCC[C@H](O)CC Amb27770360 [0,2,0,0,0,0|0,0,2]=4 9408 B9R0.46 CCCNCC\C(N)=N/O Amb19981292 [0,2,0,0,0,0|1,0,1]=4 9409 B9R0.46 CCCNC\C=C(\C)CO Amb18644033 [0,2,0,0,0,0|0,0,2]=4 9410 B9R0.46 CCCOCCC(=O)CO Amb27616444 [0,2,0,0,0,0|0,0,0]=2 9411 B9R0.46 CCCOCCC(C)CBr Amb26369433 [0,2,0,0,0,0|1,0,1]=4 9412 B9R0.46 CCCOCCC(C)CCl Amb25921281 [0,2,0,0,0,0|1,0,1]=4 9413 B9R0.46 CCCOCCC(C)NC Amb28070797 [0,2,0,0,0,0|1,0,1]=4 9414 B9R0.46 CCCOCCC(C)NN Amb28288881 [0,2,0,0,0,0|1,0,1]=4 9415 B9R0.46 CCCOCCC(O)CN Amb27454686 [0,2,0,0,0,0|0,0,2]=4 9416 B9R0.46 CCCOCC\C(N)=N\N Amb27225679 [0,2,0,0,0,0|2,0,0]=4 9417 B9R0.46 CCCSCCC(N)CO Amb27839116 [0,2,0,0,0,0|1,0,1]=4 9418 B9R0.46 CCCS\C=C\C(=O)OC Amb27837838 [0,2,0,0,0,0|0,0,2]=4 9419 B9R0.46 CCC\C=C\CC(=O)CC Amb26948943 [0,2,0,0,0,0|0,0,1]=3 9420 B9R0.46 CCC\C=C\CC(=O)OC Amb27452086 [0,2,0,0,0,0|0,0,1]=3 9421 B9R0.46 CCC\C=N\NC(=O)OC Amb28126924 [0,2,0,0,0,0|1,0,1]=4 9422 B9R0.46 CCN(C)CCCCCCl Amb18788251 [0,2,0,0,0,0|2,0,0]=4 9423 B9R0.46 CCN(C)CCCCCF Amb27944768 [0,2,0,0,0,0|2,0,0]=4 9424 B9R0.46 CCN(C)CCCCCN Amb24700898 [0,2,0,0,0,0|2,0,0]=4 9425 B9R0.46 CCNCC#CC(=O)OC Amb33168825 [0,2,0,0,0,0|0,0,2]=4 9426 B9R0.46 CCNCCCC(=O)NC Amb24691212 [0,2,0,0,0,0|0,0,0]=2 9427 B9R0.46 CCNCCCC(=O)OC Amb22886193 [0,2,0,0,0,0|0,0,0]=2 9428 B9R0.46 CCNCCCC(=O)OC Amb8951853 [0,2,0,0,0,0|0,0,0]=2 9429 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|0,0,2]=4 9430 B9R0.46 CCNCCCC(O)CC Amb27618908 [0,2,0,0,0,0|0,0,2]=4 9431 B9R0.46 CCNCCCS(=O)CC Amb27838992 [0,2,0,0,0,0|1,0,0]=3 9432 B9R0.46 CCNCCNS(=O)CC Amb28195277 [0,2,0,0,0,0|2,0,0]=4 9433 B9R0.46 CCOCC#CC(=O)OC Amb27838920 [0,2,0,0,0,0|0,0,2]=4 9434 B9R0.46 CCOCCCC(=O)CC Amb9316826 [0,2,0,0,0,0|0,0,0]=2 9435 B9R0.46 CCOCCCC(=O)OC Amb8961279 [0,2,0,0,0,0|0,0,0]=2 9436 B9R0.46 CCOCCCC(C)CBr Amb26392239 [0,2,0,0,0,0|1,0,1]=4 9437 B9R0.46 CCOCCCC(C)CCl Amb26981336 [0,2,0,0,0,0|1,0,1]=4 9438 B9R0.46 CCOCCCC(C)CN Amb27838971 [0,2,0,0,0,0|1,0,1]=4 9439 B9R0.46 CCOCCCC(O)CO Amb27813119 [0,2,0,0,0,0|0,0,2]=4 9440 B9R0.46 CCOCCC[C@H](N)CO Amb27175345 [0,2,0,0,0,0|1,0,1]=4 9441 B9R0.46 CCOCCC\C(N)=N\O Amb6262054 [0,2,0,0,0,0|1,0,1]=4 9442 B9R0.46 CCOCCNC(=O)CBr Amb17325304 [0,2,0,0,0,0|1,0,0]=3 9443 B9R0.46 CCOCCNC(=O)CCl Amb9454593 [0,2,0,0,0,0|1,0,0]=3 9444 B9R0.46 CCOCCNC(=O)NN Amb9455041 [0,2,0,0,0,0|2,0,0]=4 9445 B9R0.46 CCOCCOC(=O)CCl Amb18602724 [0,2,0,0,0,0|1,0,0]=3 9446 B9R0.46 CCOCCOC(=O)CO Amb28139347 [0,2,0,0,0,0|1,0,0]=3 9447 B9R0.46 CCOCCOC(=O)NC Amb28050097 [0,2,0,0,0,0|1,0,0]=3 9448 B9R0.46 CCOCCOC(C)C=O Amb27599434 [0,2,0,0,0,0|1,0,1]=4 9449 B9R0.46 CCOCCSC(=S)OC Amb27973406 [0,2,0,0,0,0|1,1,0]=4 9450 B9R0.46 CCOCSCC(=O)NC Amb27261229 [0,2,0,0,0,0|1,0,0]=3 9451 B9R0.46 CCS(=O)CCCCC#N Amb28318160 [0,2,0,0,0,0|1,0,1]=4 9452 B9R0.46 CCS(=O)CCOCCN Amb27976568 [0,2,0,0,0,0|2,0,0]=4 9453 B9R0.46 CCS(=O)NCCCCN Amb28324239 [0,2,0,0,0,0|2,0,0]=4 9454 B9R0.46 CCSCCCC(Br)CC Amb27652366 [0,2,0,0,0,0|1,0,1]=4 9455 B9R0.46 CCSCCCC(C)CBr Amb24509145 [0,2,0,0,0,0|1,0,1]=4 9456 B9R0.46 CCSCCCC(C)CCl Amb26362369 [0,2,0,0,0,0|1,0,1]=4 9457 B9R0.46 CCSCCCC(C)CO Amb27967129 [0,2,0,0,0,0|0,0,2]=4 9458 B9R0.46 CCSCCCC(C)NC Amb27979610 [0,2,0,0,0,0|1,0,1]=4 9459 B9R0.46 CCSCCCC(Cl)CC Amb28044995 [0,2,0,0,0,0|1,0,1]=4 9460 B9R0.46 CCSCCCC(N)CO Amb27779485 [0,2,0,0,0,0|1,0,1]=4 9461 B9R0.46 CCSCCCC(O)CN Amb28401101 [0,2,0,0,0,0|0,0,2]=4 9462 B9R0.46 CCSCCNC(=N)NC Amb27397407 [0,2,0,0,0,0|2,0,0]=4 9463 B9R0.46 CCSCCNC(=O)CBr Amb17323884 [0,2,0,0,0,0|1,0,0]=3 9464 B9R0.46 CCSCCNC(=O)CCl Amb17331758 [0,2,0,0,0,0|1,0,0]=3 9465 B9R0.46 CCSCCNC(=O)CN Amb27457077 [0,2,0,0,0,0|1,0,0]=3 9466 B9R0.46 CCSCCNC(=O)CS Amb27945387 [0,2,0,0,0,0|1,0,0]=3 9467 B9R0.46 CCSCCNC(=O)NN Amb27770546 [0,2,0,0,0,0|2,0,0]=4 9468 B9R0.46 CCSCCNC(=S)NC Amb27752619 [0,2,0,0,0,0|1,1,0]=4 9469 B9R0.46 CCSCCOC(=O)CCl Amb27656954 [0,2,0,0,0,0|1,0,0]=3 9470 B9R0.46 CCSCCOC(=O)CO Amb28078370 [0,2,0,0,0,0|1,0,0]=3 9471 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|1,0,1]=4 9472 B9R0.46 CC[C@H](O)CCCCCF Amb27651955 [0,2,0,0,0,0|0,0,2]=4 9473 B9R0.46 CC\C(C)=C\CCCCBr Amb27253547 [0,2,0,0,0,0|1,0,1]=4 9474 B9R0.46 CC\C=C/CCC(=O)CC Amb27192561 [0,2,0,0,0,0|0,0,1]=3 9475 B9R0.46 CC\C=C/CCC(C)C=O Amb27797306 [0,2,0,0,0,0|0,0,2]=4 9476 B9R0.46 CC\C=C\CCC(=O)CC Amb28198289 [0,2,0,0,0,0|0,0,1]=3 9477 B9R0.46 CC\C=C\CCC(=O)NC Amb28133852 [0,2,0,0,0,0|0,0,1]=3 9478 B9R0.46 CC\C=C\CCC(=O)OC Amb25350136 [0,2,0,0,0,0|0,0,1]=3 9479 B9R0.46 CC\C=C\CNC(=O)CBr Amb27422866 [0,2,0,0,0,0|0,0,2]=4 9480 B9R0.46 CC\C=C\CNC(=O)CS Amb27874552 [0,2,0,0,0,0|0,0,2]=4 9481 B9R0.46 CC\C=C\COC(=O)CC Amb27150578 [0,2,0,0,0,0|0,0,2]=4 9482 B9R0.46 CC\C=C\COC(=O)CO Amb27479358 [0,2,0,0,0,0|0,0,2]=4 9483 B9R0.46 CNC(=N)SCCCCO Amb27812506 [0,2,0,0,0,0|2,0,0]=4 9484 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [0,2,0,0,0,0|0,0,1]=3 9485 B9R0.46 CNC(=O)CCCCCCl Amb27473380 [0,2,0,0,0,0|0,0,0]=2 9486 B9R0.46 CNC(=O)CCCCCO Amb27592471 [0,2,0,0,0,0|0,0,0]=2 9487 B9R0.46 CNC(=O)CCCN=[N+]=[N-] Amb28184460 [0,2,0,0,0,0|2,0,0]=4 9488 B9R0.46 CNC(=O)CCCNC#N Amb27447520 [0,2,0,0,0,0|1,0,1]=4 9489 B9R0.46 CNC(=O)CCCNC=O Amb27959411 [0,2,0,0,0,0|1,0,1]=4 9490 B9R0.46 CNC(=O)CCCNOC Amb27838996 [0,2,0,0,0,0|1,0,0]=3 9491 B9R0.46 CNC(=O)CCOCCN Amb28249892 [0,2,0,0,0,0|1,0,0]=3 9492 B9R0.46 CNC(=O)CCSCC#N Amb27221143 [0,2,0,0,0,0|1,0,1]=4 9493 B9R0.46 CNC(=O)CCSCCBr Amb27430701 [0,2,0,0,0,0|1,0,0]=3 9494 B9R0.46 CNC(=O)CCSCCS Amb27787141 [0,2,0,0,0,0|1,0,0]=3 9495 B9R0.46 CNC(=O)CNCCCF Amb27654911 [0,2,0,0,0,0|1,0,0]=3 9496 B9R0.46 CNC(=O)CNCCSC Amb27843263 [0,2,0,0,0,0|1,0,0]=3 9497 B9R0.46 CNC(=O)CSCCC=O Amb27602014 [0,2,0,0,0,0|1,0,1]=4 9498 B9R0.46 CNC(=O)CSCCCCl Amb27981112 [0,2,0,0,0,0|1,0,0]=3 9499 B9R0.46 CNC(=O)CSCCCF Amb27426687 [0,2,0,0,0,0|1,0,0]=3 9500 B9R0.46 CNC(=O)CSCCCN Amb17500712 [0,2,0,0,0,0|1,0,0]=3 9501 B9R0.46 CNC(=O)NCCCOC Amb2132785 [0,2,0,0,0,0|1,0,0]=3 9502 B9R0.46 CNC(=O)OCCCCCl Amb28073988 [0,2,0,0,0,0|1,0,0]=3 9503 B9R0.46 CNC(=O)OCCCON Amb28132676 [0,2,0,0,0,0|2,0,0]=4 9504 B9R0.46 CNCCCCC(=O)OC Amb25725637 [0,2,0,0,0,0|0,0,0]=2 9505 B9R0.46 CNCCCCC(=O)OC Amb32676714 [0,2,0,0,0,0|0,0,0]=2 9506 B9R0.46 CNCCCCN(C)C=O Amb27813564 [0,2,0,0,0,0|1,0,0]=3 9507 B9R0.46 CNCCCC\C(N)=N\O Amb27442257 [0,2,0,0,0,0|1,0,1]=4 9508 B9R0.46 CNCCCNC(=O)CCl Amb27953669 [0,2,0,0,0,0|1,0,0]=3 9509 B9R0.46 CNCCOCC(=O)NC Amb19374954 [0,2,0,0,0,0|1,0,0]=3 9510 B9R0.46 CNCCOCC(=O)NC Amb27814093 [0,2,0,0,0,0|1,0,0]=3 9511 B9R0.46 CNCCOCC(=O)OC Amb27481250 [0,2,0,0,0,0|1,0,0]=3 9512 B9R0.46 CNCCSCC(=O)NC Amb28126889 [0,2,0,0,0,0|1,0,0]=3 9513 B9R0.46 CNCCSCC(=O)OC Amb18798231 [0,2,0,0,0,0|1,0,0]=3 9514 B9R0.46 COC(=O)C#CCCCCl Amb27757420 [0,2,0,0,0,0|0,0,2]=4 9515 B9R0.46 COC(=O)C#CCCCN Amb33168790 [0,2,0,0,0,0|0,0,2]=4 9516 B9R0.46 COC(=O)C#CCCCO Amb22230916 [0,2,0,0,0,0|0,0,2]=4 9517 B9R0.46 COC(=O)CCCCC=O Amb16233585 [0,2,0,0,0,0|0,0,1]=3 9518 B9R0.46 COC(=O)CCCCCBr Amb4017062 [0,2,0,0,0,0|0,0,0]=2 9519 B9R0.46 COC(=O)CCCCCCl Amb25703167 [0,2,0,0,0,0|0,0,0]=2 9520 B9R0.46 COC(=O)CCCCCN Amb1152885 [0,2,0,0,0,0|0,0,0]=2 9521 B9R0.46 COC(=O)CCCCCN Amb1935045 [0,2,0,0,0,0|0,0,0]=2 9522 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|0,0,0]=2 9523 B9R0.46 COC(=O)CCCCCS Amb25934957 [0,2,0,0,0,0|0,0,0]=2 9524 B9R0.46 COC(=O)CCCN=C=O Amb2688917 [0,2,0,0,0,0|1,0,1]=4 9525 B9R0.46 COC(=O)CCCN=C=S Amb2371146 [0,2,0,0,0,0|1,0,1]=4 9526 B9R0.46 COC(=O)CCCN=[N+]=[N-] Amb22586627 [0,2,0,0,0,0|2,0,0]=4 9527 B9R0.46 COC(=O)CCCNC=O Amb27615072 [0,2,0,0,0,0|1,0,1]=4 9528 B9R0.46 COC(=O)CCCSC#N Amb22230905 [0,2,0,0,0,0|1,0,1]=4 9529 B9R0.46 COC(=O)CCCSSC Amb32992714 [0,2,0,0,0,0|1,0,0]=3 9530 B9R0.46 COC(=O)CCC\C=C/Cl Amb28076519 [0,2,0,0,0,0|0,0,2]=4 9531 B9R0.46 COC(=O)CCNCC#N Amb27837578 [0,2,0,0,0,0|1,0,1]=4 9532 B9R0.46 COC(=O)CCNCCO Amb9243303 [0,2,0,0,0,0|1,0,0]=3 9533 B9R0.46 COC(=O)CCOCCN Amb26516683 [0,2,0,0,0,0|1,0,0]=3 9534 B9R0.46 COC(=O)CCOCCN Amb33330774 [0,2,0,0,0,0|1,0,0]=3 9535 B9R0.46 COC(=O)CCOCCO Amb33986072 [0,2,0,0,0,0|1,0,0]=3 9536 B9R0.46 COC(=O)CCSCCBr Amb26983185 [0,2,0,0,0,0|1,0,0]=3 9537 B9R0.46 COC(=O)CCSCCN Amb20623046 [0,2,0,0,0,0|1,0,0]=3 9538 B9R0.46 COC(=O)CCSCCN Amb20668423 [0,2,0,0,0,0|1,0,0]=3 9539 B9R0.46 COC(=O)CCSCCN Amb9482009 [0,2,0,0,0,0|1,0,0]=3 9540 B9R0.46 COC(=O)CNCCC#N Amb8390100 [0,2,0,0,0,0|1,0,1]=4 9541 B9R0.46 COC(=O)CNCCCO Amb9247002 [0,2,0,0,0,0|1,0,0]=3 9542 B9R0.46 COC(=O)CNCCSC Amb27244506 [0,2,0,0,0,0|1,0,0]=3 9543 B9R0.46 COC(=O)COCCCN Amb27597156 [0,2,0,0,0,0|1,0,0]=3 9544 B9R0.46 COC(=O)COCCSC Amb28256796 [0,2,0,0,0,0|1,0,0]=3 9545 B9R0.46 COC(=O)CSCCC#N Amb2724560 [0,2,0,0,0,0|1,0,1]=4 9546 B9R0.46 COC(=O)CSCCCCl Amb22524768 [0,2,0,0,0,0|1,0,0]=3 9547 B9R0.46 COC(=O)CSSCCO Amb26922212 [0,2,0,0,0,0|2,0,0]=4 9548 B9R0.46 COC(=O)C\C=C\CCO Amb28292442 [0,2,0,0,0,0|0,0,2]=4 9549 B9R0.46 COC(=O)NCCCCBr Amb27817636 [0,2,0,0,0,0|1,0,0]=3 9550 B9R0.46 COC(=O)NCCCCN Amb27259183 [0,2,0,0,0,0|1,0,0]=3 9551 B9R0.46 COC(=O)NCCCCO Amb27251899 [0,2,0,0,0,0|1,0,0]=3 9552 B9R0.46 COC(=O)NCCCSC Amb28050553 [0,2,0,0,0,0|1,0,0]=3 9553 B9R0.46 COC(=O)SSCCCO Amb28065222 [0,2,0,0,0,0|2,0,0]=4 9554 B9R0.46 COC(=O)\C=C\CCSC Amb27855319 [0,2,0,0,0,0|0,0,2]=4 9555 B9R0.46 COC(=S)SCCCSC Amb28049724 [0,2,0,0,0,0|1,1,0]=4 9556 B9R0.46 COCCCCC(=O)CO Amb28254576 [0,2,0,0,0,0|0,0,0]=2 9557 B9R0.46 COCCCCC(C)CBr Amb27254567 [0,2,0,0,0,0|1,0,1]=4 9558 B9R0.46 COCCCCC(C)CCl Amb28248640 [0,2,0,0,0,0|1,0,1]=4 9559 B9R0.46 COCCCCC(O)CCl Amb27478160 [0,2,0,0,0,0|0,0,2]=4 9560 B9R0.46 COCCCCN(C)C#N Amb27256057 [0,2,0,0,0,0|2,0,0]=4 9561 B9R0.46 COCCCCN(C)C=O Amb27459150 [0,2,0,0,0,0|1,0,0]=3 9562 B9R0.46 COCCCCN(C)OC Amb28315967 [0,2,0,0,0,0|1,0,1]=4 9563 B9R0.46 COCCCNC(=O)CBr Amb17323752 [0,2,0,0,0,0|1,0,0]=3 9564 B9R0.46 COCCCNC(=O)CCl Amb1150989 [0,2,0,0,0,0|1,0,0]=3 9565 B9R0.46 COCCCNC(=O)CI Amb27839141 [0,2,0,0,0,0|1,0,0]=3 9566 B9R0.46 COCCCNC(=O)CN Amb5783035 [0,2,0,0,0,0|1,0,0]=3 9567 B9R0.46 COCCCNC(=O)CO Amb9421653 [0,2,0,0,0,0|1,0,0]=3 9568 B9R0.46 COCCCNC(=O)CS Amb27203369 [0,2,0,0,0,0|1,0,0]=3 9569 B9R0.46 COCCCNC(=O)NN Amb33552025 [0,2,0,0,0,0|2,0,0]=4 9570 B9R0.46 COCCCNC(=S)SC Amb27823572 [0,2,0,0,0,0|1,1,0]=4 9571 B9R0.46 COCCCOC(=O)CN Amb27848859 [0,2,0,0,0,0|1,0,0]=3 9572 B9R0.46 COCCCOC(=O)CO Amb27207808 [0,2,0,0,0,0|1,0,0]=3 9573 B9R0.46 COCCCOC(=O)CS Amb27648593 [0,2,0,0,0,0|1,0,0]=3 9574 B9R0.46 COCCC\C=C(/C)C=O Amb28320361 [0,2,0,0,0,0|0,0,1]=3 9575 B9R0.46 COCCNCC(=O)OC Amb6707178 [0,2,0,0,0,0|1,0,0]=3 9576 B9R0.46 COCCNC\C(C)=C\Cl Amb27170943 [0,2,0,0,0,0|2,0,0]=4 9577 B9R0.46 COCCOCC(=O)NN Amb30666693 [0,2,0,0,0,0|2,0,0]=4 9578 B9R0.46 COCCOCC(=O)NN Amb8998710 [0,2,0,0,0,0|2,0,0]=4 9579 B9R0.46 COCCOCC(=O)OC Amb9206379 [0,2,0,0,0,0|1,0,0]=3 9580 B9R0.46 COCCOC\C(C)=N\N Amb27834697 [0,2,0,0,0,0|2,0,0]=4 9581 B9R0.46 COCCSCC(=O)NN Amb8999118 [0,2,0,0,0,0|2,0,0]=4 9582 B9R0.46 COCCSCC(=O)OC Amb9238654 [0,2,0,0,0,0|1,0,0]=3 9583 B9R0.46 CONCCCC(=O)OC Amb27250548 [0,2,0,0,0,0|1,0,0]=3 9584 B9R0.46 CSC(=O)NCCCCO Amb27614137 [0,2,0,0,0,0|1,0,0]=3 9585 B9R0.46 CSC(=S)NCCCCN Amb27816566 [0,2,0,0,0,0|1,1,0]=4 9586 B9R0.46 CSCCCCC(=O)NN Amb28366127 [0,2,0,0,0,0|1,0,0]=3 9587 B9R0.46 CSCCCCC(C)CBr Amb27833849 [0,2,0,0,0,0|1,0,1]=4 9588 B9R0.46 CSCCCCC(C)CN Amb27857677 [0,2,0,0,0,0|1,0,1]=4 9589 B9R0.46 CSCCCNC(=O)CBr Amb28323524 [0,2,0,0,0,0|1,0,0]=3 9590 B9R0.46 CSCCCNC(=O)CCl Amb27843262 [0,2,0,0,0,0|1,0,0]=3 9591 B9R0.46 CSCCCOC(=O)CO Amb28285323 [0,2,0,0,0,0|1,0,0]=3 9592 B9R0.46 CSCCNC\C(C)=C\Cl Amb28256005 [0,2,0,0,0,0|2,0,0]=4 9593 B9R0.46 CSCCSCC(=O)NN Amb27402153 [0,2,0,0,0,0|2,0,0]=4 9594 B9R0.46 C\C(=C/CCCCCl)CCl Amb28247217 [0,2,0,0,0,0|1,0,1]=4 9595 B9R0.46 C\C(=C/Cl)CSCCCCl Amb27664325 [0,2,0,0,0,0|2,0,0]=4 9596 B9R0.46 C\C(CSCCCF)=N/O Amb27424924 [0,2,0,0,0,0|1,0,1]=4 9597 B9R0.46 C\C=C(/Br)CNCCCC Amb27236836 [0,2,0,0,0,0|1,0,0]=3 9598 B9R0.46 C\C=C(/C)CNCCOC Amb27486771 [0,2,0,0,0,0|2,0,0]=4 9599 B9R0.46 C\C=C\CCCC(=O)CC Amb26388423 [0,2,0,0,0,0|0,0,1]=3 9600 B9R0.46 C\C=C\CCCC(C)C=O Amb18643631 [0,2,0,0,0,0|0,0,2]=4 9601 B9R0.46 C\C=C\CCNC(=O)CS Amb28350571 [0,2,0,0,0,0|0,0,2]=4 9602 B9R0.46 C\C=C\CNCC(=O)OC Amb27263471 [0,2,0,0,0,0|0,0,2]=4 9603 B9R0.46 N#CCCCCC(=O)CCl Amb25960754 [0,2,0,0,0,0|0,0,1]=3 9604 B9R0.46 N#CCCCNC(=O)CO Amb27756100 [0,2,0,0,0,0|1,0,1]=4 9605 B9R0.46 N#CCCSCC(=O)CCl Amb27233005 [0,2,0,0,0,0|1,0,1]=4 9606 B9R0.46 NCC(=O)OCCCCO Amb27657505 [0,2,0,0,0,0|1,0,0]=3 9607 B9R0.46 NCCCCCC(=O)NO Amb32432421 [0,2,0,0,0,0|1,0,0]=3 9608 B9R0.46 NCCCCCC(N)CN Amb27210080 [0,2,0,0,0,0|1,0,1]=4 9609 B9R0.46 NCCCCC\C(N)=N\O Amb28199763 [0,2,0,0,0,0|1,0,1]=4 9610 B9R0.46 NCCCCNC(=O)CBr Amb26357219 [0,2,0,0,0,0|1,0,0]=3 9611 B9R0.46 NCCCCNC(=O)CBr Amb32670653 [0,2,0,0,0,0|1,0,0]=3 9612 B9R0.46 NCCCCNC(=O)CCl Amb18177807 [0,2,0,0,0,0|1,0,0]=3 9613 B9R0.46 NCCCCNC(=O)CCl Amb32681202 [0,2,0,0,0,0|1,0,0]=3 9614 B9R0.46 NCCCSCC(=O)NN Amb27408147 [0,2,0,0,0,0|2,0,0]=4 9615 B9R0.46 NCCOCCC(=O)NN Amb27164396 [0,2,0,0,0,0|2,0,0]=4 9616 B9R0.46 NCCOCCC(=O)NO Amb27970345 [0,2,0,0,0,0|2,0,0]=4 9617 B9R0.46 NC[C@H](O)CCCCCBr Amb27640190 [0,2,0,0,0,0|0,0,2]=4 9618 B9R0.46 NNC(=O)CCCCCO Amb6371427 [0,2,0,0,0,0|1,0,0]=3 9619 B9R0.46 NNC(=O)CCNCCS Amb28323608 [0,2,0,0,0,0|2,0,0]=4 9620 B9R0.46 NNC(=O)NCCCCF Amb27398770 [0,2,0,0,0,0|2,0,0]=4 9621 B9R0.46 NNC(=O)SCCCCS Amb28343270 [0,2,0,0,0,0|2,0,0]=4 9622 B9R0.46 N\C(CCCCCF)=N/O Amb27834441 [0,2,0,0,0,0|1,0,1]=4 9623 B9R0.46 O=C(CBr)NCCCCO Amb27839557 [0,2,0,0,0,0|1,0,0]=3 9624 B9R0.46 O=C(CBr)OCCCCBr Amb24598197 [0,2,0,0,0,0|1,0,0]=3 9625 B9R0.46 O=C(CBr)OCCCCO Amb28208349 [0,2,0,0,0,0|1,0,0]=3 9626 B9R0.46 O=C(CCl)CCCCCO Amb27799874 [0,2,0,0,0,0|0,0,0]=2 9627 B9R0.46 O=C(CF)CCCCCF Amb27869046 [0,2,0,0,0,0|0,0,0]=2 9628 B9R0.46 O=CCCCOC(=O)CBr Amb27841814 [0,2,0,0,0,0|1,0,1]=4 9629 B9R0.46 O=CCCCOC(=O)CCl Amb28072931 [0,2,0,0,0,0|1,0,1]=4 9630 B9R0.46 O=NC(=O)CCNCCO Amb27393447 [0,2,0,0,0,0|2,0,0]=4 9631 B9R0.46 OCC(O)CCCCCBr Amb27252942 [0,2,0,0,0,0|0,0,2]=4 9632 B9R0.46 OCCCCCC(Cl)CCl Amb28244982 [0,2,0,0,0,0|1,0,1]=4 9633 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|0,0,2]=4 9634 B9R0.46 [C-]#[N+]C(C)CCCCCC Amb2688921 [0,2,0,0,0,0|1,0,1]=4 9635 B9R0.46 [C-]#[N+]CCCCC(=O)OC Amb2688987 [0,2,0,0,0,0|0,0,1]=3 9636 B9R0.47 C#CCCCC(C)C(C)=O Amb25965398 [0,2,0,0,0,0|0,0,1]=3 9637 B9R0.47 C#CCCCC(N)C(=O)O Amb27947457 [0,2,0,0,0,0|1,0,1]=4 9638 B9R0.47 C#CCCCC(N)C(=O)O Amb33483976 [0,2,0,0,0,0|1,0,1]=4 9639 B9R0.47 C#CCCCC(N)C(N)=O Amb26967363 [0,2,0,0,0,0|1,0,1]=4 9640 B9R0.47 C#CCCC[C@@H](N)C(=O)O Amb24077358 [0,2,0,0,0,0|1,0,1]=4 9641 B9R0.47 C#CCCC[C@H](N)C(=O)O Amb24088878 [0,2,0,0,0,0|1,0,1]=4 9642 B9R0.47 C#CCOCC(Br)C(C)=O Amb28050003 [0,2,0,0,0,0|0,0,2]=4 9643 B9R0.47 C=C(C)C(=O)CCCCF Amb27752631 [0,2,0,0,0,0|1,0,0]=3 9644 B9R0.47 C=C(C)C(=O)CCCNC Amb28050438 [0,2,0,0,0,0|1,0,0]=3 9645 B9R0.47 C=C(C)C(=O)CCCOC Amb28134573 [0,2,0,0,0,0|1,0,0]=3 9646 B9R0.47 C=C(C)C(=O)CCOCC Amb27950854 [0,2,0,0,0,0|1,0,0]=3 9647 B9R0.47 C=C(C)C(=O)COCCN Amb27253794 [0,2,0,0,0,0|2,0,0]=4 9648 B9R0.47 C=C(C)C(=O)CSCCC Amb28424133 [0,2,0,0,0,0|1,0,0]=3 9649 B9R0.47 C=C(C)C(=O)NCCCC Amb17933970 [0,2,0,0,0,0|1,0,0]=3 9650 B9R0.47 C=C(C)C(=O)NCCCCl Amb27219533 [0,2,0,0,0,0|2,0,0]=4 9651 B9R0.47 C=C(C)C(=O)NCCCN Amb17933170 [0,2,0,0,0,0|2,0,0]=4 9652 B9R0.47 C=C(C)C(=O)NCCCN Amb22284541 [0,2,0,0,0,0|2,0,0]=4 9653 B9R0.47 C=C(C)C(=O)OCCCBr Amb28241063 [0,2,0,0,0,0|2,0,0]=4 9654 B9R0.47 C=C(C)C(=O)OCCCC Amb8395007 [0,2,0,0,0,0|1,0,0]=3 9655 B9R0.47 C=C(C)C(=O)OCCCO Amb22338752 [0,2,0,0,0,0|2,0,0]=4 9656 B9R0.47 C=C(C)C(=O)OCCNC Amb27874112 [0,2,0,0,0,0|2,0,0]=4 9657 B9R0.47 C=C(C)C(=O)OCCOC Amb22228871 [0,2,0,0,0,0|2,0,0]=4 9658 B9R0.47 C=C(C)C(=O)OCCSC Amb22228171 [0,2,0,0,0,0|2,0,0]=4 9659 B9R0.47 C=C(C)C(=O)\C=C\CCC Amb26627157 [0,2,0,0,0,0|0,0,2]=4 9660 B9R0.47 C=C(C)C(C)OCCCC Amb27595789 [0,2,0,0,0,0|1,0,0]=3 9661 B9R0.47 C=C(C)C(N)CCCOC Amb28455830 [0,2,0,0,0,0|1,0,0]=3 9662 B9R0.47 C=C(C)C(O)CC#CCC Amb27839251 [0,2,0,0,0,0|1,0,1]=4 9663 B9R0.47 C=C(C)C(O)CCCCO Amb27765710 [0,2,0,0,0,0|1,0,0]=3 9664 B9R0.47 C=C(C)C(O)CCCSC Amb27978956 [0,2,0,0,0,0|1,0,0]=3 9665 B9R0.47 C=C(C)C(O)CC\C=C\C Amb27839343 [0,2,0,0,0,0|1,0,1]=4 9666 B9R0.47 C=C(C)[C@@H](O)CCCCC Amb28065257 [0,2,0,0,0,0|1,0,0]=3 9667 B9R0.47 C=C(CCCCC)[C@H](C)O Amb27406775 [0,2,0,0,0,0|1,0,0]=3 9668 B9R0.47 C=C(CCCNC)C(=O)O Amb28050053 [0,2,0,0,0,0|1,0,1]=4 9669 B9R0.47 C=C(Cl)C(C)CCCCO Amb27260219 [0,2,0,0,0,0|1,0,1]=4 9670 B9R0.47 C=C(F)C(=O)OCCCC Amb27453582 [0,2,0,0,0,0|1,0,1]=4 9671 B9R0.47 C=CCCCC(=O)N(C)C Amb28064613 [0,2,0,0,0,0|0,0,2]=4 9672 B9R0.47 C=CCCCC(C)C(C)=O Amb27839019 [0,2,0,0,0,0|0,0,1]=3 9673 B9R0.47 C=CCCCC(Cl)C(=C)C Amb27478034 [0,2,0,0,0,0|1,0,1]=4 9674 B9R0.47 C=CCCCC(N)C(=O)O Amb22002149 [0,2,0,0,0,0|1,0,1]=4 9675 B9R0.47 C=CCCCC(N)C(=O)O Amb32752542 [0,2,0,0,0,0|1,0,1]=4 9676 B9R0.47 C=CCCCC(N)C(N)=O Amb25988690 [0,2,0,0,0,0|1,0,1]=4 9677 B9R0.47 C=CCCCN(C)C(C)=O Amb24627578 [0,2,0,0,0,0|0,0,2]=4 9678 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb22831130 [0,2,0,0,0,0|1,0,1]=4 9679 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb32687472 [0,2,0,0,0,0|1,0,1]=4 9680 B9R0.47 C=CCCC[C@@H](O)C(C)=O Amb27453672 [0,2,0,0,0,0|0,0,1]=3 9681 B9R0.47 C=CCCC[C@H](N)C(=O)O Amb2699129 [0,2,0,0,0,0|1,0,1]=4 9682 B9R0.47 C=CCCOC(C)C(C)=O Amb27979070 [0,2,0,0,0,0|0,0,2]=4 9683 B9R0.47 CC#CCCC(=O)C(F)F Amb27639182 [0,2,0,0,0,0|0,0,2]=4 9684 B9R0.47 CC#CCCC(=O)[C@@H](C)N Amb30024134 [0,2,0,0,0,0|0,0,2]=4 9685 B9R0.47 CC#CCCC(=O)[C@H](C)N Amb35624369 [0,2,0,0,0,0|0,0,2]=4 9686 B9R0.47 CC#CCCC(C)C(=O)O Amb27412753 [0,2,0,0,0,0|1,0,1]=4 9687 B9R0.47 CC#CCCC(N)C(=O)O Amb28285646 [0,2,0,0,0,0|1,0,1]=4 9688 B9R0.47 CC#CCCC(N)C(N)=O Amb26893252 [0,2,0,0,0,0|1,0,1]=4 9689 B9R0.47 CC#CCCC(O)C(=O)O Amb27615159 [0,2,0,0,0,0|1,0,1]=4 9690 B9R0.47 CC#CCC[C@@H](N)C(=O)O Amb25835847 [0,2,0,0,0,0|1,0,1]=4 9691 B9R0.47 CC#CCC[C@H](N)C(=O)O Amb28368944 [0,2,0,0,0,0|1,0,1]=4 9692 B9R0.47 CC#CCOC(C)C(C)=O Amb27437779 [0,2,0,0,0,0|0,0,2]=4 9693 B9R0.47 CC#CCSC(C)C(C)=O Amb28348863 [0,2,0,0,0,0|0,0,2]=4 9694 B9R0.47 CC(=O)C(=O)NCCCO Amb27589399 [0,2,0,0,0,0|1,0,1]=4 9695 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,2,0,0,0,0|0,0,0]=2 9696 B9R0.47 CC(=O)C(C)OCCCN Amb18111504 [0,2,0,0,0,0|1,0,0]=3 9697 B9R0.47 CC(=O)C(C)SCCC#N Amb18927758 [0,2,0,0,0,0|1,0,1]=4 9698 B9R0.47 CC(=O)C(C)SCCCF Amb27424937 [0,2,0,0,0,0|1,0,0]=3 9699 B9R0.47 CC(=O)C(C)SCCCS Amb28200050 [0,2,0,0,0,0|1,0,0]=3 9700 B9R0.47 CC(=O)N(C)CCCCBr Amb27860570 [0,2,0,0,0,0|1,0,0]=3 9701 B9R0.47 CC(Br)C(=O)NCCCO Amb17333283 [0,2,0,0,0,0|2,0,0]=4 9702 B9R0.47 CC(C)=C(C)CCCCBr Amb32690232 [0,2,0,0,0,0|1,0,1]=4 9703 B9R0.47 CC(C)=C(C)CCCCCl Amb32690231 [0,2,0,0,0,0|1,0,1]=4 9704 B9R0.47 CC(C)=C(C)CCCCO Amb26895794 [0,2,0,0,0,0|1,0,1]=4 9705 B9R0.47 CC(C)C(=O)CCCC=O Amb18643953 [0,2,0,0,0,0|1,0,1]=4 9706 B9R0.47 CC(C)C(=O)CCCCF Amb27833045 [0,2,0,0,0,0|1,0,0]=3 9707 B9R0.47 CC(C)C(=O)COCCN Amb27859717 [0,2,0,0,0,0|2,0,0]=4 9708 B9R0.47 CC(C)C(=O)NCCCCl Amb3886658 [0,2,0,0,0,0|2,0,0]=4 9709 B9R0.47 CC(C)C(=O)NCCCN Amb32686908 [0,2,0,0,0,0|2,0,0]=4 9710 B9R0.47 CC(C)C(=O)NCCCN Amb6275650 [0,2,0,0,0,0|2,0,0]=4 9711 B9R0.47 CC(C)C(=O)NCCCO Amb5797625 [0,2,0,0,0,0|2,0,0]=4 9712 B9R0.47 CC(C)C(=O)OCCCO Amb24396987 [0,2,0,0,0,0|2,0,0]=4 9713 B9R0.47 CC(C)C(N)CCCCF Amb27218723 [0,2,0,0,0,0|1,0,1]=4 9714 B9R0.47 CC(C)C(O)CCCCF Amb27425079 [0,2,0,0,0,0|1,0,1]=4 9715 B9R0.47 CC(C)S(=O)CCCCCl Amb27454352 [0,2,0,0,0,0|2,0,0]=4 9716 B9R0.47 CC(C)S(=O)CCCCN Amb27168285 [0,2,0,0,0,0|2,0,0]=4 9717 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [0,2,0,0,0,0|1,0,0]=3 9718 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [0,2,0,0,0,0|1,0,0]=3 9719 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [0,2,0,0,0,0|1,0,0]=3 9720 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [0,2,0,0,0,0|1,0,0]=3 9721 B9R0.47 CC(CCCCO)N(C)C Amb27959595 [0,2,0,0,0,0|2,0,0]=4 9722 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [0,2,0,0,0,0|2,0,0]=4 9723 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [0,2,0,0,0,0|2,0,0]=4 9724 B9R0.47 CC(CNCCN)S(C)=O Amb27458530 [0,2,0,0,0,0|2,0,0]=4 9725 B9R0.47 CC(CNCCO)C(N)=O Amb9358396 [0,2,0,0,0,0|2,0,0]=4 9726 B9R0.47 CC(CNCCO)S(C)=O Amb27245628 [0,2,0,0,0,0|2,0,0]=4 9727 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [0,2,0,0,0,0|2,0,0]=4 9728 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [0,2,0,0,0,0|2,0,0]=4 9729 B9R0.47 CC(Cl)C(=O)NCCCO Amb17600137 [0,2,0,0,0,0|2,0,0]=4 9730 B9R0.47 CC(N)C(=O)NCCCS Amb24741609 [0,2,0,0,0,0|2,0,0]=4 9731 B9R0.47 CC(NCCCF)C(N)=O Amb28136243 [0,2,0,0,0,0|2,0,0]=4 9732 B9R0.47 CC(NCCCO)C(N)=O Amb9246629 [0,2,0,0,0,0|2,0,0]=4 9733 B9R0.47 CC(O)C(=O)CCCCF Amb27457078 [0,2,0,0,0,0|1,0,0]=3 9734 B9R0.47 CC(O)C(=O)OCCCCl Amb26979833 [0,2,0,0,0,0|2,0,0]=4 9735 B9R0.47 CC(O)C(=O)OCCCI Amb28062159 [0,2,0,0,0,0|2,0,0]=4 9736 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,2,0,0,0,0|2,0,0]=4 9737 B9R0.47 CC(S)C(=O)NCCCN Amb27772358 [0,2,0,0,0,0|2,0,0]=4 9738 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [0,2,0,0,0,0|2,0,0]=4 9739 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [0,2,0,0,0,0|2,0,0]=4 9740 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [0,2,0,0,0,0|2,0,0]=4 9741 B9R0.47 CCC#CCC(=O)C(O)O Amb28201129 [0,2,0,0,0,0|0,0,2]=4 9742 B9R0.47 CCCC#CC(=O)C(C)C Amb28321931 [0,2,0,0,0,0|0,0,2]=4 9743 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [0,2,0,0,0,0|0,0,1]=3 9744 B9R0.47 CCCCCC(=O)C(=O)O Amb18644122 [0,2,0,0,0,0|0,0,1]=3 9745 B9R0.47 CCCCCC(=O)C(C)C Amb9024776 [0,2,0,0,0,0|0,0,0]=2 9746 B9R0.47 CCCCCC(=O)C(C)Cl Amb27214156 [0,2,0,0,0,0|0,0,0]=2 9747 B9R0.47 CCCCCC(=O)C(C)F Amb27802661 [0,2,0,0,0,0|0,0,0]=2 9748 B9R0.47 CCCCCC(=O)C(Cl)Cl Amb27865495 [0,2,0,0,0,0|0,0,0]=2 9749 B9R0.47 CCCCCC(=O)C(F)F Amb26985245 [0,2,0,0,0,0|0,0,0]=2 9750 B9R0.47 CCCCCC(=O)N(C)C Amb2720943 [0,2,0,0,0,0|0,0,0]=2 9751 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [0,2,0,0,0,0|1,0,0]=3 9752 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [0,2,0,0,0,0|0,0,0]=2 9753 B9R0.47 CCCCCC(Br)C(C)C Amb27877198 [0,2,0,0,0,0|1,0,1]=4 9754 B9R0.47 CCCCCC(Br)C(C)F Amb27947488 [0,2,0,0,0,0|1,0,1]=4 9755 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,2,0,0,0,0|0,0,2]=4 9756 B9R0.47 CCCCCC(C)=C(C)C Amb22228299 [0,2,0,0,0,0|1,0,0]=3 9757 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,2,0,0,0,0|0,0,1]=3 9758 B9R0.47 CCCCCC(C)C(C)C Amb10069375 [0,2,0,0,0,0|1,0,1]=4 9759 B9R0.47 CCCCCC(C)C(C)N Amb27155602 [0,2,0,0,0,0|1,0,1]=4 9760 B9R0.47 CCCCCC(C)[C@@H](C)N Amb33738432 [0,2,0,0,0,0|1,0,1]=4 9761 B9R0.47 CCCCCC(C)[C@H](C)N Amb33745259 [0,2,0,0,0,0|1,0,1]=4 9762 B9R0.47 CCCCCC(C)[N+](=O)[O-] Amb25059956 [0,2,0,0,0,0|0,0,1]=3 9763 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [0,2,0,0,0,0|1,0,0]=3 9764 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [0,2,0,0,0,0|1,0,0]=3 9765 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,2,0,0,0,0|0,0,2]=4 9766 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [0,2,0,0,0,0|1,0,0]=3 9767 B9R0.47 CCCCCC(N)C(F)F Amb28135618 [0,2,0,0,0,0|1,0,1]=4 9768 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,2,0,0,0,0|1,0,0]=3 9769 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [0,2,0,0,0,0|1,0,1]=4 9770 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [0,2,0,0,0,0|1,0,0]=3 9771 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [0,2,0,0,0,0|0,0,0]=2 9772 B9R0.47 CCCCCC(O)C(C)C Amb4036433 [0,2,0,0,0,0|0,0,2]=4 9773 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,2,0,0,0,0|0,0,2]=4 9774 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [0,2,0,0,0,0|1,0,0]=3 9775 B9R0.47 CCCCCN(C)C(=N)N Amb8925796 [0,2,0,0,0,0|2,0,0]=4 9776 B9R0.47 CCCCCN(C)C(N)=S Amb8925607 [0,2,0,0,0,0|1,1,0]=4 9777 B9R0.47 CCCCCN(N)C(=N)N Amb29471652 [0,2,0,0,0,0|2,0,0]=4 9778 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [0,2,0,0,0,0|1,0,0]=3 9779 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [0,2,0,0,0,0|0,0,0]=2 9780 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [0,2,0,0,0,0|1,0,0]=3 9781 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [0,2,0,0,0,0|1,0,0]=3 9782 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,2,0,0,0,0|0,0,0]=2 9783 B9R0.47 CCCCC[C@@H](O)[C@H](C)Br Amb28049949 [0,2,0,0,0,0|0,0,2]=4 9784 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [0,2,0,0,0,0|1,0,0]=3 9785 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,2,0,0,0,0|0,0,2]=4 9786 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,2,0,0,0,0|0,0,1]=3 9787 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [0,2,0,0,0,0|1,0,0]=3 9788 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [0,2,0,0,0,0|1,0,0]=3 9789 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,2,0,0,0,0|0,0,2]=4 9790 B9R0.47 CCCCC[C@H](O)C(C)C Amb28064175 [0,2,0,0,0,0|0,0,2]=4 9791 B9R0.47 CCCCC[C@H](O)[C@@H](C)N Amb27488726 [0,2,0,0,0,0|0,0,2]=4 9792 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,2,0,0,0,0|0,0,2]=4 9793 B9R0.47 CCCCNC(=N)N(C)C Amb28072105 [0,2,0,0,0,0|2,0,0]=4 9794 B9R0.47 CCCCNC(=O)C(=O)O Amb9303865 [0,2,0,0,0,0|1,0,1]=4 9795 B9R0.47 CCCCNC(=O)C(C)=O Amb17399878 [0,2,0,0,0,0|0,0,1]=3 9796 B9R0.47 CCCCNC(=O)C(C)Br Amb17333014 [0,2,0,0,0,0|1,0,0]=3 9797 B9R0.47 CCCCNC(=O)C(C)Cl Amb6279272 [0,2,0,0,0,0|1,0,0]=3 9798 B9R0.47 CCCCNC(=O)C(C)I Amb28365859 [0,2,0,0,0,0|1,0,0]=3 9799 B9R0.47 CCCCNC(=O)C(C)N Amb6274939 [0,2,0,0,0,0|1,0,0]=3 9800 B9R0.47 CCCCNC(=O)C(C)O Amb9421393 [0,2,0,0,0,0|1,0,0]=3 9801 B9R0.47 CCCCNC(=O)C(F)Cl Amb28145280 [0,2,0,0,0,0|1,0,0]=3 9802 B9R0.47 CCCCNC(=O)C(N)=O Amb28050037 [0,2,0,0,0,0|1,0,1]=4 9803 B9R0.47 CCCCNC(=O)N(C)C Amb2721024 [0,2,0,0,0,0|1,0,0]=3 9804 B9R0.47 CCCCNC(=O)N(C)N Amb27817849 [0,2,0,0,0,0|1,0,0]=3 9805 B9R0.47 CCCCNC(=O)[C@@H](C)Br Amb27799880 [0,2,0,0,0,0|1,0,0]=3 9806 B9R0.47 CCCCNC(=O)[C@@H](C)N Amb18014636 [0,2,0,0,0,0|1,0,0]=3 9807 B9R0.47 CCCCNC(=O)[C@@H](C)O Amb25740293 [0,2,0,0,0,0|1,0,0]=3 9808 B9R0.47 CCCCNC(=O)[C@H](C)Br Amb27617159 [0,2,0,0,0,0|1,0,0]=3 9809 B9R0.47 CCCCNC(=O)[C@H](C)O Amb27259099 [0,2,0,0,0,0|1,0,0]=3 9810 B9R0.47 CCCCNC(=S)C(=O)O Amb27657804 [0,2,0,0,0,0|1,0,1]=4 9811 B9R0.47 CCCCNC(=S)N(C)N Amb1150085 [0,2,0,0,0,0|1,1,0]=4 9812 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,2,0,0,0,0|1,0,0]=3 9813 B9R0.47 CCCCNC(C)C(C)Cl Amb27424247 [0,2,0,0,0,0|1,0,1]=4 9814 B9R0.47 CCCCNC(C)C(C)O Amb27874111 [0,2,0,0,0,0|0,0,2]=4 9815 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [0,2,0,0,0,0|1,0,0]=3 9816 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,2,0,0,0,0|1,0,0]=3 9817 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,2,0,0,0,0|1,0,0]=3 9818 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [0,2,0,0,0,0|1,0,1]=4 9819 B9R0.47 CCCCOC(=O)C(C)Br Amb3939973 [0,2,0,0,0,0|1,0,0]=3 9820 B9R0.47 CCCCOC(=O)C(C)Cl Amb9786084 [0,2,0,0,0,0|1,0,0]=3 9821 B9R0.47 CCCCOC(=O)C(C)F Amb27816837 [0,2,0,0,0,0|1,0,0]=3 9822 B9R0.47 CCCCOC(=O)C(C)N Amb8894984 [0,2,0,0,0,0|1,0,0]=3 9823 B9R0.47 CCCCOC(=O)C(C)O Amb3939678 [0,2,0,0,0,0|1,0,0]=3 9824 B9R0.47 CCCCOC(=O)C(F)Cl Amb10840262 [0,2,0,0,0,0|1,0,0]=3 9825 B9R0.47 CCCCOC(=O)C(F)F Amb10838765 [0,2,0,0,0,0|1,0,0]=3 9826 B9R0.47 CCCCOC(=O)C(O)O Amb26507421 [0,2,0,0,0,0|1,0,0]=3 9827 B9R0.47 CCCCOC(=O)[C@H](C)N Amb26979455 [0,2,0,0,0,0|1,0,0]=3 9828 B9R0.47 CCCCOC(=O)[C@H](C)O Amb3939703 [0,2,0,0,0,0|1,0,0]=3 9829 B9R0.47 CCCCOC(C)C(=N)N Amb27393859 [0,2,0,0,0,0|2,0,0]=4 9830 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,2,0,0,0,0|1,0,0]=3 9831 B9R0.47 CCCCOC(C)C(C)Cl Amb28383768 [0,2,0,0,0,0|1,0,1]=4 9832 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [0,2,0,0,0,0|1,0,0]=3 9833 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [0,2,0,0,0,0|1,1,0]=4 9834 B9R0.47 CCCCOC(C)[C@@H](C)N Amb27201179 [0,2,0,0,0,0|1,0,1]=4 9835 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [0,2,0,0,0,0|1,0,0]=3 9836 B9R0.47 CCCCOC(O)C(C)C Amb27764938 [0,2,0,0,0,0|1,0,1]=4 9837 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,2,0,0,0,0|1,0,0]=3 9838 B9R0.47 CCCCO[C@@H](C)[C@@H](C)O Amb28050639 [0,2,0,0,0,0|0,0,2]=4 9839 B9R0.47 CCCCO[C@@H](C)[C@H](C)O Amb27790251 [0,2,0,0,0,0|0,0,2]=4 9840 B9R0.47 CCCCSC(=S)N(C)C Amb27599912 [0,2,0,0,0,0|1,1,0]=4 9841 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,2,0,0,0,0|1,0,0]=3 9842 B9R0.47 CCCCSC(C)C(C)Cl Amb27424775 [0,2,0,0,0,0|1,0,1]=4 9843 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [0,2,0,0,0,0|1,0,0]=3 9844 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [0,2,0,0,0,0|1,0,0]=3 9845 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,2,0,0,0,0|1,0,0]=3 9846 B9R0.47 CCCCS[C@H](C)[C@@H](C)O Amb27835113 [0,2,0,0,0,0|0,0,2]=4 9847 B9R0.47 CCCC\C=C(/Br)C(=O)O Amb27615132 [0,2,0,0,0,0|1,0,1]=4 9848 B9R0.47 CCCC\C=C(/C)B(O)O Amb27449318 [0,2,0,0,0,0|0,0,2]=4 9849 B9R0.47 CCCC\C=C(/Cl)C(C)=O Amb27822638 [0,2,0,0,0,0|0,0,1]=3 9850 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [0,2,0,0,0,0|0,0,1]=3 9851 B9R0.47 CCCC\C=C(\C)C(C)N Amb27617843 [0,2,0,0,0,0|1,0,1]=4 9852 B9R0.47 CCCC\C=C(\F)C(=O)O Amb28197633 [0,2,0,0,0,0|1,0,1]=4 9853 B9R0.47 CCCC\C=C(\N)C(N)=O Amb27473333 [0,2,0,0,0,0|1,0,1]=4 9854 B9R0.47 CCCC\N=C(/C)N(C)C Amb28246152 [0,2,0,0,0,0|2,0,0]=4 9855 B9R0.47 CCCC\N=C(/Cl)C(C)=O Amb27861098 [0,2,0,0,0,0|0,0,1]=3 9856 B9R0.47 CCCC\N=C(/F)C(F)Cl Amb28118914 [0,2,0,0,0,0|2,0,0]=4 9857 B9R0.47 CCCNCC(=O)N(C)C Amb6714438 [0,2,0,0,0,0|1,0,0]=3 9858 B9R0.47 CCCNCC(C)N(C)C Amb28204516 [0,2,0,0,0,0|2,0,0]=4 9859 B9R0.47 CCCNCC(Cl)C(C)C Amb27207030 [0,2,0,0,0,0|1,0,1]=4 9860 B9R0.47 CCCNCC(N)C(N)=O Amb27952357 [0,2,0,0,0,0|1,0,0]=3 9861 B9R0.47 CCCNCC(O)C(C)C Amb27427929 [0,2,0,0,0,0|1,0,1]=4 9862 B9R0.47 CCCNCC(O)C(N)=O Amb27875874 [0,2,0,0,0,0|1,0,0]=3 9863 B9R0.47 CCCN\C=C(/O)C(C)=O Amb27259606 [0,2,0,0,0,0|0,0,2]=4 9864 B9R0.47 CCCN\C=C(\C)C(C)=O Amb25244710 [0,2,0,0,0,0|0,0,2]=4 9865 B9R0.47 CCCN\N=C(/C)C(=O)O Amb27495222 [0,2,0,0,0,0|2,0,0]=4 9866 B9R0.47 CCCOCC(=O)C(=O)O Amb27787004 [0,2,0,0,0,0|1,0,1]=4 9867 B9R0.47 CCCOCC(=O)C(C)N Amb28050473 [0,2,0,0,0,0|1,0,0]=3 9868 B9R0.47 CCCOCC(=O)N(C)C Amb27823198 [0,2,0,0,0,0|1,0,0]=3 9869 B9R0.47 CCCOCC(=O)N(C)O Amb27435235 [0,2,0,0,0,0|1,0,0]=3 9870 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [0,2,0,0,0,0|1,0,0]=3 9871 B9R0.47 CCCOCC(Cl)C(C)Cl Amb27659302 [0,2,0,0,0,0|1,0,1]=4 9872 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [0,2,0,0,0,0|1,0,0]=3 9873 B9R0.47 CCCOCC(N)C(C)C Amb22009215 [0,2,0,0,0,0|1,0,1]=4 9874 B9R0.47 CCCOCC(N)C(N)=O Amb27155900 [0,2,0,0,0,0|1,0,0]=3 9875 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [0,2,0,0,0,0|1,0,0]=3 9876 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [0,2,0,0,0,0|1,0,0]=3 9877 B9R0.47 CCCONC(=O)C(C)Br Amb27165388 [0,2,0,0,0,0|2,0,0]=4 9878 B9R0.47 CCCO\C=C(\C)C(N)=O Amb27950360 [0,2,0,0,0,0|1,0,1]=4 9879 B9R0.47 CCCSCC(=N)N(C)C Amb28280345 [0,2,0,0,0,0|2,0,0]=4 9880 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [0,2,0,0,0,0|0,0,0]=2 9881 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [0,2,0,0,0,0|1,0,0]=3 9882 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [0,2,0,0,0,0|1,0,0]=3 9883 B9R0.47 CCCSCC(N)C(C)C Amb27649482 [0,2,0,0,0,0|1,0,1]=4 9884 B9R0.47 CCCSC[C@H](C)N(C)C Amb28349583 [0,2,0,0,0,0|2,0,0]=4 9885 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [0,2,0,0,0,0|1,0,0]=3 9886 B9R0.47 CCC\C=C/C(N)C(N)=O Amb28249181 [0,2,0,0,0,0|1,0,1]=4 9887 B9R0.47 CCC\C=C\C(=O)C(C)=O Amb25255453 [0,2,0,0,0,0|0,0,2]=4 9888 B9R0.47 CCC\C=C\C(=O)C(C)N Amb33327185 [0,2,0,0,0,0|0,0,2]=4 9889 B9R0.47 CCC\C=C\C(=O)C(F)F Amb32745563 [0,2,0,0,0,0|0,0,2]=4 9890 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [0,2,0,0,0,0|1,0,1]=4 9891 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [0,2,0,0,0,0|1,0,1]=4 9892 B9R0.47 CCC\C=C\[C@@H](N)C(=O)O Amb27230868 [0,2,0,0,0,0|1,0,1]=4 9893 B9R0.47 CCC\C=C\[C@H](O)C(C)=O Amb28139306 [0,2,0,0,0,0|0,0,1]=3 9894 B9R0.47 CCNCCC(=O)C(C)C Amb28423107 [0,2,0,0,0,0|1,0,0]=3 9895 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [0,2,0,0,0,0|1,0,0]=3 9896 B9R0.47 CCNCCC(C)C(C)C Amb27801731 [0,2,0,0,0,0|1,0,1]=4 9897 B9R0.47 CCNCCC(C)S(C)=O Amb27408727 [0,2,0,0,0,0|1,0,0]=3 9898 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [0,2,0,0,0,0|1,0,0]=3 9899 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [0,2,0,0,0,0|1,0,0]=3 9900 B9R0.47 CCNC\C=C(\C)C(=O)O Amb27630213 [0,2,0,0,0,0|1,0,1]=4 9901 B9R0.47 CCOCCC(=O)C(=O)Cl Amb24649864 [0,2,0,0,0,0|1,0,1]=4 9902 B9R0.47 CCOCCC(C)C(C)=O Amb27837597 [0,2,0,0,0,0|0,0,0]=2 9903 B9R0.47 CCOCCC(C)C(C)N Amb27837598 [0,2,0,0,0,0|1,0,1]=4 9904 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [0,2,0,0,0,0|1,0,0]=3 9905 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [0,2,0,0,0,0|1,0,0]=3 9906 B9R0.47 CCOCCC(N)C(C)=O Amb28055992 [0,2,0,0,0,0|0,0,0]=2 9907 B9R0.47 CCOCCC(N)C(C)C Amb28207891 [0,2,0,0,0,0|1,0,1]=4 9908 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,2,0,0,0,0|1,0,0]=3 9909 B9R0.47 CCOCCN(C)C(=O)Cl Amb27228674 [0,2,0,0,0,0|2,0,0]=4 9910 B9R0.47 CCOCCN(C)C(N)=O Amb28137478 [0,2,0,0,0,0|2,0,0]=4 9911 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [0,2,0,0,0,0|1,0,0]=3 9912 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [0,2,0,0,0,0|1,0,0]=3 9913 B9R0.47 CCOCNC(=O)C(C)Cl Amb27945631 [0,2,0,0,0,0|2,0,0]=4 9914 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,2,0,0,0,0|2,0,0]=4 9915 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,2,0,0,0,0|2,0,0]=4 9916 B9R0.47 CCOC\C=C(\C)C(=O)O Amb27877295 [0,2,0,0,0,0|1,0,1]=4 9917 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [0,2,0,0,0,0|2,0,0]=4 9918 B9R0.47 CCONCC(C)C(N)=O Amb28244659 [0,2,0,0,0,0|2,0,0]=4 9919 B9R0.47 CCONCC(N)C(N)=O Amb28045946 [0,2,0,0,0,0|2,0,0]=4 9920 B9R0.47 CCSCCC(=O)C(=O)O Amb26652044 [0,2,0,0,0,0|1,0,1]=4 9921 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [0,2,0,0,0,0|1,0,0]=3 9922 B9R0.47 CCSCCC(C)C(C)O Amb27762859 [0,2,0,0,0,0|0,0,2]=4 9923 B9R0.47 CCSCCC(Cl)C(N)=O Amb27614970 [0,2,0,0,0,0|1,0,0]=3 9924 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [0,2,0,0,0,0|1,0,0]=3 9925 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,2,0,0,0,0|1,0,0]=3 9926 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [0,2,0,0,0,0|1,0,0]=3 9927 B9R0.47 CCSCCC(O)C(N)=O Amb26926790 [0,2,0,0,0,0|1,0,0]=3 9928 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [0,2,0,0,0,0|1,0,0]=3 9929 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [0,2,0,0,0,0|1,0,0]=3 9930 B9R0.47 CCSSCC(N)C(N)=O Amb27201565 [0,2,0,0,0,0|2,0,0]=4 9931 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [0,2,0,0,0,0|1,0,1]=4 9932 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [0,2,0,0,0,0|1,0,1]=4 9933 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [0,2,0,0,0,0|1,0,1]=4 9934 B9R0.47 CN(C)C(=O)CCCC=O Amb26480717 [0,2,0,0,0,0|1,0,1]=4 9935 B9R0.47 CN(C)C(=O)CCCCBr Amb17239685 [0,2,0,0,0,0|1,0,0]=3 9936 B9R0.47 CN(C)C(=O)CCCCCl Amb7782604 [0,2,0,0,0,0|1,0,0]=3 9937 B9R0.47 CN(C)C(=O)CCCCN Amb13883045 [0,2,0,0,0,0|1,0,0]=3 9938 B9R0.47 CN(C)C(=O)CCCCN Amb25146454 [0,2,0,0,0,0|1,0,0]=3 9939 B9R0.47 CN(C)C(=O)CCCCO Amb17232000 [0,2,0,0,0,0|1,0,0]=3 9940 B9R0.47 CN(C)C(=O)CNCCF Amb27623759 [0,2,0,0,0,0|2,0,0]=4 9941 B9R0.47 CN(C)C(=O)CNCCN Amb27170566 [0,2,0,0,0,0|2,0,0]=4 9942 B9R0.47 CN(C)C(=O)COCCN Amb18308413 [0,2,0,0,0,0|2,0,0]=4 9943 B9R0.47 CN(C)C(=O)CSCCN Amb6273883 [0,2,0,0,0,0|2,0,0]=4 9944 B9R0.47 CN(C)C(=O)NCCCN Amb18251288 [0,2,0,0,0,0|2,0,0]=4 9945 B9R0.47 CN(C)C(=O)NCCCN Amb33733496 [0,2,0,0,0,0|2,0,0]=4 9946 B9R0.47 CN(C)C(=O)OCCCN Amb26035128 [0,2,0,0,0,0|2,0,0]=4 9947 B9R0.47 CN(C)C(=O)OCCCN Amb33743958 [0,2,0,0,0,0|2,0,0]=4 9948 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [0,2,0,0,0,0|2,0,0]=4 9949 B9R0.47 CN(CCCCO)C(N)=O Amb27452604 [0,2,0,0,0,0|2,0,0]=4 9950 B9R0.47 CN(CCCCO)S(C)=O Amb28192000 [0,2,0,0,0,0|2,0,0]=4 9951 B9R0.47 CN(O)C(=O)COCCN Amb28129391 [0,2,0,0,0,0|2,0,0]=4 9952 B9R0.47 CNCCCC(=O)N(C)C Amb19003180 [0,2,0,0,0,0|1,0,0]=3 9953 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [0,2,0,0,0,0|1,0,0]=3 9954 B9R0.47 CNCCCN(C)C(N)=O Amb27446493 [0,2,0,0,0,0|2,0,0]=4 9955 B9R0.47 CNCCNC(=O)C(C)C Amb19036002 [0,2,0,0,0,0|2,0,0]=4 9956 B9R0.47 CNCCNC(=O)C(C)C Amb24271128 [0,2,0,0,0,0|2,0,0]=4 9957 B9R0.47 CNCCNC(=O)C(F)F Amb27243353 [0,2,0,0,0,0|2,0,0]=4 9958 B9R0.47 CNCCNC(=O)N(C)C Amb22157186 [0,2,0,0,0,0|2,0,0]=4 9959 B9R0.47 CNCCNC(=O)N(C)C Amb32674836 [0,2,0,0,0,0|2,0,0]=4 9960 B9R0.47 CNCCNC(=O)[C@H](C)O Amb27859599 [0,2,0,0,0,0|2,0,0]=4 9961 B9R0.47 CNCCOC(=O)N(C)C Amb24357109 [0,2,0,0,0,0|2,0,0]=4 9962 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,2,0,0,0,0|2,0,0]=4 9963 B9R0.47 CNCCOC(C)C(C)=O Amb18111841 [0,2,0,0,0,0|1,0,0]=3 9964 B9R0.47 CNOCC[C@H](N)C(=O)O Amb27405026 [0,2,0,0,0,0|2,0,0]=4 9965 B9R0.47 COCCCC(=N)N(C)C Amb27826721 [0,2,0,0,0,0|2,0,0]=4 9966 B9R0.47 COCCCC(=O)C(=O)O Amb28050154 [0,2,0,0,0,0|1,0,1]=4 9967 B9R0.47 COCCCC(=O)C(C)C Amb9031695 [0,2,0,0,0,0|1,0,0]=3 9968 B9R0.47 COCCCC(=O)N(C)C Amb26546914 [0,2,0,0,0,0|1,0,0]=3 9969 B9R0.47 COCCCC(Br)C(C)C Amb27432345 [0,2,0,0,0,0|1,0,1]=4 9970 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [0,2,0,0,0,0|1,0,0]=3 9971 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [0,2,0,0,0,0|0,0,0]=2 9972 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [0,2,0,0,0,0|1,0,0]=3 9973 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [0,2,0,0,0,0|1,0,0]=3 9974 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [0,2,0,0,0,0|1,0,0]=3 9975 B9R0.47 COCCCC(N)C(N)=O Amb26331697 [0,2,0,0,0,0|1,0,0]=3 9976 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [0,2,0,0,0,0|1,0,0]=3 9977 B9R0.47 COCCCN(C)C(=O)Cl Amb27837819 [0,2,0,0,0,0|2,0,0]=4 9978 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [0,2,0,0,0,0|1,0,0]=3 9979 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [0,2,0,0,0,0|1,0,0]=3 9980 B9R0.47 COCCNC(=O)C(C)=O Amb17399892 [0,2,0,0,0,0|1,0,1]=4 9981 B9R0.47 COCCNC(=O)C(C)C Amb3357874 [0,2,0,0,0,0|2,0,0]=4 9982 B9R0.47 COCCNC(=O)C(C)Cl Amb9745744 [0,2,0,0,0,0|2,0,0]=4 9983 B9R0.47 COCCNC(=O)C(C)I Amb27255487 [0,2,0,0,0,0|2,0,0]=4 9984 B9R0.47 COCCNC(=O)C(C)O Amb9421406 [0,2,0,0,0,0|2,0,0]=4 9985 B9R0.47 COCCNC(=O)C(C)S Amb27858288 [0,2,0,0,0,0|2,0,0]=4 9986 B9R0.47 COCCNC(=O)[C@@H](C)N Amb18014645 [0,2,0,0,0,0|2,0,0]=4 9987 B9R0.47 COCCNC(=O)[C@@H](C)O Amb27804900 [0,2,0,0,0,0|2,0,0]=4 9988 B9R0.47 COCCNC(=O)[C@H](C)N Amb5783196 [0,2,0,0,0,0|2,0,0]=4 9989 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [0,2,0,0,0,0|2,0,0]=4 9990 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [0,2,0,0,0,0|2,0,0]=4 9991 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,2,0,0,0,0|2,0,0]=4 9992 B9R0.47 COCCNC(C)C(N)=O Amb9203267 [0,2,0,0,0,0|2,0,0]=4 9993 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [0,2,0,0,0,0|2,0,0]=4 9994 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [0,2,0,0,0,0|2,0,0]=4 9995 B9R0.47 COCCOC(=O)C(C)=O Amb27656479 [0,2,0,0,0,0|1,0,1]=4 9996 B9R0.47 COCCOC(=O)C(C)S Amb27780473 [0,2,0,0,0,0|2,0,0]=4 9997 B9R0.47 COCCOC(=O)N(C)C Amb28049823 [0,2,0,0,0,0|2,0,0]=4 9998 B9R0.47 COCCOC(=O)[C@@H](C)N Amb24478115 [0,2,0,0,0,0|2,0,0]=4 9999 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,2,0,0,0,0|2,0,0]=4 10000 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,2,0,0,0,0|2,0,0]=4 10001 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [0,2,0,0,0,0|2,0,0]=4 10002 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [0,2,0,0,0,0|2,0,0]=4 10003 B9R0.47 CONCC[C@H](N)C(=O)O Amb27623933 [0,2,0,0,0,0|2,0,0]=4 10004 B9R0.47 CSCCCC(=O)C(=O)O Amb27490899 [0,2,0,0,0,0|1,0,1]=4 10005 B9R0.47 CSCCCC(=O)N(C)C Amb18413480 [0,2,0,0,0,0|1,0,0]=3 10006 B9R0.47 CSCCCC(Br)C(C)C Amb27833845 [0,2,0,0,0,0|1,0,1]=4 10007 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [0,2,0,0,0,0|1,0,0]=3 10008 B9R0.47 CSCCCC(C)C(C)=O Amb27841950 [0,2,0,0,0,0|0,0,0]=2 10009 B9R0.47 CSCCCC(Cl)C(N)=O Amb27588927 [0,2,0,0,0,0|1,0,0]=3 10010 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [0,2,0,0,0,0|1,0,0]=3 10011 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [0,2,0,0,0,0|1,0,0]=3 10012 B9R0.47 CSCCCC(N)C(C)C Amb27494428 [0,2,0,0,0,0|1,0,1]=4 10013 B9R0.47 CSCCCC(N)C(N)=O Amb27770389 [0,2,0,0,0,0|1,0,0]=3 10014 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [0,2,0,0,0,0|1,0,0]=3 10015 B9R0.47 CSCCCC(O)C(N)=O Amb27197765 [0,2,0,0,0,0|1,0,0]=3 10016 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [0,2,0,0,0,0|1,0,0]=3 10017 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [0,2,0,0,0,0|1,0,0]=3 10018 B9R0.47 CSCCNC(=O)C(C)Cl Amb9387315 [0,2,0,0,0,0|2,0,0]=4 10019 B9R0.47 CSCCNC(=O)N(C)C Amb27973444 [0,2,0,0,0,0|2,0,0]=4 10020 B9R0.47 CSCCNC(=O)[C@H](C)N Amb28123343 [0,2,0,0,0,0|2,0,0]=4 10021 B9R0.47 CSCCNC(C)C(N)=O Amb27400757 [0,2,0,0,0,0|2,0,0]=4 10022 B9R0.47 CSCCOC(=O)C(C)O Amb28142790 [0,2,0,0,0,0|2,0,0]=4 10023 B9R0.47 CSCCOC(=O)C(F)F Amb27219269 [0,2,0,0,0,0|2,0,0]=4 10024 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,2,0,0,0,0|2,0,0]=4 10025 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,2,0,0,0,0|2,0,0]=4 10026 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [0,2,0,0,0,0|2,0,0]=4 10027 B9R0.47 CSCC\C=C(\C)C(=O)O Amb27449576 [0,2,0,0,0,0|1,0,1]=4 10028 B9R0.47 CSCSC[C@H](N)C(=O)O Amb26874540 [0,2,0,0,0,0|2,0,0]=4 10029 B9R0.47 CSSCCC(N)C(=O)O Amb28456103 [0,2,0,0,0,0|2,0,0]=4 10030 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [0,2,0,0,0,0|1,0,0]=3 10031 B9R0.47 C[C@@H](N)C(=O)NCCCN Amb28325305 [0,2,0,0,0,0|2,0,0]=4 10032 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [0,2,0,0,0,0|2,0,0]=4 10033 B9R0.47 C[C@@H](O)C(=O)NCCCO Amb28316044 [0,2,0,0,0,0|2,0,0]=4 10034 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,2,0,0,0,0|2,0,0]=4 10035 B9R0.47 C[C@H](N)C(=O)NCCCF Amb27602949 [0,2,0,0,0,0|2,0,0]=4 10036 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [0,2,0,0,0,0|2,0,0]=4 10037 B9R0.47 C\C(=C/CCCCl)C(=O)O Amb27203326 [0,2,0,0,0,0|1,0,1]=4 10038 B9R0.47 C\C=C/CCC(=O)C(C)=O Amb27591550 [0,2,0,0,0,0|0,0,2]=4 10039 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [0,2,0,0,0,0|1,0,1]=4 10040 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [0,2,0,0,0,0|1,0,1]=4 10041 B9R0.47 N#CCCCC(Cl)C(=O)Cl Amb28396535 [0,2,0,0,0,0|1,0,1]=4 10042 B9R0.47 N#CCCCC(Cl)C(=O)O Amb17594023 [0,2,0,0,0,0|1,0,1]=4 10043 B9R0.47 N#CCCCC(N)C(=O)O Amb25242567 [0,2,0,0,0,0|1,0,1]=4 10044 B9R0.47 N#CCCCC(N)C(N)=O Amb33308858 [0,2,0,0,0,0|1,0,1]=4 10045 B9R0.47 N#CCCC[C@@H](N)C(=O)O Amb28349132 [0,2,0,0,0,0|1,0,1]=4 10046 B9R0.47 N#CCCC[C@H](N)C(=O)O Amb26043277 [0,2,0,0,0,0|1,0,1]=4 10047 B9R0.47 NC(=O)C(N)CCCCBr Amb28313246 [0,2,0,0,0,0|1,0,0]=3 10048 B9R0.47 NC(=O)C(N)CCCCF Amb27977425 [0,2,0,0,0,0|1,0,0]=3 10049 B9R0.47 NC(=O)C(N)CCCCO Amb33065912 [0,2,0,0,0,0|1,0,0]=3 10050 B9R0.47 NC(=O)C(O)CNCCF Amb28320057 [0,2,0,0,0,0|2,0,0]=4 10051 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [0,2,0,0,0,0|1,0,0]=3 10052 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [0,2,0,0,0,0|1,0,0]=3 10053 B9R0.47 NC(COCCCl)C(=O)O Amb18126477 [0,2,0,0,0,0|2,0,0]=4 10054 B9R0.47 NC(CSCCO)C(=O)O Amb6262852 [0,2,0,0,0,0|2,0,0]=4 10055 B9R0.47 NC(CSCCS)C(=O)O Amb27837996 [0,2,0,0,0,0|2,0,0]=4 10056 B9R0.47 NCCCCC(=O)C(=O)O Amb33756866 [0,2,0,0,0,0|1,0,1]=4 10057 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [0,2,0,0,0,0|1,0,0]=3 10058 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [0,2,0,0,0,0|1,0,0]=3 10059 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [0,2,0,0,0,0|1,0,0]=3 10060 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [0,2,0,0,0,0|1,0,0]=3 10061 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [0,2,0,0,0,0|1,0,0]=3 10062 B9R0.47 NCCCCC(N)C(N)=O Amb17593646 [0,2,0,0,0,0|1,0,0]=3 10063 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [0,2,0,0,0,0|1,0,0]=3 10064 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [0,2,0,0,0,0|1,0,0]=3 10065 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [0,2,0,0,0,0|1,0,0]=3 10066 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [0,2,0,0,0,0|1,0,0]=3 10067 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb27404620 [0,2,0,0,0,0|1,0,0]=3 10068 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [0,2,0,0,0,0|1,0,0]=3 10069 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [0,2,0,0,0,0|1,0,0]=3 10070 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [0,2,0,0,0,0|1,0,0]=3 10071 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [0,2,0,0,0,0|1,0,0]=3 10072 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [0,2,0,0,0,0|1,0,0]=3 10073 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [0,2,0,0,0,0|1,0,0]=3 10074 B9R0.47 NCCCC[C@H](N)C(N)=O Amb33757921 [0,2,0,0,0,0|1,0,0]=3 10075 B9R0.47 NCCCOC(N)C(=O)O Amb27838076 [0,2,0,0,0,0|2,0,0]=4 10076 B9R0.47 NCCCS[C@H](N)C(=O)O Amb27410557 [0,2,0,0,0,0|2,0,0]=4 10077 B9R0.47 NCCOCC(N)C(=O)O Amb27224745 [0,2,0,0,0,0|2,0,0]=4 10078 B9R0.47 NCCOC[C@H](N)C(=O)O Amb26844671 [0,2,0,0,0,0|2,0,0]=4 10079 B9R0.47 NCCSCC(O)C(=O)O Amb27789579 [0,2,0,0,0,0|2,0,0]=4 10080 B9R0.47 NCCSC[C@@H](N)C(=O)O Amb27945627 [0,2,0,0,0,0|2,0,0]=4 10081 B9R0.47 NCCSC[C@H](N)C(=O)O Amb22362775 [0,2,0,0,0,0|2,0,0]=4 10082 B9R0.47 NCCSC[C@H](N)C(=O)O Amb25887551 [0,2,0,0,0,0|2,0,0]=4 10083 B9R0.47 NCSCCC(N)C(=O)O Amb27468506 [0,2,0,0,0,0|2,0,0]=4 10084 B9R0.47 NCSCC[C@H](N)C(=O)O Amb27425090 [0,2,0,0,0,0|2,0,0]=4 10085 B9R0.47 NOCCCC(N)C(=O)O Amb24117962 [0,2,0,0,0,0|2,0,0]=4 10086 B9R0.47 NOCCCC(N)C(=O)O Amb27222313 [0,2,0,0,0,0|2,0,0]=4 10087 B9R0.47 NOCCC[C@H](N)C(=O)O Amb28397870 [0,2,0,0,0,0|2,0,0]=4 10088 B9R0.47 N[C@@H](CCCC=O)C(=O)O Amb2695588 [0,2,0,0,0,0|1,0,1]=4 10089 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [0,2,0,0,0,0|1,0,0]=3 10090 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [0,2,0,0,0,0|1,0,0]=3 10091 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [0,2,0,0,0,0|1,0,0]=3 10092 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [0,2,0,0,0,0|1,0,0]=3 10093 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [0,2,0,0,0,0|1,0,0]=3 10094 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb29083430 [0,2,0,0,0,0|2,0,0]=4 10095 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb30666629 [0,2,0,0,0,0|2,0,0]=4 10096 B9R0.47 N[C@@H](CNCCO)C(=O)O Amb25146307 [0,2,0,0,0,0|2,0,0]=4 10097 B9R0.47 N[C@@H](COCCCl)C(=O)O Amb28134274 [0,2,0,0,0,0|2,0,0]=4 10098 B9R0.47 N[C@@H](CSCCCl)C(=O)O Amb25887675 [0,2,0,0,0,0|2,0,0]=4 10099 B9R0.47 N[C@@H](CSCCF)C(=O)O Amb27837852 [0,2,0,0,0,0|2,0,0]=4 10100 B9R0.47 N[C@@H](CSCCO)C(=O)O Amb2695551 [0,2,0,0,0,0|2,0,0]=4 10101 B9R0.47 N[C@H](CCCC=O)C(=O)O Amb27272621 [0,2,0,0,0,0|1,0,1]=4 10102 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [0,2,0,0,0,0|1,0,0]=3 10103 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [0,2,0,0,0,0|1,0,0]=3 10104 B9R0.47 N[C@H](CSCCO)C(=O)O Amb8629048 [0,2,0,0,0,0|2,0,0]=4 10105 B9R0.47 O=C(NCCCCl)C(Cl)Cl Amb6411252 [0,2,0,0,0,0|2,0,0]=4 10106 B9R0.47 O=C(NCCCO)C(Cl)Cl Amb17665128 [0,2,0,0,0,0|2,0,0]=4 10107 B9R0.47 O=C(O)C(=O)CCCCBr Amb27654991 [0,2,0,0,0,0|1,0,1]=4 10108 B9R0.47 O=C(O)C(=O)CCCCO Amb27626027 [0,2,0,0,0,0|1,0,1]=4 10109 B9R0.47 O=C(O)C(Cl)CSCCCl Amb27949681 [0,2,0,0,0,0|2,0,0]=4 10110 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [0,2,0,0,0,0|1,0,0]=3 10111 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [0,2,0,0,0,0|2,0,0]=4 10112 B9R0.47 [C-]#[N+]CCCN(C)C(C)=O Amb27625151 [0,2,0,0,0,0|1,0,1]=4 10113 B9R0.50 C#CC(CCCCC)NC Amb27440108 [0,2,0,0,0,0|1,0,1]=4 10114 B9R0.50 C=C=C(C=O)CCCCC Amb27268873 [0,2,0,0,0,0|0,0,1]=3 10115 B9R0.50 C=C=C(CC)CCCCO Amb27614980 [0,2,0,0,0,0|2,0,0]=4 10116 B9R0.50 C=C=C(CCCCCl)OC Amb28067743 [0,2,0,0,0,0|2,0,0]=4 10117 B9R0.50 C=CC(CCCCC)NC Amb27652218 [0,2,0,0,0,0|1,0,1]=4 10118 B9R0.50 C=CC(CO)CCCCC Amb27977343 [0,2,0,0,0,0|1,0,1]=4 10119 B9R0.50 CCCCC=C(C=O)C=O Amb18643579 [0,2,0,0,0,0|0,0,2]=4 10120 B9R0.50 CCCCC=C(CC)CC Amb22229299 [0,2,0,0,0,0|1,0,1]=4 10121 B9R0.50 CCCCCC(C=O)CC Amb25883306 [0,2,0,0,0,0|0,0,1]=3 10122 B9R0.50 CCCCCC(C=O)SC Amb27841692 [0,2,0,0,0,0|0,0,1]=3 10123 B9R0.50 CCCCCC(CC)CBr Amb26369673 [0,2,0,0,0,0|1,0,1]=4 10124 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|1,0,1]=4 10125 B9R0.50 CCCCCC(CC)CCl Amb26369462 [0,2,0,0,0,0|1,0,1]=4 10126 B9R0.50 CCCCCC(CC)CO Amb27831173 [0,2,0,0,0,0|0,0,2]=4 10127 B9R0.50 CCCCCC(CC)NN Amb28072731 [0,2,0,0,0,0|1,0,1]=4 10128 B9R0.50 CCCCCC(CC)OC Amb27425019 [0,2,0,0,0,0|0,0,2]=4 10129 B9R0.50 CCCCCC(CC)ON Amb28292988 [0,2,0,0,0,0|0,0,2]=4 10130 B9R0.50 CCCCCC(CN)CO Amb27465223 [0,2,0,0,0,0|0,0,2]=4 10131 B9R0.50 CCCCCC(CN)OC Amb25989930 [0,2,0,0,0,0|0,0,2]=4 10132 B9R0.50 CCCCCC(CN)SC Amb27249496 [0,2,0,0,0,0|0,1,1]=4 10133 B9R0.50 CCCCCC(CO)CS Amb27839186 [0,2,0,0,0,0|0,0,2]=4 10134 B9R0.50 CCCCCC(CO)SC Amb27457183 [0,2,0,0,0,0|0,0,2]=4 10135 B9R0.50 CCCCCC(OC)OC Amb8517638 [0,2,0,0,0,0|0,0,2]=4 10136 B9R0.50 CCCCCN(CC)CC Amb28049601 [0,2,0,0,0,0|2,0,0]=4 10137 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [0,2,0,0,0,0|0,0,1]=3 10138 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [0,2,0,0,0,0|0,0,2]=4 10139 B9R0.50 CCCCC\C(C#N)=C\N Amb27874067 [0,2,0,0,0,0|1,0,1]=4 10140 B9R0.50 CCCCC\C(C=O)=C/N Amb27591489 [0,2,0,0,0,0|0,0,1]=3 10141 B9R0.50 CCCCN\C(CC)=N\O Amb28189780 [0,2,0,0,0,0|1,0,1]=4 10142 B9R0.50 CCCCSC(C=O)CC Amb27799813 [0,2,0,0,0,0|1,0,1]=4 10143 B9R0.50 CCCCS\C(=C\Cl)CCl Amb27407117 [0,2,0,0,0,0|2,0,0]=4 10144 B9R0.50 CCCC\C=C(/C=O)CCl Amb28319228 [0,2,0,0,0,0|0,0,1]=3 10145 B9R0.50 CCCC\C=C(/C=O)SC Amb25324111 [0,2,0,0,0,0|0,0,1]=3 10146 B9R0.50 CCCC\C=C(\CC)CBr Amb24477337 [0,2,0,0,0,0|1,0,1]=4 10147 B9R0.50 CCCC\N=C(\NN)SC Amb27401169 [0,2,0,0,0,0|2,0,0]=4 10148 B9R0.50 CCNCCN(C=O)CC Amb18124697 [0,2,0,0,0,0|2,0,0]=4 10149 B9R0.50 CCNCCN(CC)N=O Amb27617076 [0,2,0,0,0,0|2,0,0]=4 10150 B9R0.50 CCOCCN(C=O)CC Amb28123303 [0,2,0,0,0,0|2,0,0]=4 10151 B9R0.50 CN\C(CCCOC)=N/N Amb27809776 [0,2,0,0,0,0|2,0,0]=4 10152 B9R0.50 C\C=C(\C#N)CNCCC Amb28141465 [0,2,0,0,0,0|2,0,0]=4 10153 B9R0.50 C\C=C(\C=O)CCCCC Amb27443056 [0,2,0,0,0,0|0,0,0]=2 10154 B9R0.2 C#CCCCCCC(=O)O Amb22232010 [0,2,0,0,0,0|1,0,0]=3 10155 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [0,2,0,0,0,0|0,0,0]=2 10156 B9R0.2 C#CCCCCCC(N)=O Amb27596626 [0,2,0,0,0,0|1,0,0]=3 10157 B9R0.2 C#CCCCCNC(N)=O Amb28397135 [0,2,0,0,0,0|1,0,1]=4 10158 B9R0.2 C#CCCCNCC(=C)C Amb28050425 [0,2,0,0,0,0|1,0,1]=4 10159 B9R0.2 C#CCCCSCC(=C)C Amb27247246 [0,2,0,0,0,0|1,0,1]=4 10160 B9R0.2 C#CCCCSCC(=O)O Amb27984745 [0,2,0,0,0,0|1,0,1]=4 10161 B9R0.2 C#CCCCSCC(C)=O Amb27484271 [0,2,0,0,0,0|0,0,1]=3 10162 B9R0.2 C#CCCC\C=C\C(C)=O Amb25205680 [0,2,0,0,0,0|0,0,2]=4 10163 B9R0.2 C#CCCNCCC(=O)O Amb9326411 [0,2,0,0,0,0|1,0,1]=4 10164 B9R0.2 C#CCCOCCC(=O)O Amb27406242 [0,2,0,0,0,0|1,0,1]=4 10165 B9R0.2 C#CCCSCCC(N)=O Amb27846787 [0,2,0,0,0,0|1,0,1]=4 10166 B9R0.2 C#CCC\C=C\CC(C)=O Amb26626728 [0,2,0,0,0,0|0,0,2]=4 10167 B9R0.2 C#CCNCCCS(C)=O Amb27666547 [0,2,0,0,0,0|1,0,1]=4 10168 B9R0.2 C#CCOCCCC(=O)O Amb9208659 [0,2,0,0,0,0|1,0,1]=4 10169 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [0,2,0,0,0,0|1,0,1]=4 10170 B9R0.2 C=C(Br)CNCCCCC Amb27641587 [0,2,0,0,0,0|1,0,1]=4 10171 B9R0.2 C=C(Br)CNCCCCO Amb27165495 [0,2,0,0,0,0|1,0,1]=4 10172 B9R0.2 C=C(Br)CNCCCSC Amb27443989 [0,2,0,0,0,0|1,0,1]=4 10173 B9R0.2 C=C(Br)COCCCOC Amb27778814 [0,2,0,0,0,0|1,0,1]=4 10174 B9R0.2 C=C(Br)COCCSCC Amb27643203 [0,2,0,0,0,0|1,0,1]=4 10175 B9R0.2 C=C(Br)CSCCCCC Amb27810009 [0,2,0,0,0,0|1,0,1]=4 10176 B9R0.2 C=C(Br)CSCCCOC Amb27831867 [0,2,0,0,0,0|1,0,1]=4 10177 B9R0.2 C=C(C)C#CCCCCC Amb27593421 [0,2,0,0,0,0|1,0,0]=3 10178 B9R0.2 C=C(C)CC#CCCCCl Amb27856096 [0,2,0,0,0,0|1,0,1]=4 10179 B9R0.2 C=C(C)CC#CCCCO Amb27753081 [0,2,0,0,0,0|1,0,1]=4 10180 B9R0.2 C=C(C)CCC#CCCO Amb27839496 [0,2,0,0,0,0|1,0,1]=4 10181 B9R0.2 C=C(C)CCCCCCC Amb6298940 [0,2,0,0,0,0|1,0,0]=3 10182 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [0,2,0,0,0,0|1,0,0]=3 10183 B9R0.2 C=C(C)CCCCCNC Amb27489967 [0,2,0,0,0,0|1,0,0]=3 10184 B9R0.2 C=C(C)CCCOCC=O Amb27617165 [0,2,0,0,0,0|1,0,1]=4 10185 B9R0.2 C=C(C)CCNCCC#N Amb27188875 [0,2,0,0,0,0|1,0,1]=4 10186 B9R0.2 C=C(C)CCNCCCN Amb27863043 [0,2,0,0,0,0|1,0,0]=3 10187 B9R0.2 C=C(C)CCOCCCN Amb27615177 [0,2,0,0,0,0|1,0,0]=3 10188 B9R0.2 C=C(C)CCSCCCC Amb27199306 [0,2,0,0,0,0|1,0,0]=3 10189 B9R0.2 C=C(C)CCSCCCN Amb27615176 [0,2,0,0,0,0|1,0,0]=3 10190 B9R0.2 C=C(C)CNCCCCC Amb17308711 [0,2,0,0,0,0|1,0,0]=3 10191 B9R0.2 C=C(C)CNCCOCC Amb28119481 [0,2,0,0,0,0|1,0,0]=3 10192 B9R0.2 C=C(C)COCCCCC Amb27862423 [0,2,0,0,0,0|1,0,0]=3 10193 B9R0.2 C=C(C)CONCCCN Amb27627211 [0,2,0,0,0,0|2,0,0]=4 10194 B9R0.2 C=C(C)CSCCC#CC Amb27771956 [0,2,0,0,0,0|1,0,1]=4 10195 B9R0.2 C=C(C)CSCCCCC Amb27977453 [0,2,0,0,0,0|1,0,0]=3 10196 B9R0.2 C=C(C)CSCCCCN Amb17500961 [0,2,0,0,0,0|1,0,0]=3 10197 B9R0.2 C=C(C)CSCCSCC Amb27970745 [0,2,0,0,0,0|1,0,0]=3 10198 B9R0.2 C=C(C)C\C=C\CCCO Amb27661168 [0,2,0,0,0,0|1,0,1]=4 10199 B9R0.2 C=C(Cl)CCCCCCCl Amb6298882 [0,2,0,0,0,0|1,0,1]=4 10200 B9R0.2 C=C(Cl)CNCCCOC Amb18800731 [0,2,0,0,0,0|1,0,1]=4 10201 B9R0.2 C=C(Cl)CNCCCSC Amb27490426 [0,2,0,0,0,0|1,0,1]=4 10202 B9R0.2 C=C(Cl)CSCCCCF Amb27972129 [0,2,0,0,0,0|1,0,1]=4 10203 B9R0.2 C=C(Cl)CSCCSCC Amb27766351 [0,2,0,0,0,0|1,0,1]=4 10204 B9R0.2 C=CCCCC#CC(C)=O Amb27856606 [0,2,0,0,0,0|0,0,2]=4 10205 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [0,2,0,0,0,0|1,0,0]=3 10206 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [0,2,0,0,0,0|0,0,0]=2 10207 B9R0.2 C=CCCCCCC(C)C Amb27205011 [0,2,0,0,0,0|1,0,1]=4 10208 B9R0.2 C=CCCCCCN(C)C Amb27462877 [0,2,0,0,0,0|2,0,0]=4 10209 B9R0.2 C=CCCCCC[C@@H](C)O Amb28318202 [0,2,0,0,0,0|0,0,2]=4 10210 B9R0.2 C=CCCCCNC(C)=O Amb27436512 [0,2,0,0,0,0|0,0,1]=3 10211 B9R0.2 C=CCCCCOC(C)=O Amb10842183 [0,2,0,0,0,0|0,0,1]=3 10212 B9R0.2 C=CCCCNCC(=O)O Amb28119977 [0,2,0,0,0,0|1,0,1]=4 10213 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [0,2,0,0,0,0|1,0,1]=4 10214 B9R0.2 C=CCCCOCC(C)=O Amb27474466 [0,2,0,0,0,0|0,0,1]=3 10215 B9R0.2 C=CCCCSCC(=O)O Amb27838988 [0,2,0,0,0,0|1,0,1]=4 10216 B9R0.2 C=CCCC\C=C\C(C)=O Amb27628550 [0,2,0,0,0,0|0,0,2]=4 10217 B9R0.2 C=CCCNCCC(=O)O Amb27839020 [0,2,0,0,0,0|1,0,1]=4 10218 B9R0.2 C=CCCNCCS(C)=O Amb27206219 [0,2,0,0,0,0|1,0,1]=4 10219 B9R0.2 C=CCCOCCC(N)=O Amb27394496 [0,2,0,0,0,0|1,0,1]=4 10220 B9R0.2 C=CCCSCCC(=O)O Amb28201215 [0,2,0,0,0,0|1,0,1]=4 10221 B9R0.2 C=CCNCCCS(C)=O Amb28240159 [0,2,0,0,0,0|1,0,1]=4 10222 B9R0.2 C=CCNCCNC(C)=O Amb28187196 [0,2,0,0,0,0|0,0,2]=4 10223 B9R0.2 C=CCOCCCC(=O)O Amb33531507 [0,2,0,0,0,0|1,0,1]=4 10224 B9R0.2 C=CCOCCCC(C)=O Amb27590994 [0,2,0,0,0,0|0,0,1]=3 10225 B9R0.2 C=CCOCCCC(N)=O Amb27629257 [0,2,0,0,0,0|1,0,1]=4 10226 B9R0.2 C=CCOCCOC(C)=O Amb27656617 [0,2,0,0,0,0|0,0,2]=4 10227 B9R0.2 C=CCSCCCC(=O)O Amb27392354 [0,2,0,0,0,0|1,0,1]=4 10228 B9R0.2 C=CCSCCNC(C)=O Amb27663017 [0,2,0,0,0,0|0,0,2]=4 10229 B9R0.2 C=COCCCNC(C)=O Amb28201189 [0,2,0,0,0,0|0,0,2]=4 10230 B9R0.2 C=C\C=C/CCCC(C)=O Amb28126953 [0,2,0,0,0,0|0,0,2]=4 10231 B9R0.2 C=C\C=C\CCCC(C)=O Amb25713959 [0,2,0,0,0,0|0,0,2]=4 10232 B9R0.2 CC#CCCCCC(C)Br Amb27949818 [0,2,0,0,0,0|1,0,1]=4 10233 B9R0.2 CC#CCCCCC(N)=O Amb27258980 [0,2,0,0,0,0|1,0,0]=3 10234 B9R0.2 CC#CCCONC(C)=O Amb27814768 [0,2,0,0,0,0|0,0,2]=4 10235 B9R0.2 CC#CCNCCC(=O)O Amb27594145 [0,2,0,0,0,0|1,0,1]=4 10236 B9R0.2 CC#CCNCCC(N)=O Amb28119482 [0,2,0,0,0,0|1,0,1]=4 10237 B9R0.2 CC(=O)CCCC#CCO Amb28201537 [0,2,0,0,0,0|0,0,1]=3 10238 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,2,0,0,0,0|0,0,0]=2 10239 B9R0.2 CC(=O)CCCCCCN Amb32663700 [0,2,0,0,0,0|0,0,0]=2 10240 B9R0.2 CC(=O)CCCCN=C=O Amb27838960 [0,2,0,0,0,0|0,0,1]=3 10241 B9R0.2 CC(=O)CCCCN=C=S Amb27945518 [0,2,0,0,0,0|0,0,1]=3 10242 B9R0.2 CC(=O)CCCSCCO Amb9660259 [0,2,0,0,0,0|0,0,0]=2 10243 B9R0.2 CC(=O)CCC\C=C/C#N Amb28244715 [0,2,0,0,0,0|0,0,2]=4 10244 B9R0.2 CC(=O)CNCCCC=O Amb24664343 [0,2,0,0,0,0|0,0,1]=3 10245 B9R0.2 CC(=O)CNCCCCN Amb33483477 [0,2,0,0,0,0|0,0,0]=2 10246 B9R0.2 CC(=O)CNCCCCN Amb33483478 [0,2,0,0,0,0|0,0,0]=2 10247 B9R0.2 CC(=O)CSCCCCF Amb27952719 [0,2,0,0,0,0|0,0,0]=2 10248 B9R0.2 CC(=O)CSCCCCN Amb17500952 [0,2,0,0,0,0|0,0,0]=2 10249 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [0,2,0,0,0,0|0,0,1]=3 10250 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [0,2,0,0,0,0|0,0,0]=2 10251 B9R0.2 CC(=O)NCCCCCN Amb18102716 [0,2,0,0,0,0|0,0,0]=2 10252 B9R0.2 CC(=O)NCCCN=C=S Amb28074571 [0,2,0,0,0,0|1,0,1]=4 10253 B9R0.2 CC(=O)NCCCNC=O Amb28197455 [0,2,0,0,0,0|1,0,1]=4 10254 B9R0.2 CC(=O)NCCCSC#N Amb27197871 [0,2,0,0,0,0|1,0,1]=4 10255 B9R0.2 CC(=O)NCCNCCN Amb27596069 [0,2,0,0,0,0|1,0,0]=3 10256 B9R0.2 CC(=O)NCCOCCBr Amb33528182 [0,2,0,0,0,0|1,0,0]=3 10257 B9R0.2 CC(=O)NCCOCCCl Amb27461485 [0,2,0,0,0,0|1,0,0]=3 10258 B9R0.2 CC(=O)NCCOCCN Amb16233780 [0,2,0,0,0,0|1,0,0]=3 10259 B9R0.2 CC(=O)NCCOCCO Amb24477952 [0,2,0,0,0,0|1,0,0]=3 10260 B9R0.2 CC(=O)NCCSCCN Amb8876526 [0,2,0,0,0,0|1,0,0]=3 10261 B9R0.2 CC(=O)OCCC#CCO Amb27761640 [0,2,0,0,0,0|0,0,2]=4 10262 B9R0.2 CC(=O)OCCCCC=O Amb26505388 [0,2,0,0,0,0|0,0,1]=3 10263 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [0,2,0,0,0,0|0,0,0]=2 10264 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [0,2,0,0,0,0|0,0,0]=2 10265 B9R0.2 CC(=O)OCCCC[Zn]Br Amb22000480 [0,2,0,0,0,0|1,0,0]=3 10266 B9R0.2 CC(=O)OCCCN=C=O Amb32670651 [0,2,0,0,0,0|1,0,1]=4 10267 B9R0.2 CC(=O)OCCC\C=C\Cl Amb24720035 [0,2,0,0,0,0|0,0,2]=4 10268 B9R0.2 CC(=O)OCCNCCCl Amb28142296 [0,2,0,0,0,0|1,0,0]=3 10269 B9R0.2 CC(=O)OCCOCCCl Amb9787226 [0,2,0,0,0,0|1,0,0]=3 10270 B9R0.2 CC(=O)OCCOCCI Amb28050483 [0,2,0,0,0,0|1,0,0]=3 10271 B9R0.2 CC(=O)OCCSCCO Amb27825930 [0,2,0,0,0,0|1,0,0]=3 10272 B9R0.2 CC(=O)SCCCCC#N Amb28322815 [0,2,0,0,0,0|0,0,1]=3 10273 B9R0.2 CC(=O)SCCCCC=O Amb27432569 [0,2,0,0,0,0|0,0,1]=3 10274 B9R0.2 CC(=O)SCCCN=[N+]=[N-] Amb26023730 [0,2,0,0,0,0|2,0,0]=4 10275 B9R0.2 CC(=O)SCCOCCO Amb28050523 [0,2,0,0,0,0|1,0,0]=3 10276 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,2,0,0,0,0|0,0,1]=3 10277 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [0,2,0,0,0,0|0,0,1]=3 10278 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,2,0,0,0,0|0,0,1]=3 10279 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [0,2,0,0,0,0|0,0,1]=3 10280 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [0,2,0,0,0,0|1,0,1]=4 10281 B9R0.2 CC(C)=CCCCCCCl Amb27879457 [0,2,0,0,0,0|1,0,0]=3 10282 B9R0.2 CC(C)=CCNCCCN Amb18622357 [0,2,0,0,0,0|1,0,1]=4 10283 B9R0.2 CC(C)=CCOCCCN Amb27200033 [0,2,0,0,0,0|1,0,1]=4 10284 B9R0.2 CC(C)CCCCCC#N Amb18643473 [0,2,0,0,0,0|1,0,1]=4 10285 B9R0.2 CC(C)CCCCCC=O Amb22233123 [0,2,0,0,0,0|1,0,1]=4 10286 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|1,0,1]=4 10287 B9R0.2 CC(C)CCCCCCN Amb6608741 [0,2,0,0,0,0|1,0,1]=4 10288 B9R0.2 CC(C)CCCNCCBr Amb28368030 [0,2,0,0,0,0|1,0,1]=4 10289 B9R0.2 CC(C)CCCNCCN Amb27950337 [0,2,0,0,0,0|1,0,1]=4 10290 B9R0.2 CC(C)CCCOCCS Amb27979122 [0,2,0,0,0,0|1,0,1]=4 10291 B9R0.2 CC(C)CCNCCCCl Amb27466095 [0,2,0,0,0,0|1,0,1]=4 10292 B9R0.2 CC(C)CCNCCCN Amb17315309 [0,2,0,0,0,0|1,0,1]=4 10293 B9R0.2 CC(C)CCNCCCO Amb6733599 [0,2,0,0,0,0|1,0,1]=4 10294 B9R0.2 CC(C)CCOCCCN Amb6248634 [0,2,0,0,0,0|1,0,1]=4 10295 B9R0.2 CC(C)CCOCCCS Amb27594404 [0,2,0,0,0,0|1,0,1]=4 10296 B9R0.2 CC(C)CCSCCCN Amb17500699 [0,2,0,0,0,0|1,0,1]=4 10297 B9R0.2 CC(C)CCSCCCO Amb17502843 [0,2,0,0,0,0|1,0,1]=4 10298 B9R0.2 CC(C)CNCCCCBr Amb27839561 [0,2,0,0,0,0|1,0,1]=4 10299 B9R0.2 CC(C)CNCCCCN Amb17334222 [0,2,0,0,0,0|1,0,1]=4 10300 B9R0.2 CC(C)CNCCCCO Amb17334252 [0,2,0,0,0,0|1,0,1]=4 10301 B9R0.2 CC(C)COCCCCBr Amb8855451 [0,2,0,0,0,0|1,0,1]=4 10302 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,0,1]=4 10303 B9R0.2 CC(C)COCCCCO Amb27617219 [0,2,0,0,0,0|1,0,1]=4 10304 B9R0.2 CC(C)CSCCCCN Amb9391257 [0,2,0,0,0,0|1,0,1]=4 10305 B9R0.2 CC(C)NCCCCCCl Amb27257059 [0,2,0,0,0,0|1,0,1]=4 10306 B9R0.2 CC(C)NCCCCCF Amb27594142 [0,2,0,0,0,0|1,0,1]=4 10307 B9R0.2 CC(C)NCCCCCI Amb27619570 [0,2,0,0,0,0|1,0,1]=4 10308 B9R0.2 CC(C)NCCCCCN Amb21953734 [0,2,0,0,0,0|1,0,1]=4 10309 B9R0.2 CC(C)NCCCCCO Amb17334255 [0,2,0,0,0,0|1,0,1]=4 10310 B9R0.2 CC(C)OCCCCCBr Amb25060878 [0,2,0,0,0,0|1,0,1]=4 10311 B9R0.2 CC(C)OCCCCCCl Amb9001658 [0,2,0,0,0,0|1,0,1]=4 10312 B9R0.2 CC(C)OCCCCCN Amb25049832 [0,2,0,0,0,0|1,0,1]=4 10313 B9R0.2 CC(C)SCCCCCN Amb18792402 [0,2,0,0,0,0|1,0,1]=4 10314 B9R0.2 CC(C)SCCCCCS Amb27833893 [0,2,0,0,0,0|1,0,1]=4 10315 B9R0.2 CC(Cl)CCCCCCN Amb28137853 [0,2,0,0,0,0|1,0,1]=4 10316 B9R0.2 CC(N)CCSCCCN Amb27755582 [0,2,0,0,0,0|1,0,1]=4 10317 B9R0.2 CC(N)CSCCCCO Amb27801506 [0,2,0,0,0,0|1,0,1]=4 10318 B9R0.2 CC(O)CCCCCCO Amb27272851 [0,2,0,0,0,0|0,0,2]=4 10319 B9R0.2 CC(O)CCCNCCN Amb27253160 [0,2,0,0,0,0|0,0,2]=4 10320 B9R0.2 CC(O)CCCNCCO Amb28343143 [0,2,0,0,0,0|0,0,2]=4 10321 B9R0.2 CC(O)CCNCCCF Amb27817504 [0,2,0,0,0,0|0,0,2]=4 10322 B9R0.2 CC(O)COCCCCN Amb28246831 [0,2,0,0,0,0|0,0,2]=4 10323 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [0,2,0,0,0,0|1,0,0]=3 10324 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [0,2,0,0,0,0|0,0,0]=2 10325 B9R0.2 CCC#CCCOC(C)=O Amb22641578 [0,2,0,0,0,0|0,0,1]=3 10326 B9R0.2 CCC#CCOCC(=O)O Amb27425006 [0,2,0,0,0,0|1,0,1]=4 10327 B9R0.2 CCCC#CC#CC(C)=O Amb17593414 [0,2,0,0,0,0|0,0,2]=4 10328 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [0,2,0,0,0,0|1,0,0]=3 10329 B9R0.2 CCCC#CCCC(N)=O Amb28054810 [0,2,0,0,0,0|1,0,0]=3 10330 B9R0.2 CCCC=C=CCC(=O)O Amb27814505 [0,2,0,0,0,0|1,0,1]=4 10331 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [0,2,0,0,0,0|1,0,0]=3 10332 B9R0.2 CCCCC#CCC(C)O Amb28190297 [0,2,0,0,0,0|0,0,2]=4 10333 B9R0.2 CCCCC#CC[C@@H](C)O Amb27812433 [0,2,0,0,0,0|0,0,2]=4 10334 B9R0.2 CCCCC#CC[C@H](C)O Amb27755474 [0,2,0,0,0,0|0,0,2]=4 10335 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [0,2,0,0,0,0|1,0,1]=4 10336 B9R0.2 CCCCCC#CC(=O)Cl Amb27950037 [0,2,0,0,0,0|1,0,0]=3 10337 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [0,2,0,0,0,0|1,0,0]=3 10338 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [0,2,0,0,0,0|1,0,0]=3 10339 B9R0.2 CCCCCCCC(=O)O Amb3940371 [0,2,0,0,0,0|1,0,0]=3 10340 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,2,0,0,0,0|1,0,0]=3 10341 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [0,2,0,0,0,0|1,0,0]=3 10342 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [0,2,0,0,0,0|1,0,0]=3 10343 B9R0.2 CCCCCCCC(C)=O Amb6891951 [0,2,0,0,0,0|0,0,0]=2 10344 B9R0.2 CCCCCCCC(C)Br Amb3940567 [0,2,0,0,0,0|1,0,1]=4 10345 B9R0.2 CCCCCCCC(C)C Amb6366303 [0,2,0,0,0,0|1,0,1]=4 10346 B9R0.2 CCCCCCCC(C)S Amb7795228 [0,2,0,0,0,0|0,1,1]=4 10347 B9R0.2 CCCCCCCC(N)=O Amb8999028 [0,2,0,0,0,0|1,0,0]=3 10348 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [0,2,0,0,0,0|2,0,0]=4 10349 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [0,2,0,0,0,0|2,0,0]=4 10350 B9R0.2 CCCCCCCS(N)=O Amb32720352 [0,2,0,0,0,0|2,0,0]=4 10351 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [0,2,0,0,0,0|1,0,1]=4 10352 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|1,0,1]=4 10353 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|0,0,2]=4 10354 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|1,0,1]=4 10355 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|0,0,2]=4 10356 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [0,2,0,0,0,0|2,0,0]=4 10357 B9R0.2 CCCCCCNC(C)=O Amb3368460 [0,2,0,0,0,0|0,0,0]=2 10358 B9R0.2 CCCCCCNC(N)=O Amb23569596 [0,2,0,0,0,0|1,0,0]=3 10359 B9R0.2 CCCCCCNC(N)=S Amb1152526 [0,2,0,0,0,0|1,1,0]=4 10360 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [0,2,0,0,0,0|1,0,0]=3 10361 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [0,2,0,0,0,0|1,1,0]=4 10362 B9R0.2 CCCCCCOC(C)=O Amb8513414 [0,2,0,0,0,0|0,0,0]=2 10363 B9R0.2 CCCCCCOC(C)C Amb28320041 [0,2,0,0,0,0|1,0,1]=4 10364 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|1,0,1]=4 10365 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,2,0,0,0,0|0,0,2]=4 10366 B9R0.2 CCCCCCOC(N)=O Amb22495526 [0,2,0,0,0,0|1,0,0]=3 10367 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [0,2,0,0,0,0|2,0,0]=4 10368 B9R0.2 CCCCCCSC(=N)N Amb20676030 [0,2,0,0,0,0|2,0,0]=4 10369 B9R0.2 CCCCCCSC(=N)N Amb22487386 [0,2,0,0,0,0|2,0,0]=4 10370 B9R0.2 CCCCCCSC(=N)N Amb27811857 [0,2,0,0,0,0|2,0,0]=4 10371 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [0,2,0,0,0,0|1,0,0]=3 10372 B9R0.2 CCCCCCSC(C)=O Amb27837874 [0,2,0,0,0,0|0,0,0]=2 10373 B9R0.2 CCCCCCSC(C)C Amb28315852 [0,2,0,0,0,0|1,0,1]=4 10374 B9R0.2 CCCCCCSC(N)=S Amb28342219 [0,2,0,0,0,0|1,1,0]=4 10375 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [0,2,0,0,0,0|1,0,0]=3 10376 B9R0.2 CCCCCNCC(N)=O Amb6708061 [0,2,0,0,0,0|1,0,0]=3 10377 B9R0.2 CCCCCOCC(=O)O Amb8902706 [0,2,0,0,0,0|1,0,0]=3 10378 B9R0.2 CCCCCOCC(C)N Amb8902896 [0,2,0,0,0,0|1,0,1]=4 10379 B9R0.2 CCCCCOC[C@@H](C)N Amb27490460 [0,2,0,0,0,0|1,0,1]=4 10380 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,2,0,0,0,0|0,0,2]=4 10381 B9R0.2 CCCCCONC(N)=O Amb2899790 [0,2,0,0,0,0|1,0,0]=3 10382 B9R0.2 CCCCCSCC(=O)O Amb6249571 [0,2,0,0,0,0|1,0,0]=3 10383 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,2,0,0,0,0|1,0,1]=4 10384 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,2,0,0,0,0|1,0,1]=4 10385 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [0,2,0,0,0,0|0,0,2]=4 10386 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [0,2,0,0,0,0|0,0,2]=4 10387 B9R0.2 CCCCNCCC(=O)O Amb7755713 [0,2,0,0,0,0|1,0,0]=3 10388 B9R0.2 CCCCNCCC(C)=O Amb26381876 [0,2,0,0,0,0|0,0,0]=2 10389 B9R0.2 CCCCNCCC(C)O Amb27986026 [0,2,0,0,0,0|0,0,2]=4 10390 B9R0.2 CCCCNCCC(N)=O Amb8841106 [0,2,0,0,0,0|1,0,0]=3 10391 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 10392 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,2,0,0,0,0|0,0,1]=3 10393 B9R0.2 CCCCOCCC(N)=O Amb27480748 [0,2,0,0,0,0|1,0,0]=3 10394 B9R0.2 CCCCOCCC(N)=S Amb8895295 [0,2,0,0,0,0|1,1,0]=4 10395 B9R0.2 CCCCOCCN(C)C Amb27192355 [0,2,0,0,0,0|2,0,0]=4 10396 B9R0.2 CCCCO\C=C\C(=O)Cl Amb27804268 [0,2,0,0,0,0|1,0,1]=4 10397 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|1,0,0]=3 10398 B9R0.2 CCCCSCCC(C)C Amb27651351 [0,2,0,0,0,0|1,0,1]=4 10399 B9R0.2 CCCCSCCC(C)N Amb28189560 [0,2,0,0,0,0|1,0,1]=4 10400 B9R0.2 CCCCSCCC(N)=S Amb17503251 [0,2,0,0,0,0|1,1,0]=4 10401 B9R0.2 CCCCS\C=C/C(C)=O Amb27945160 [0,2,0,0,0,0|0,0,1]=3 10402 B9R0.2 CCCCS\C=C\C(C)=O Amb26410917 [0,2,0,0,0,0|0,0,1]=3 10403 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [0,2,0,0,0,0|0,0,0]=2 10404 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [0,2,0,0,0,0|1,0,0]=3 10405 B9R0.2 CCCC\C=C\CC(C)O Amb27839464 [0,2,0,0,0,0|0,0,2]=4 10406 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [0,2,0,0,0,0|1,0,0]=3 10407 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,2,0,0,0,0|0,0,1]=3 10408 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,2,0,0,0,0|0,0,1]=3 10409 B9R0.2 CCCC\C=N\NC(N)=O Amb28050098 [0,2,0,0,0,0|1,0,1]=4 10410 B9R0.2 CCCNCCC=C(C)C Amb27238155 [0,2,0,0,0,0|1,0,0]=3 10411 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|1,0,0]=3 10412 B9R0.2 CCCNCCCC(C)C Amb8853733 [0,2,0,0,0,0|1,0,1]=4 10413 B9R0.2 CCCNCCCC(C)N Amb27475709 [0,2,0,0,0,0|1,0,1]=4 10414 B9R0.2 CCCNCCCN(C)C Amb6699374 [0,2,0,0,0,0|2,0,0]=4 10415 B9R0.2 CCCNCCNS(C)=O Amb27265740 [0,2,0,0,0,0|1,0,0]=3 10416 B9R0.2 CCCNCCOC(N)=O Amb27828395 [0,2,0,0,0,0|1,0,0]=3 10417 B9R0.2 CCCOCC#CC(N)=O Amb33495811 [0,2,0,0,0,0|1,0,1]=4 10418 B9R0.2 CCCOCCCC(=N)N Amb8874875 [0,2,0,0,0,0|2,0,0]=4 10419 B9R0.2 CCCOCCCC(=O)O Amb8874517 [0,2,0,0,0,0|1,0,0]=3 10420 B9R0.2 CCCOCCCC(C)Cl Amb27795432 [0,2,0,0,0,0|1,0,1]=4 10421 B9R0.2 CCCOCCCC(N)=S Amb8874843 [0,2,0,0,0,0|1,1,0]=4 10422 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [0,2,0,0,0,0|1,0,0]=3 10423 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,2,0,0,0,0|0,0,0]=2 10424 B9R0.2 CCCOCCOC(N)=O Amb27265626 [0,2,0,0,0,0|1,0,0]=3 10425 B9R0.2 CCCOCCSC(=N)N Amb27837335 [0,2,0,0,0,0|2,0,0]=4 10426 B9R0.2 CCCONCC=C(C)C Amb28186052 [0,2,0,0,0,0|1,0,1]=4 10427 B9R0.2 CCCONCCC(=O)O Amb27233908 [0,2,0,0,0,0|1,0,0]=3 10428 B9R0.2 CCCONCCC(C)C Amb28396906 [0,2,0,0,0,0|1,0,1]=4 10429 B9R0.2 CCCONCCC(C)O Amb27244555 [0,2,0,0,0,0|0,0,2]=4 10430 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,2,0,0,0,0|1,0,0]=3 10431 B9R0.2 CCCSCCCC(C)=O Amb9660304 [0,2,0,0,0,0|0,0,0]=2 10432 B9R0.2 CCCSCCCC(C)N Amb27838926 [0,2,0,0,0,0|1,0,1]=4 10433 B9R0.2 CCCSCCNC(N)=O Amb28345909 [0,2,0,0,0,0|1,0,0]=3 10434 B9R0.2 CCC\C=C/C#CC(C)=O Amb28411610 [0,2,0,0,0,0|0,0,2]=4 10435 B9R0.2 CCC\C=C/C=C/C(C)=O Amb28291455 [0,2,0,0,0,0|0,0,2]=4 10436 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [0,2,0,0,0,0|1,0,0]=3 10437 B9R0.2 CCC\C=C/COC(N)=O Amb27413052 [0,2,0,0,0,0|1,0,1]=4 10438 B9R0.2 CCC\C=C\C#CC(C)=O Amb17593455 [0,2,0,0,0,0|0,0,2]=4 10439 B9R0.2 CCC\C=C\C=C\C(C)=O Amb33079035 [0,2,0,0,0,0|0,0,2]=4 10440 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [0,2,0,0,0,0|1,0,0]=3 10441 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [0,2,0,0,0,0|0,0,0]=2 10442 B9R0.2 CCC\C=C\CCC(C)N Amb33424850 [0,2,0,0,0,0|1,0,1]=4 10443 B9R0.2 CCC\C=C\CCC(C)O Amb33424849 [0,2,0,0,0,0|0,0,2]=4 10444 B9R0.2 CCC\C=C\CCC(N)=O Amb27493443 [0,2,0,0,0,0|1,0,0]=3 10445 B9R0.2 CCC\C=C\CC[C@@H](C)N Amb33424844 [0,2,0,0,0,0|1,0,1]=4 10446 B9R0.2 CCC\C=C\CC[C@@H](C)O Amb33424845 [0,2,0,0,0,0|0,0,2]=4 10447 B9R0.2 CCC\C=C\CC[C@H](C)N Amb33424843 [0,2,0,0,0,0|1,0,1]=4 10448 B9R0.2 CCC\C=C\CC[C@H](C)O Amb33424847 [0,2,0,0,0,0|0,0,2]=4 10449 B9R0.2 CCC\C=C\CC[N+](=O)[O-] Amb33424827 [0,2,0,0,0,0|2,0,0]=4 10450 B9R0.2 CCC\C=C\COC(C)=O Amb8515402 [0,2,0,0,0,0|0,0,1]=3 10451 B9R0.2 CCC\C=N\NCC(=O)O Amb27432508 [0,2,0,0,0,0|1,0,1]=4 10452 B9R0.2 CCC\C=N\NCC(N)=O Amb27853075 [0,2,0,0,0,0|1,0,1]=4 10453 B9R0.2 CCC\C=N\OCC(N)=O Amb27255660 [0,2,0,0,0,0|1,0,1]=4 10454 B9R0.2 CCNCCCCC(=O)O Amb24385094 [0,2,0,0,0,0|1,0,0]=3 10455 B9R0.2 CCNCCCCC(=O)O Amb32686610 [0,2,0,0,0,0|1,0,0]=3 10456 B9R0.2 CCNCCCCC(C)=O Amb27951143 [0,2,0,0,0,0|0,0,0]=2 10457 B9R0.2 CCNCCCCC(N)=O Amb27964384 [0,2,0,0,0,0|1,0,0]=3 10458 B9R0.2 CCNCCCCN(C)C Amb27254437 [0,2,0,0,0,0|2,0,0]=4 10459 B9R0.2 CCNCCCNC(=N)N Amb27759465 [0,2,0,0,0,0|2,0,0]=4 10460 B9R0.2 CCNCCCNC(N)=O Amb9466113 [0,2,0,0,0,0|1,0,0]=3 10461 B9R0.2 CCNCCCSC(C)C Amb18177750 [0,2,0,0,0,0|1,0,1]=4 10462 B9R0.2 CCNCCNCC(C)C Amb27232336 [0,2,0,0,0,0|1,0,1]=4 10463 B9R0.2 CCNCCOCC(C)C Amb27834453 [0,2,0,0,0,0|1,0,1]=4 10464 B9R0.2 CCNCCSCC(C)N Amb27467377 [0,2,0,0,0,0|1,0,1]=4 10465 B9R0.2 CCOCCC#CC(=O)O Amb33168968 [0,2,0,0,0,0|1,0,1]=4 10466 B9R0.2 CCOCCCCC(=N)N Amb28352192 [0,2,0,0,0,0|2,0,0]=4 10467 B9R0.2 CCOCCCCC(=O)O Amb9207786 [0,2,0,0,0,0|1,0,0]=3 10468 B9R0.2 CCOCCCCC(C)=O Amb9659807 [0,2,0,0,0,0|0,0,0]=2 10469 B9R0.2 CCOCCCCC(N)=S Amb18180039 [0,2,0,0,0,0|1,1,0]=4 10470 B9R0.2 CCOCCCNC(C)=O Amb3886591 [0,2,0,0,0,0|0,0,0]=2 10471 B9R0.2 CCOCCCNC(N)=O Amb404787 [0,2,0,0,0,0|1,0,0]=3 10472 B9R0.2 CCOCCCNC(N)=S Amb446862 [0,2,0,0,0,0|1,1,0]=4 10473 B9R0.2 CCOCCCOC(C)=O Amb22733319 [0,2,0,0,0,0|0,0,0]=2 10474 B9R0.2 CCOCCCSC(=N)N Amb28204042 [0,2,0,0,0,0|2,0,0]=4 10475 B9R0.2 CCOCCNCC(C)C Amb9241020 [0,2,0,0,0,0|1,0,1]=4 10476 B9R0.2 CCOCCOCC(=O)O Amb6258165 [0,2,0,0,0,0|1,0,0]=3 10477 B9R0.2 CCOCCOCC(C)O Amb9787531 [0,2,0,0,0,0|0,0,2]=4 10478 B9R0.2 CCOCCOCC(N)=O Amb28203011 [0,2,0,0,0,0|1,0,0]=3 10479 B9R0.2 CCOCCONC(N)=O Amb27432448 [0,2,0,0,0,0|2,0,0]=4 10480 B9R0.2 CCOCSCC=C(C)C Amb27842954 [0,2,0,0,0,0|1,0,1]=4 10481 B9R0.2 CCOCSCCC(=O)O Amb27447358 [0,2,0,0,0,0|1,0,0]=3 10482 B9R0.2 CCONCCCC(=O)O Amb27839067 [0,2,0,0,0,0|1,0,0]=3 10483 B9R0.2 CCONCCCN(C)C Amb27412749 [0,2,0,0,0,0|2,0,0]=4 10484 B9R0.2 CCSCCCCC(=O)O Amb7782874 [0,2,0,0,0,0|1,0,0]=3 10485 B9R0.2 CCSCCCCC(C)Br Amb27867199 [0,2,0,0,0,0|1,0,1]=4 10486 B9R0.2 CCSCCCOC(C)=O Amb27605064 [0,2,0,0,0,0|0,0,0]=2 10487 B9R0.2 CCSCCNC[C@H](C)O Amb27972582 [0,2,0,0,0,0|0,0,2]=4 10488 B9R0.2 CCSCCONC(C)=O Amb28070443 [0,2,0,0,0,0|1,0,0]=3 10489 B9R0.2 CCSCCONC(N)=O Amb28185803 [0,2,0,0,0,0|2,0,0]=4 10490 B9R0.2 CCSCCSCC(=O)O Amb28126747 [0,2,0,0,0,0|1,0,0]=3 10491 B9R0.2 CCSCCSCC(N)=O Amb28293850 [0,2,0,0,0,0|1,0,0]=3 10492 B9R0.2 CC\C=C\CCCC(C)N Amb28247293 [0,2,0,0,0,0|1,0,1]=4 10493 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [0,2,0,0,0,0|0,0,1]=3 10494 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [0,2,0,0,0,0|1,0,1]=4 10495 B9R0.2 CC\C=C\C\C=C\C(C)=O Amb27226161 [0,2,0,0,0,0|0,0,2]=4 10496 B9R0.2 CN(C)CCCCCC#N Amb27234781 [0,2,0,0,0,0|2,0,0]=4 10497 B9R0.2 CN(C)CCCCCC=O Amb25743404 [0,2,0,0,0,0|2,0,0]=4 10498 B9R0.2 CN(C)CCCCCCBr Amb27759352 [0,2,0,0,0,0|2,0,0]=4 10499 B9R0.2 CN(C)CCCCCCCl Amb18800750 [0,2,0,0,0,0|2,0,0]=4 10500 B9R0.2 CN(C)CCCCCCN Amb2721296 [0,2,0,0,0,0|2,0,0]=4 10501 B9R0.2 CN(C)CCCCCCO Amb17613201 [0,2,0,0,0,0|2,0,0]=4 10502 B9R0.2 CN(C)CCCNCCCl Amb17334624 [0,2,0,0,0,0|2,0,0]=4 10503 B9R0.2 CN(C)CCCNCCN Amb5722657 [0,2,0,0,0,0|2,0,0]=4 10504 B9R0.2 CN(C)CCCSCCN Amb28050313 [0,2,0,0,0,0|2,0,0]=4 10505 B9R0.2 CN(C)CCNCCCF Amb28049563 [0,2,0,0,0,0|2,0,0]=4 10506 B9R0.2 CN(C)CCNCCCN Amb17315303 [0,2,0,0,0,0|2,0,0]=4 10507 B9R0.2 CN(C)CCOCCCN Amb23308391 [0,2,0,0,0,0|2,0,0]=4 10508 B9R0.2 CN(C)CCSCCCBr Amb27458103 [0,2,0,0,0,0|2,0,0]=4 10509 B9R0.2 CN(C)CCSCCCCl Amb27981147 [0,2,0,0,0,0|2,0,0]=4 10510 B9R0.2 CN(C)CCSCCCS Amb27179966 [0,2,0,0,0,0|2,0,0]=4 10511 B9R0.2 CNCCCCCC(C)=O Amb25728176 [0,2,0,0,0,0|0,0,0]=2 10512 B9R0.2 CNCCCCCC(N)=O Amb27625362 [0,2,0,0,0,0|1,0,0]=3 10513 B9R0.2 CNCCCCOC(C)C Amb27668355 [0,2,0,0,0,0|1,0,1]=4 10514 B9R0.2 CNCCCNCC(C)C Amb28193252 [0,2,0,0,0,0|1,0,1]=4 10515 B9R0.2 CNCCCSCC(C)N Amb27815759 [0,2,0,0,0,0|1,0,1]=4 10516 B9R0.2 CNCCNCC=C(C)C Amb28123457 [0,2,0,0,0,0|1,0,1]=4 10517 B9R0.2 CNCCNCCN(C)C Amb27768587 [0,2,0,0,0,0|2,0,0]=4 10518 B9R0.2 CNCCOCCC(=O)O Amb18111840 [0,2,0,0,0,0|1,0,0]=3 10519 B9R0.2 CNCCOCCC(C)=O Amb18630756 [0,2,0,0,0,0|0,0,0]=2 10520 B9R0.2 CNCCOCCC(N)=O Amb28122222 [0,2,0,0,0,0|1,0,0]=3 10521 B9R0.2 CNCCOCCS(C)=O Amb28197250 [0,2,0,0,0,0|1,0,0]=3 10522 B9R0.2 CNCCSCCC(=O)O Amb27442544 [0,2,0,0,0,0|1,0,0]=3 10523 B9R0.2 CNCCSCCC(C)N Amb27404073 [0,2,0,0,0,0|1,0,1]=4 10524 B9R0.2 CNCCSCCN(C)C Amb27837823 [0,2,0,0,0,0|2,0,0]=4 10525 B9R0.2 CNCCSCCS(C)=O Amb27856345 [0,2,0,0,0,0|1,0,0]=3 10526 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,2,0,0,0,0|1,0,0]=3 10527 B9R0.2 COCCCCCC(C)=O Amb27227265 [0,2,0,0,0,0|0,0,0]=2 10528 B9R0.2 COCCCCCC(N)=S Amb27226780 [0,2,0,0,0,0|1,1,0]=4 10529 B9R0.2 COCCCCNC(C)=O Amb27170819 [0,2,0,0,0,0|0,0,0]=2 10530 B9R0.2 COCCCCOC(C)=O Amb24325176 [0,2,0,0,0,0|0,0,0]=2 10531 B9R0.2 COCCCNCC(C)C Amb6730181 [0,2,0,0,0,0|1,0,1]=4 10532 B9R0.2 COCCCNCC(C)N Amb28281327 [0,2,0,0,0,0|1,0,1]=4 10533 B9R0.2 COCCCNCC(C)O Amb17138417 [0,2,0,0,0,0|0,0,2]=4 10534 B9R0.2 COCCCOCC(=O)O Amb25304314 [0,2,0,0,0,0|1,0,0]=3 10535 B9R0.2 COCCCOCC(C)N Amb27837579 [0,2,0,0,0,0|1,0,1]=4 10536 B9R0.2 COCCCOCC(C)O Amb27600623 [0,2,0,0,0,0|0,0,2]=4 10537 B9R0.2 COCCCOCC(N)=S Amb18792509 [0,2,0,0,0,0|1,1,0]=4 10538 B9R0.2 COCCCOC[C@@H](C)N Amb28382568 [0,2,0,0,0,0|1,0,1]=4 10539 B9R0.2 COCCCSC[C@H](C)N Amb28344655 [0,2,0,0,0,0|1,0,1]=4 10540 B9R0.2 COCCNCCC(=O)O Amb33527038 [0,2,0,0,0,0|1,0,0]=3 10541 B9R0.2 COCCNCCC(=O)O Amb7755691 [0,2,0,0,0,0|1,0,0]=3 10542 B9R0.2 COCCNCCC(C)=O Amb24473587 [0,2,0,0,0,0|0,0,0]=2 10543 B9R0.2 COCCNCCC(C)Cl Amb28369525 [0,2,0,0,0,0|1,0,1]=4 10544 B9R0.2 COCCNCCC(N)=O Amb19960056 [0,2,0,0,0,0|1,0,0]=3 10545 B9R0.2 COCCNCCC(N)=O Amb8841099 [0,2,0,0,0,0|1,0,0]=3 10546 B9R0.2 COCCNCCN(C)C Amb6714684 [0,2,0,0,0,0|2,0,0]=4 10547 B9R0.2 COCCNCCS(C)=O Amb27220298 [0,2,0,0,0,0|1,0,0]=3 10548 B9R0.2 COCCOCCC(=O)O Amb6268336 [0,2,0,0,0,0|1,0,0]=3 10549 B9R0.2 COCCOCCC(N)=O Amb28428996 [0,2,0,0,0,0|1,0,0]=3 10550 B9R0.2 COCCOCCC(N)=S Amb6276300 [0,2,0,0,0,0|1,1,0]=4 10551 B9R0.2 COCCOCCS(=O)Cl Amb32720478 [0,2,0,0,0,0|2,0,0]=4 10552 B9R0.2 COCCOCCS(=O)[O-] Amb32754578 [0,2,0,0,0,0|2,0,0]=4 10553 B9R0.2 COCCOCCS(N)=O Amb32720479 [0,2,0,0,0,0|2,0,0]=4 10554 B9R0.2 COCCOCOC(C)=O Amb28126918 [0,2,0,0,0,0|1,0,0]=3 10555 B9R0.2 COCCSCCC(C)F Amb27457248 [0,2,0,0,0,0|1,0,1]=4 10556 B9R0.2 COCCSCCS(C)=O Amb28078807 [0,2,0,0,0,0|1,0,0]=3 10557 B9R0.2 COCNCCOC(N)=O Amb28384599 [0,2,0,0,0,0|2,0,0]=4 10558 B9R0.2 COCOC\C=C\C(C)=O Amb26404277 [0,2,0,0,0,0|0,0,2]=4 10559 B9R0.2 CONCCCCN(C)C Amb27834823 [0,2,0,0,0,0|2,0,0]=4 10560 B9R0.2 CO\N=C\CCCC(C)=O Amb27267149 [0,2,0,0,0,0|0,0,1]=3 10561 B9R0.2 CS(=O)CCCCCC#N Amb24326343 [0,2,0,0,0,0|1,0,0]=3 10562 B9R0.2 CS(=O)CCCCCCO Amb27771220 [0,2,0,0,0,0|1,0,0]=3 10563 B9R0.2 CS(=O)CCCCNC=O Amb27668912 [0,2,0,0,0,0|1,0,1]=4 10564 B9R0.2 CS(=O)CCCC\C=N\O Amb22055821 [0,2,0,0,0,0|1,0,1]=4 10565 B9R0.2 CS(=O)CCNCCCBr Amb27780009 [0,2,0,0,0,0|1,0,0]=3 10566 B9R0.2 CS(=O)CCNCCCCl Amb27786049 [0,2,0,0,0,0|1,0,0]=3 10567 B9R0.2 CS(=O)CCNCCCF Amb28063397 [0,2,0,0,0,0|1,0,0]=3 10568 B9R0.2 CS(=O)CCSCCCCl Amb27653763 [0,2,0,0,0,0|1,0,0]=3 10569 B9R0.2 CS(=O)NCCCCC#N Amb28399225 [0,2,0,0,0,0|1,0,1]=4 10570 B9R0.2 CSCCCCCC(=O)O Amb27444761 [0,2,0,0,0,0|1,0,0]=3 10571 B9R0.2 CSCCCCNC(=N)N Amb27863143 [0,2,0,0,0,0|2,0,0]=4 10572 B9R0.2 CSCCCCNC(C)=O Amb28325257 [0,2,0,0,0,0|0,0,0]=2 10573 B9R0.2 CSCCCCNC(C)C Amb18798069 [0,2,0,0,0,0|1,0,1]=4 10574 B9R0.2 CSCCCCOC(C)=O Amb28041805 [0,2,0,0,0,0|0,0,0]=2 10575 B9R0.2 CSCCCNCC(=O)O Amb8827601 [0,2,0,0,0,0|1,0,0]=3 10576 B9R0.2 CSCCCNC[C@@H](C)O Amb27449650 [0,2,0,0,0,0|0,0,2]=4 10577 B9R0.2 CSCCCOCC(=O)O Amb28042679 [0,2,0,0,0,0|1,0,0]=3 10578 B9R0.2 CSCCCSCC(C)=O Amb28059012 [0,2,0,0,0,0|0,0,0]=2 10579 B9R0.2 CSCCCSCC(C)C Amb27253070 [0,2,0,0,0,0|1,0,1]=4 10580 B9R0.2 CSCCCSC[C@H](C)N Amb27482910 [0,2,0,0,0,0|1,0,1]=4 10581 B9R0.2 CSCCCSC[C@H](C)O Amb27875476 [0,2,0,0,0,0|0,0,2]=4 10582 B9R0.2 CSCCNCC=C(C)C Amb27831042 [0,2,0,0,0,0|1,0,1]=4 10583 B9R0.2 CSCCNCCC(=O)O Amb25055507 [0,2,0,0,0,0|1,0,0]=3 10584 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|1,0,1]=4 10585 B9R0.2 CSCCNCCN(C)C Amb18800678 [0,2,0,0,0,0|2,0,0]=4 10586 B9R0.2 CSCCNCCS(C)=O Amb27594101 [0,2,0,0,0,0|1,0,0]=3 10587 B9R0.2 CSCCNOCC(N)=O Amb27613925 [0,2,0,0,0,0|2,0,0]=4 10588 B9R0.2 CSCCOCCC(=N)N Amb27613566 [0,2,0,0,0,0|2,0,0]=4 10589 B9R0.2 CSSCCNCC(N)=O Amb27779657 [0,2,0,0,0,0|2,0,0]=4 10590 B9R0.2 CS\C=C\CCCC(C)=O Amb28054428 [0,2,0,0,0,0|0,0,1]=3 10591 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [0,2,0,0,0,0|0,0,2]=4 10592 B9R0.2 C[C@@H](O)CNCCCCO Amb27235176 [0,2,0,0,0,0|0,0,2]=4 10593 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [0,2,0,0,0,0|1,0,0]=3 10594 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [0,2,0,0,0,0|1,0,0]=3 10595 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [0,2,0,0,0,0|0,0,0]=2 10596 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [0,2,0,0,0,0|0,0,1]=3 10597 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [0,2,0,0,0,0|1,0,1]=4 10598 B9R0.2 C\C=C\CNCCC(N)=O Amb27251437 [0,2,0,0,0,0|1,0,1]=4 10599 B9R0.2 N#CCCCCCC(=O)O Amb18643705 [0,2,0,0,0,0|1,0,0]=3 10600 B9R0.2 N#CCCCCNC(N)=O Amb27839109 [0,2,0,0,0,0|1,0,1]=4 10601 B9R0.2 N#CCCCCSC(N)=O Amb27617974 [0,2,0,0,0,0|1,0,1]=4 10602 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,2,0,0,0,0|1,0,1]=4 10603 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [0,2,0,0,0,0|1,0,1]=4 10604 B9R0.2 N#CCCSCCC(=O)O Amb18927741 [0,2,0,0,0,0|1,0,1]=4 10605 B9R0.2 N#CCCSCCC(N)=O Amb27655950 [0,2,0,0,0,0|1,0,1]=4 10606 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [0,2,0,0,0,0|1,0,1]=4 10607 B9R0.2 N=C(N)CCSCCCO Amb28349035 [0,2,0,0,0,0|2,0,0]=4 10608 B9R0.2 N=C(N)NCCCCCN Amb25889016 [0,2,0,0,0,0|2,0,0]=4 10609 B9R0.2 N=C(N)NCCCCCO Amb19823705 [0,2,0,0,0,0|2,0,0]=4 10610 B9R0.2 N=C(N)OCCCCCN Amb27875240 [0,2,0,0,0,0|2,0,0]=4 10611 B9R0.2 N=C(N)SCCCCCF Amb27652003 [0,2,0,0,0,0|2,0,0]=4 10612 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [0,2,0,0,0,0|1,0,0]=3 10613 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [0,2,0,0,0,0|1,0,0]=3 10614 B9R0.2 NC(=O)CCCCNC=O Amb27232578 [0,2,0,0,0,0|1,0,1]=4 10615 B9R0.2 NC(=O)CCNCCCO Amb19959936 [0,2,0,0,0,0|1,0,0]=3 10616 B9R0.2 NC(=O)CCNCCCO Amb9243308 [0,2,0,0,0,0|1,0,0]=3 10617 B9R0.2 NC(=O)CCSCCCCl Amb27217057 [0,2,0,0,0,0|1,0,0]=3 10618 B9R0.2 NC(=O)CCSCCCF Amb27756832 [0,2,0,0,0,0|1,0,0]=3 10619 B9R0.2 NC(=O)CCSCCCO Amb27615089 [0,2,0,0,0,0|1,0,0]=3 10620 B9R0.2 NC(=O)CCSCCCS Amb27779781 [0,2,0,0,0,0|1,0,0]=3 10621 B9R0.2 NC(=O)COCCCCO Amb27195620 [0,2,0,0,0,0|1,0,0]=3 10622 B9R0.2 NC(=O)CONCCCO Amb27644309 [0,2,0,0,0,0|2,0,0]=4 10623 B9R0.2 NC(=O)CSCCCCCl Amb27806823 [0,2,0,0,0,0|1,0,0]=3 10624 B9R0.2 NC(=O)CSCCCCS Amb27776386 [0,2,0,0,0,0|1,0,0]=3 10625 B9R0.2 NC(=O)NCCNCCF Amb27646276 [0,2,0,0,0,0|2,0,0]=4 10626 B9R0.2 NC(=O)NCCOCCO Amb26350475 [0,2,0,0,0,0|2,0,0]=4 10627 B9R0.2 NC(=O)NOCCCCF Amb27946674 [0,2,0,0,0,0|2,0,0]=4 10628 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,2,0,0,0,0|1,0,0]=3 10629 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,2,0,0,0,0|1,0,0]=3 10630 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [0,2,0,0,0,0|1,0,0]=3 10631 B9R0.2 NCCCCCNC(=S)S Amb28076658 [0,2,0,0,0,0|1,1,0]=4 10632 B9R0.2 NCCCCCNC(N)=O Amb28120485 [0,2,0,0,0,0|1,0,0]=3 10633 B9R0.2 NCCCCNCC(=O)O Amb27800960 [0,2,0,0,0,0|1,0,0]=3 10634 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,2,0,0,0,0|1,0,0]=3 10635 B9R0.2 NCCCCSCC(N)=O Amb17500917 [0,2,0,0,0,0|1,0,0]=3 10636 B9R0.2 NCCCNCCC(=O)O Amb27959846 [0,2,0,0,0,0|1,0,0]=3 10637 B9R0.2 NCCCOCCC(=O)O Amb18111494 [0,2,0,0,0,0|1,0,0]=3 10638 B9R0.2 NCCCOCCC(N)=O Amb27412120 [0,2,0,0,0,0|1,0,0]=3 10639 B9R0.2 NCCCSCCC(=O)O Amb24496605 [0,2,0,0,0,0|1,0,0]=3 10640 B9R0.2 NCCCSCCC(N)=O Amb28077685 [0,2,0,0,0,0|1,0,0]=3 10641 B9R0.2 NCCNCCNC(=O)O Amb24069145 [0,2,0,0,0,0|2,0,0]=4 10642 B9R0.2 NCCNCCNC(N)=O Amb28122121 [0,2,0,0,0,0|2,0,0]=4 10643 B9R0.2 NCCOCCCC(=O)O Amb18111467 [0,2,0,0,0,0|1,0,0]=3 10644 B9R0.2 NCCOCCNC(N)=O Amb27758878 [0,2,0,0,0,0|2,0,0]=4 10645 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,2,0,0,0,0|1,0,0]=3 10646 B9R0.2 NCCSSCCC(=O)O Amb17608062 [0,2,0,0,0,0|2,0,0]=4 10647 B9R0.2 NOCCCCCC(=O)O Amb32708458 [0,2,0,0,0,0|1,0,0]=3 10648 B9R0.2 NOCCSCCC(N)=O Amb27475291 [0,2,0,0,0,0|2,0,0]=4 10649 B9R0.2 O=C(Cl)CCCSCCCl Amb27644536 [0,2,0,0,0,0|1,0,0]=3 10650 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [0,2,0,0,0,0|1,0,1]=4 10651 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [0,2,0,0,0,0|1,0,0]=3 10652 B9R0.2 O=C(O)C#CCCCCO Amb28050129 [0,2,0,0,0,0|1,0,1]=4 10653 B9R0.2 O=C(O)CCCC#CCO Amb27391720 [0,2,0,0,0,0|1,0,1]=4 10654 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [0,2,0,0,0,0|1,0,0]=3 10655 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [0,2,0,0,0,0|1,0,0]=3 10656 B9R0.2 O=C(O)CCCCCCF Amb25132501 [0,2,0,0,0,0|1,0,0]=3 10657 B9R0.2 O=C(O)CCCCCCO Amb9787028 [0,2,0,0,0,0|1,0,0]=3 10658 B9R0.2 O=C(O)CCCCCCS Amb24710334 [0,2,0,0,0,0|1,0,0]=3 10659 B9R0.2 O=C(O)CCCCCNBr Amb28054088 [0,2,0,0,0,0|1,0,0]=3 10660 B9R0.2 O=C(O)CCCCN=C=S Amb25685363 [0,2,0,0,0,0|1,0,1]=4 10661 B9R0.2 O=C(O)CCCC\C=C\Br Amb26542054 [0,2,0,0,0,0|1,0,1]=4 10662 B9R0.2 O=C(O)CCCNCCO Amb9333522 [0,2,0,0,0,0|1,0,0]=3 10663 B9R0.2 O=C(O)CCCOCCO Amb6680919 [0,2,0,0,0,0|1,0,0]=3 10664 B9R0.2 O=C(O)CCCSCCF Amb27614997 [0,2,0,0,0,0|1,0,0]=3 10665 B9R0.2 O=C(O)CCCSCCO Amb9481728 [0,2,0,0,0,0|1,0,0]=3 10666 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [0,2,0,0,0,0|1,0,1]=4 10667 B9R0.2 O=C(O)CCNCCCF Amb28049536 [0,2,0,0,0,0|1,0,0]=3 10668 B9R0.2 O=C(O)CCNCCCO Amb9239888 [0,2,0,0,0,0|1,0,0]=3 10669 B9R0.2 O=C(O)CCOCCCO Amb24476864 [0,2,0,0,0,0|1,0,0]=3 10670 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [0,2,0,0,0,0|1,0,0]=3 10671 B9R0.2 O=C(O)CCSCCCF Amb27251653 [0,2,0,0,0,0|1,0,0]=3 10672 B9R0.2 O=C(O)CCSSCCO Amb17615366 [0,2,0,0,0,0|2,0,0]=4 10673 B9R0.2 O=C(O)CNCCCCO Amb28063278 [0,2,0,0,0,0|1,0,0]=3 10674 B9R0.2 O=C(O)COCCCCF Amb27770553 [0,2,0,0,0,0|1,0,0]=3 10675 B9R0.2 O=C(O)COCCCCO Amb27465121 [0,2,0,0,0,0|1,0,0]=3 10676 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [0,2,0,0,0,0|1,0,0]=3 10677 B9R0.2 O=C(O)CSCCCCF Amb28062594 [0,2,0,0,0,0|1,0,0]=3 10678 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [0,2,0,0,0,0|1,0,1]=4 10679 B9R0.2 O=C=NCCCCC(=O)O Amb24505309 [0,2,0,0,0,0|1,0,1]=4 10680 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [0,2,0,0,0,0|1,0,0]=3 10681 B9R0.2 O=S([O-])CCCCCCO Amb27485557 [0,2,0,0,0,0|2,0,0]=4 10682 B9R0.2 O=[N+]([O-])CCCCCCBr Amb27870042 [0,2,0,0,0,0|2,0,0]=4 10683 B9R0.2 O=[N+]([O-])CCCCCCF Amb27882997 [0,2,0,0,0,0|2,0,0]=4 10684 B9R0.2 [N-]=[N+]=NCCCCC(=O)O Amb19516609 [0,2,0,0,0,0|2,0,0]=4 10685 B9R0.2 [N-]=[N+]=NCCCCC(N)=O Amb28239589 [0,2,0,0,0,0|2,0,0]=4 10686 B9R0.38 C#CCCCCS(C)(=O)=O Amb26877943 [0,2,0,0,0,0|1,0,1]=4 10687 B9R0.38 CC(C)(C)CCCCCBr Amb27153170 [0,2,0,0,0,0|1,0,1]=4 10688 B9R0.38 CC(C)(C)CCCCCCl Amb27247922 [0,2,0,0,0,0|1,0,1]=4 10689 B9R0.38 CC(C)(C)CCCCCN Amb28241232 [0,2,0,0,0,0|1,0,1]=4 10690 B9R0.38 CC(C)(C)CCCCCO Amb27880910 [0,2,0,0,0,0|1,0,1]=4 10691 B9R0.38 CC(C)(O)CCCCCBr Amb25737898 [0,2,0,0,0,0|0,0,2]=4 10692 B9R0.38 CC(C)(O)CCCCCN Amb27593876 [0,2,0,0,0,0|0,0,2]=4 10693 B9R0.38 CC(C)(S)CCCCCO Amb27853563 [0,2,0,0,0,0|0,1,1]=4 10694 B9R0.38 CC(F)(F)CCCCCBr Amb25309673 [0,2,0,0,0,0|1,0,1]=4 10695 B9R0.38 CC(F)(F)CCCCCCl Amb32691350 [0,2,0,0,0,0|1,0,1]=4 10696 B9R0.38 CC(F)(F)CCCCCN Amb28045023 [0,2,0,0,0,0|1,0,1]=4 10697 B9R0.38 CC(F)(F)CCCCCO Amb27827320 [0,2,0,0,0,0|1,0,1]=4 10698 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|1,0,1]=4 10699 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|1,0,1]=4 10700 B9R0.38 CCCCCCC(C)(C)N Amb26336797 [0,2,0,0,0,0|1,0,1]=4 10701 B9R0.38 CCCCCCC(C)(C)S Amb6366514 [0,2,0,0,0,0|0,1,1]=4 10702 B9R0.38 CCCCCCP(=O)(Cl)Cl Amb8516180 [0,2,0,0,0,0|2,0,0]=4 10703 B9R0.38 CCCCCCP(=O)(O)O Amb3371952 [0,2,0,0,0,0|2,0,0]=4 10704 B9R0.38 CCCCCCP(C)(C)=O Amb26515387 [0,2,0,0,0,0|1,0,0]=3 10705 B9R0.38 CCCCCCS(=O)(=O)Cl Amb2688722 [0,2,0,0,0,0|2,0,0]=4 10706 B9R0.38 CCCCCCS(=O)(=O)F Amb33352465 [0,2,0,0,0,0|2,0,0]=4 10707 B9R0.38 CCCCCCS(=O)(=O)O Amb25138206 [0,2,0,0,0,0|2,0,0]=4 10708 B9R0.38 CCCCCCS(=O)(=O)[O-] Amb6366783 [0,2,0,0,0,0|2,0,0]=4 10709 B9R0.38 CCCCCCS(=O)(=O)[O-] Amb8396881 [0,2,0,0,0,0|2,0,0]=4 10710 B9R0.38 CCCCCCS(N)(=O)=O Amb16191920 [0,2,0,0,0,0|2,0,0]=4 10711 B9R0.38 CCCCCC[N+](C)(C)[O-] Amb9825627 [0,2,0,0,0,0|1,0,1]=4 10712 B9R0.38 CCCCCC[Si](C)(C)C Amb27211083 [0,2,0,0,0,0|1,1,0]=4 10713 B9R0.38 CCCCCC[Si](C)(C)Cl Amb8515717 [0,2,0,0,0,0|1,1,0]=4 10714 B9R0.38 CCCCCC[Si](C)(Cl)Cl Amb19893899 [0,2,0,0,0,0|1,1,0]=4 10715 B9R0.38 CCCCCNS(C)(=O)=O Amb6559179 [0,2,0,0,0,0|1,0,0]=3 10716 B9R0.38 CCCCCOP(=O)(O)O Amb22168445 [0,2,0,0,0,0|2,0,0]=4 10717 B9R0.38 CCCCCOP(C)(=O)S Amb26900733 [0,2,0,0,0,0|1,0,0]=3 10718 B9R0.38 CCCCCOS(=O)(=O)[O-] Amb8517451 [0,2,0,0,0,0|2,0,0]=4 10719 B9R0.38 CCCCCOS(C)(=O)=O Amb22388766 [0,2,0,0,0,0|1,0,0]=3 10720 B9R0.38 CCCCCSC(C)(C)C Amb27487192 [0,2,0,0,0,0|1,0,1]=4 10721 B9R0.38 CCCCCSS(C)(=O)=O Amb17619183 [0,2,0,0,0,0|1,0,0]=3 10722 B9R0.38 CCCCNCC(C)(C)Br Amb27838125 [0,2,0,0,0,0|1,0,1]=4 10723 B9R0.38 CCCCNCC(C)(C)F Amb27453060 [0,2,0,0,0,0|1,0,1]=4 10724 B9R0.38 CCCCNCP(C)(=O)O Amb1776475 [0,2,0,0,0,0|1,0,0]=3 10725 B9R0.38 CCCCOCC(C)(C)N Amb17485999 [0,2,0,0,0,0|1,0,1]=4 10726 B9R0.38 CCCCSCC(C)(C)N Amb28422265 [0,2,0,0,0,0|1,0,1]=4 10727 B9R0.38 CCCCSCC(C)(C)O Amb18792455 [0,2,0,0,0,0|0,0,2]=4 10728 B9R0.38 CCCNCCC(C)(C)C Amb9204027 [0,2,0,0,0,0|1,0,1]=4 10729 B9R0.38 CCCNCCC(C)(C)N Amb27839014 [0,2,0,0,0,0|1,0,1]=4 10730 B9R0.38 CCCNCCC(C)(C)O Amb27786325 [0,2,0,0,0,0|0,0,2]=4 10731 B9R0.38 CCCNCCS(=O)(=O)F Amb33463759 [0,2,0,0,0,0|2,0,0]=4 10732 B9R0.38 CCCNCCS(=O)(=O)O Amb27866270 [0,2,0,0,0,0|2,0,0]=4 10733 B9R0.38 CCCNCCS(N)(=O)=O Amb9414108 [0,2,0,0,0,0|2,0,0]=4 10734 B9R0.38 CCCOCCS(=O)(=O)Cl Amb26986103 [0,2,0,0,0,0|2,0,0]=4 10735 B9R0.38 CCCOCCS(N)(=O)=O Amb25318135 [0,2,0,0,0,0|2,0,0]=4 10736 B9R0.38 CCCSCCC(C)(C)O Amb28254020 [0,2,0,0,0,0|0,0,2]=4 10737 B9R0.38 CCNCCCC(C)(F)F Amb28455943 [0,2,0,0,0,0|1,0,1]=4 10738 B9R0.38 CCNCCCS(=O)(=O)F Amb33463920 [0,2,0,0,0,0|2,0,0]=4 10739 B9R0.38 CCNCCC[Si](C)(C)C Amb28073939 [0,2,0,0,0,0|1,1,0]=4 10740 B9R0.38 CCNCCN=S(C)(C)=O Amb27447640 [0,2,0,0,0,0|2,0,0]=4 10741 B9R0.38 CCOCCCS(=O)(=O)Cl Amb25756682 [0,2,0,0,0,0|2,0,0]=4 10742 B9R0.38 CCOCCCS(=O)(=O)F Amb26951899 [0,2,0,0,0,0|2,0,0]=4 10743 B9R0.38 CCOCCCS(N)(=O)=O Amb24617117 [0,2,0,0,0,0|2,0,0]=4 10744 B9R0.38 CCOCCNS(C)(=O)=O Amb27797899 [0,2,0,0,0,0|2,0,0]=4 10745 B9R0.38 CCOCCOS(C)(=O)=O Amb24288665 [0,2,0,0,0,0|2,0,0]=4 10746 B9R0.38 CCSCCCC(C)(C)N Amb28313421 [0,2,0,0,0,0|1,0,1]=4 10747 B9R0.38 CNCCCCC(C)(C)O Amb17569963 [0,2,0,0,0,0|0,0,2]=4 10748 B9R0.38 CNCCCCS(=O)(=O)F Amb33463937 [0,2,0,0,0,0|2,0,0]=4 10749 B9R0.38 CNCCCCS(N)(=O)=O Amb28126742 [0,2,0,0,0,0|2,0,0]=4 10750 B9R0.38 CNCCCN=S(C)(C)=O Amb27247167 [0,2,0,0,0,0|2,0,0]=4 10751 B9R0.38 CNCCCNS(C)(=O)=O Amb9466525 [0,2,0,0,0,0|2,0,0]=4 10752 B9R0.38 COCCCCC(C)(C)N Amb17569981 [0,2,0,0,0,0|1,0,1]=4 10753 B9R0.38 COCCCCS(=O)(=O)Cl Amb26447071 [0,2,0,0,0,0|2,0,0]=4 10754 B9R0.38 COCCCCS(=O)(=O)F Amb26421601 [0,2,0,0,0,0|2,0,0]=4 10755 B9R0.38 COCCCCS(N)(=O)=O Amb25810707 [0,2,0,0,0,0|2,0,0]=4 10756 B9R0.38 COCCCNS(C)(=O)=O Amb3357773 [0,2,0,0,0,0|2,0,0]=4 10757 B9R0.38 COCCCOS(C)(=O)=O Amb28388697 [0,2,0,0,0,0|2,0,0]=4 10758 B9R0.38 CONCCCS(C)(=O)=O Amb27834163 [0,2,0,0,0,0|2,0,0]=4 10759 B9R0.38 CP(C)(=O)COCCCO Amb28350175 [0,2,0,0,0,0|2,0,0]=4 10760 B9R0.38 CS(=N)(=O)CCCCC#N Amb33620882 [0,2,0,0,0,0|1,0,1]=4 10761 B9R0.38 CS(=O)(=O)CCCCC#N Amb26546128 [0,2,0,0,0,0|1,0,1]=4 10762 B9R0.38 CS(=O)(=O)CCCCCBr Amb25091397 [0,2,0,0,0,0|1,0,0]=3 10763 B9R0.38 CS(=O)(=O)CCCCCCl Amb18319620 [0,2,0,0,0,0|1,0,0]=3 10764 B9R0.38 CS(=O)(=O)CCCCCN Amb28895974 [0,2,0,0,0,0|1,0,0]=3 10765 B9R0.38 CS(=O)(=O)CCNCCBr Amb27817156 [0,2,0,0,0,0|2,0,0]=4 10766 B9R0.38 CS(=O)(=O)CCOCCN Amb17502064 [0,2,0,0,0,0|2,0,0]=4 10767 B9R0.38 CS(=O)(=O)CCOCCN Amb19352281 [0,2,0,0,0,0|2,0,0]=4 10768 B9R0.38 CS(=O)(=O)CCSCCO Amb18324344 [0,2,0,0,0,0|2,0,0]=4 10769 B9R0.38 CS(=O)(=O)NCCCCCl Amb27982349 [0,2,0,0,0,0|2,0,0]=4 10770 B9R0.38 CS(=O)(=O)NCCCCF Amb28248456 [0,2,0,0,0,0|2,0,0]=4 10771 B9R0.38 CS(=O)(=O)NCCCCO Amb17103035 [0,2,0,0,0,0|2,0,0]=4 10772 B9R0.38 CS(=O)(=O)OCCCCCl Amb21964961 [0,2,0,0,0,0|2,0,0]=4 10773 B9R0.38 CS(=O)(=O)OCCCCO Amb24524699 [0,2,0,0,0,0|2,0,0]=4 10774 B9R0.38 CS(C)(=O)=NCCCCN Amb27217001 [0,2,0,0,0,0|2,0,0]=4 10775 B9R0.38 CSCCCCC(C)(C)N Amb33198294 [0,2,0,0,0,0|1,0,1]=4 10776 B9R0.38 CSCCCCS(C)(=O)=O Amb28049770 [0,2,0,0,0,0|1,0,0]=3 10777 B9R0.38 CSCCCOS(C)(=O)=O Amb24074532 [0,2,0,0,0,0|2,0,0]=4 10778 B9R0.38 C[N+](C)(C)CCCCCO Amb27980112 [0,2,0,0,0,0|2,0,0]=4 10779 B9R0.38 C[S@](=N)(=O)CCCCC#N Amb33743812 [0,2,0,0,0,0|1,0,1]=4 10780 B9R0.38 C[Si](C)(C)CCCCCN Amb27487341 [0,2,0,0,0,0|1,1,0]=4 10781 B9R0.38 C[Si](C)(C)CCCCCO Amb28350371 [0,2,0,0,0,0|1,1,0]=4 10782 B9R0.38 NCCCCCS(=O)(=O)F Amb33463767 [0,2,0,0,0,0|2,0,0]=4 10783 B9R0.38 NCCCCCS(=O)(=O)O Amb28325598 [0,2,0,0,0,0|2,0,0]=4 10784 B9R0.38 NS(=O)(=O)CCCCCF Amb24593996 [0,2,0,0,0,0|2,0,0]=4 10785 B9R0.38 O=S(=O)(Cl)CCCCCBr Amb24505264 [0,2,0,0,0,0|2,0,0]=4 10786 B9R0.38 O=S(=O)(Cl)CCCCCCl Amb18062652 [0,2,0,0,0,0|2,0,0]=4 10787 B9R0.38 O=S(=O)(Cl)CCCCCF Amb27154799 [0,2,0,0,0,0|2,0,0]=4 10788 B9R0.38 O=S(=O)(Cl)CCCCCO Amb28282606 [0,2,0,0,0,0|2,0,0]=4 10789 B9R0.38 O=S(=O)(F)CCCCCBr Amb32719031 [0,2,0,0,0,0|2,0,0]=4 10790 B9R0.38 [C-]#[N+]CCCCS(C)(=O)=O Amb33053756 [0,2,0,0,0,0|1,0,1]=4 10791 B9R0.48 C#CCC(O)CCC(=C)C Amb27652985 [0,2,0,0,0,0|1,0,1]=4 10792 B9R0.48 C#CCN(C)CCC(C)=O Amb27750362 [0,2,0,0,0,0|0,0,2]=4 10793 B9R0.48 C=C(Br)CNC(C)CCC Amb27410926 [0,2,0,0,0,0|1,0,1]=4 10794 B9R0.48 C=C(C)C#CC(Br)CCC Amb27849702 [0,2,0,0,0,0|1,0,1]=4 10795 B9R0.48 C=C(C)C#CC(Cl)CCC Amb27232747 [0,2,0,0,0,0|1,0,1]=4 10796 B9R0.48 C=C(C)CCC(=O)CCN Amb27467366 [0,2,0,0,0,0|1,0,1]=4 10797 B9R0.48 C=C(C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|1,0,1]=4 10798 B9R0.48 C=C(C)CCC(Br)C#CC Amb27617163 [0,2,0,0,0,0|1,0,1]=4 10799 B9R0.48 C=C(C)CCC(O)CCC Amb27424964 [0,2,0,0,0,0|1,0,0]=3 10800 B9R0.48 C=C(C)CCC(O)COC Amb28043414 [0,2,0,0,0,0|1,0,0]=3 10801 B9R0.48 C=C(C)CNS(=O)CCC Amb28324094 [0,2,0,0,0,0|2,0,0]=4 10802 B9R0.48 C=C(C)COC(=O)CCC Amb27805708 [0,2,0,0,0,0|1,0,1]=4 10803 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|1,0,0]=3 10804 B9R0.48 C=C(COC(C)=O)OCC Amb28050232 [0,2,0,0,0,0|1,0,1]=4 10805 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,2,0,0,0,0|1,0,1]=4 10806 B9R0.48 C=CCC(N)CCC(=C)C Amb28056992 [0,2,0,0,0,0|1,0,1]=4 10807 B9R0.48 C=CCC(O)CCC(C)=O Amb28194573 [0,2,0,0,0,0|0,0,1]=3 10808 B9R0.48 C=CC[C@@H](O)CCC(C)=O Amb28386579 [0,2,0,0,0,0|0,0,1]=3 10809 B9R0.48 CC(=O)CCC(C)CC=O Amb28199726 [0,2,0,0,0,0|0,0,1]=3 10810 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [0,2,0,0,0,0|0,0,0]=2 10811 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,2,0,0,0,0|0,0,1]=3 10812 B9R0.48 CC(=O)CC[C@@H](C)CCO Amb27944575 [0,2,0,0,0,0|0,0,0]=2 10813 B9R0.48 CC(=O)CC[C@H](C)CC=O Amb27255456 [0,2,0,0,0,0|0,0,1]=3 10814 B9R0.48 CC(=O)CSC(C)CCO Amb27875971 [0,2,0,0,0,0|1,0,0]=3 10815 B9R0.48 CC(=O)NCC(C)CCBr Amb27851099 [0,2,0,0,0,0|1,0,0]=3 10816 B9R0.48 CC(=O)NCC(C)CCCl Amb27162325 [0,2,0,0,0,0|1,0,0]=3 10817 B9R0.48 CC(=O)NCC(C)CCO Amb28364911 [0,2,0,0,0,0|1,0,0]=3 10818 B9R0.48 CC(=O)OCC(C)CC=O Amb18644137 [0,2,0,0,0,0|1,0,1]=4 10819 B9R0.48 CC(=O)OCC(Cl)CC#N Amb28458495 [0,2,0,0,0,0|1,0,1]=4 10820 B9R0.48 CC(=O)OC[C@H](C)CCO Amb27753095 [0,2,0,0,0,0|1,0,0]=3 10821 B9R0.48 CC(C)CCC(F)CCN Amb27436790 [0,2,0,0,0,0|1,0,1]=4 10822 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|1,0,1]=4 10823 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|1,0,1]=4 10824 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,2,0,0,0,0|1,0,0]=3 10825 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,2,0,0,0,0|1,0,0]=3 10826 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,2,0,0,0,0|1,0,0]=3 10827 B9R0.48 CC(CCN)CCN(C)C Amb26652169 [0,2,0,0,0,0|2,0,0]=4 10828 B9R0.48 CC(CCN)CNC(N)=O Amb27455693 [0,2,0,0,0,0|2,0,0]=4 10829 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,2,0,0,0,0|2,0,0]=4 10830 B9R0.48 CC(CCN)SCC(N)=O Amb27234451 [0,2,0,0,0,0|2,0,0]=4 10831 B9R0.48 CC(CCO)CCN(C)C Amb27839328 [0,2,0,0,0,0|2,0,0]=4 10832 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|2,0,0]=4 10833 B9R0.48 CC(CCO)NCC(N)=O Amb27857723 [0,2,0,0,0,0|2,0,0]=4 10834 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,2,0,0,0,0|1,0,0]=3 10835 B9R0.48 CC(CCS)CCN(C)C Amb28049588 [0,2,0,0,0,0|2,0,0]=4 10836 B9R0.48 CCCC(=O)CCC(C)=O Amb2721037 [0,2,0,0,0,0|0,0,0]=2 10837 B9R0.48 CCCC(=O)CCC(C)C Amb9031590 [0,2,0,0,0,0|1,0,1]=4 10838 B9R0.48 CCCC(=O)CCC(C)N Amb27866591 [0,2,0,0,0,0|1,0,1]=4 10839 B9R0.48 CCCC(=O)CCN(C)C Amb28422505 [0,2,0,0,0,0|2,0,0]=4 10840 B9R0.48 CCCC(=O)COC(C)=O Amb28437151 [0,2,0,0,0,0|0,0,1]=3 10841 B9R0.48 CCCC(=O)NCC(=O)O Amb5741675 [0,2,0,0,0,0|1,0,1]=4 10842 B9R0.48 CCCC(=O)NCC(N)=O Amb17231980 [0,2,0,0,0,0|1,0,1]=4 10843 B9R0.48 CCCC(=O)NNC(C)=O Amb28453795 [0,2,0,0,0,0|1,0,1]=4 10844 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,2,0,0,0,0|1,0,1]=4 10845 B9R0.48 CCCC(=O)OCC(C)=O Amb28350457 [0,2,0,0,0,0|0,0,1]=3 10846 B9R0.48 CCCC(=O)SCC(=O)O Amb27400351 [0,2,0,0,0,0|1,0,1]=4 10847 B9R0.48 CCCC(Br)CCC(C)C Amb28063055 [0,2,0,0,0,0|1,0,1]=4 10848 B9R0.48 CCCC(Br)CNC(C)=O Amb28146730 [0,2,0,0,0,0|0,0,0]=2 10849 B9R0.48 CCCC(Br)\C=C\C(C)=O Amb27463361 [0,2,0,0,0,0|0,0,1]=3 10850 B9R0.48 CCCC(C)C#CC(=O)O Amb27981033 [0,2,0,0,0,0|1,0,1]=4 10851 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|1,0,0]=3 10852 B9R0.48 CCCC(C)CCC(C)=O Amb10807385 [0,2,0,0,0,0|0,0,0]=2 10853 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|1,0,1]=4 10854 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|0,0,2]=4 10855 B9R0.48 CCCC(C)CC[C@@H](C)N Amb33223658 [0,2,0,0,0,0|1,0,1]=4 10856 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|0,0,2]=4 10857 B9R0.48 CCCC(C)CC[C@H](C)N Amb33321143 [0,2,0,0,0,0|1,0,1]=4 10858 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|0,0,2]=4 10859 B9R0.48 CCCC(C)CC[N+](=O)[O-] Amb33321108 [0,2,0,0,0,0|2,0,0]=4 10860 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,2,0,0,0,0|0,0,0]=2 10861 B9R0.48 CCCC(C)COC(C)Cl Amb32715992 [0,2,0,0,0,0|1,0,1]=4 10862 B9R0.48 CCCC(C)NC[C@H](C)O Amb27442940 [0,2,0,0,0,0|0,0,2]=4 10863 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|1,0,0]=3 10864 B9R0.48 CCCC(C)OCC(C)=O Amb27444940 [0,2,0,0,0,0|0,0,0]=2 10865 B9R0.48 CCCC(C)OCC(C)N Amb28077537 [0,2,0,0,0,0|1,0,1]=4 10866 B9R0.48 CCCC(C)OC[C@H](C)N Amb27424873 [0,2,0,0,0,0|1,0,1]=4 10867 B9R0.48 CCCC(C)OC[C@H](C)O Amb27424875 [0,2,0,0,0,0|0,0,2]=4 10868 B9R0.48 CCCC(C)SCC(C)=O Amb28280192 [0,2,0,0,0,0|0,0,0]=2 10869 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [0,2,0,0,0,0|1,0,1]=4 10870 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,2,0,0,0,0|0,0,1]=3 10871 B9R0.48 CCCC(Cl)CCC(=O)Cl Amb27831367 [0,2,0,0,0,0|1,0,0]=3 10872 B9R0.48 CCCC(Cl)OCC(C)C Amb28050900 [0,2,0,0,0,0|1,0,1]=4 10873 B9R0.48 CCCC(N)C#CC(=O)O Amb33168957 [0,2,0,0,0,0|1,0,1]=4 10874 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,2,0,0,0,0|1,0,0]=3 10875 B9R0.48 CCCC(N)CCN(C)C Amb18202388 [0,2,0,0,0,0|2,0,0]=4 10876 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,2,0,0,0,0|1,0,0]=3 10877 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [0,2,0,0,0,0|1,0,0]=3 10878 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [0,2,0,0,0,0|1,0,0]=3 10879 B9R0.48 CCCC(O)CCC(C)C Amb27971606 [0,2,0,0,0,0|1,0,1]=4 10880 B9R0.48 CCCC(O)CNS(C)=O Amb27257176 [0,2,0,0,0,0|1,0,0]=3 10881 B9R0.48 CCCC(O)COC(C)=O Amb27945320 [0,2,0,0,0,0|0,0,0]=2 10882 B9R0.48 CCCC(O)\C=C\C(=O)O Amb27790698 [0,2,0,0,0,0|1,0,1]=4 10883 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [0,2,0,0,0,0|1,0,0]=3 10884 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [0,2,0,0,0,0|1,0,0]=3 10885 B9R0.48 CCCN(C)CCC(C)Br Amb27224607 [0,2,0,0,0,0|1,0,1]=4 10886 B9R0.48 CCCN(C)CCC(C)Cl Amb28186132 [0,2,0,0,0,0|1,0,1]=4 10887 B9R0.48 CCCN(C)CCC(N)=O Amb27454732 [0,2,0,0,0,0|1,0,0]=3 10888 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [0,2,0,0,0,0|1,0,0]=3 10889 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [0,2,0,0,0,0|1,0,0]=3 10890 B9R0.48 CCCS(=O)NCC(N)=O Amb27613567 [0,2,0,0,0,0|2,0,0]=4 10891 B9R0.48 CCC[C@@H](N)CCC(C)C Amb28050311 [0,2,0,0,0,0|1,0,1]=4 10892 B9R0.48 CCC[C@@H](N)COC(C)C Amb27983968 [0,2,0,0,0,0|1,0,1]=4 10893 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,2,0,0,0,0|1,0,0]=3 10894 B9R0.48 CCC[C@@H](O)\C=C\C(=O)O Amb27961045 [0,2,0,0,0,0|1,0,1]=4 10895 B9R0.48 CCC[C@@H](O)\C=C\S(C)=O Amb27833711 [0,2,0,0,0,0|1,0,1]=4 10896 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|1,0,0]=3 10897 B9R0.48 CCC[C@H](N)COC(C)C Amb27613605 [0,2,0,0,0,0|1,0,1]=4 10898 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,2,0,0,0,0|1,0,0]=3 10899 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [0,2,0,0,0,0|1,0,0]=3 10900 B9R0.48 CCC\C(N)=N\OC(C)=O Amb24532437 [0,2,0,0,0,0|1,0,1]=4 10901 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,1]=4 10902 B9R0.48 CCNC(=O)CCC(C)=O Amb17334212 [0,2,0,0,0,0|0,0,1]=3 10903 B9R0.48 CCNC(=O)CCC(N)=O Amb17142864 [0,2,0,0,0,0|1,0,1]=4 10904 B9R0.48 CCNC(=O)NCC(C)=O Amb28194385 [0,2,0,0,0,0|1,0,1]=4 10905 B9R0.48 CCNC(=O)OCC(C)=O Amb27660754 [0,2,0,0,0,0|1,0,1]=4 10906 B9R0.48 CCNC(C)CCC(C)C Amb6256330 [0,2,0,0,0,0|1,0,1]=4 10907 B9R0.48 CCNC(C)CCN(C)C Amb27843211 [0,2,0,0,0,0|2,0,0]=4 10908 B9R0.48 CCN[C@@H](C)CNC(C)=O Amb28137826 [0,2,0,0,0,0|1,0,0]=3 10909 B9R0.48 CCN[C@@H](C)CNS(C)=O Amb28063025 [0,2,0,0,0,0|2,0,0]=4 10910 B9R0.48 CCN[C@H](C)CNC(C)=O Amb27267319 [0,2,0,0,0,0|1,0,0]=3 10911 B9R0.48 CCN[C@H](C)CNS(C)=O Amb28399486 [0,2,0,0,0,0|2,0,0]=4 10912 B9R0.48 CCOC(=O)CCC(=O)Cl Amb3939960 [0,2,0,0,0,0|1,0,1]=4 10913 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 10914 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,2,0,0,0,0|0,0,1]=3 10915 B9R0.48 CCOC(=O)CCC(N)=O Amb8997750 [0,2,0,0,0,0|1,0,1]=4 10916 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,2,0,0,0,0|1,0,1]=4 10917 B9R0.48 CCOC(=O)CNC(C)=O Amb33534694 [0,2,0,0,0,0|1,0,1]=4 10918 B9R0.48 CCOC(=S)SCC(C)=O Amb17872265 [0,2,0,0,0,0|1,0,1]=4 10919 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,2,0,0,0,0|1,0,0]=3 10920 B9R0.48 CCOC(C)CCC(C)=O Amb27859467 [0,2,0,0,0,0|0,0,0]=2 10921 B9R0.48 CCOC(C)CCC(C)N Amb33425314 [0,2,0,0,0,0|1,0,1]=4 10922 B9R0.48 CCOC(C)CCC(C)O Amb33425313 [0,2,0,0,0,0|0,0,2]=4 10923 B9R0.48 CCOC(C)CC[C@@H](C)N Amb33425309 [0,2,0,0,0,0|1,0,1]=4 10924 B9R0.48 CCOC(C)CC[C@@H](C)O Amb33425310 [0,2,0,0,0,0|0,0,2]=4 10925 B9R0.48 CCOC(C)CC[C@H](C)N Amb33425066 [0,2,0,0,0,0|1,0,1]=4 10926 B9R0.48 CCOC(C)CC[C@H](C)O Amb33425312 [0,2,0,0,0,0|0,0,2]=4 10927 B9R0.48 CCOC(C)CC[N+](=O)[O-] Amb33425046 [0,2,0,0,0,0|2,0,0]=4 10928 B9R0.48 CCOC(C)CNC(C)=O Amb27174342 [0,2,0,0,0,0|1,0,0]=3 10929 B9R0.48 CCOC(C)COC(C)=O Amb25959518 [0,2,0,0,0,0|1,0,0]=3 10930 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|2,0,0]=4 10931 B9R0.48 CCOC(C)\C=C\C(C)=O Amb33424994 [0,2,0,0,0,0|0,0,2]=4 10932 B9R0.48 CCOC(Cl)CCN(C)C Amb27407026 [0,2,0,0,0,0|2,0,0]=4 10933 B9R0.48 CCO\C(C)=C\CC(C)=O Amb27630467 [0,2,0,0,0,0|0,0,2]=4 10934 B9R0.48 CCSC(=O)CCC(C)=O Amb28253786 [0,2,0,0,0,0|0,0,1]=3 10935 B9R0.48 CCSC(=O)CNC(C)=O Amb25146289 [0,2,0,0,0,0|1,0,1]=4 10936 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|1,0,1]=4 10937 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,2,0,0,0,0|0,0,1]=3 10938 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|1,0,1]=4 10939 B9R0.48 CN(C)CCC(F)CCN Amb33272263 [0,2,0,0,0,0|2,0,0]=4 10940 B9R0.48 CN(C)CCC(N)CCO Amb33273735 [0,2,0,0,0,0|2,0,0]=4 10941 B9R0.48 CN(C)CCC(O)CCN Amb33272654 [0,2,0,0,0,0|2,0,0]=4 10942 B9R0.48 CN(C)CC[C@@H](O)CCN Amb33272264 [0,2,0,0,0,0|2,0,0]=4 10943 B9R0.48 CN(C)CC[C@H](O)CCN Amb33272265 [0,2,0,0,0,0|2,0,0]=4 10944 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [0,2,0,0,0,0|2,0,0]=4 10945 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,2,0,0,0,0|2,0,0]=4 10946 B9R0.48 CN(CCO)CCC(=O)Cl Amb17142907 [0,2,0,0,0,0|2,0,0]=4 10947 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [0,2,0,0,0,0|2,0,0]=4 10948 B9R0.48 CN(CCO)CCC(N)=O Amb17142868 [0,2,0,0,0,0|2,0,0]=4 10949 B9R0.48 CNCC(C)CNC(N)=O Amb28049490 [0,2,0,0,0,0|2,0,0]=4 10950 B9R0.48 CNCC(O)CCN(C)C Amb26326850 [0,2,0,0,0,0|2,0,0]=4 10951 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,2,0,0,0,0|1,0,0]=3 10952 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,2,0,0,0,0|1,0,1]=4 10953 B9R0.48 COCC(=O)COC(C)=O Amb27599018 [0,2,0,0,0,0|1,0,1]=4 10954 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|2,0,0]=4 10955 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|2,0,0]=4 10956 B9R0.48 COCC(C)NNC(C)=O Amb27254986 [0,2,0,0,0,0|2,0,0]=4 10957 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|2,0,0]=4 10958 B9R0.48 COCC(C)OCC(C)=O Amb27632346 [0,2,0,0,0,0|1,0,0]=3 10959 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [0,2,0,0,0,0|1,0,0]=3 10960 B9R0.48 COCC(Cl)CNC(C)=O Amb28049466 [0,2,0,0,0,0|1,0,0]=3 10961 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [0,2,0,0,0,0|1,0,0]=3 10962 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [0,2,0,0,0,0|1,0,0]=3 10963 B9R0.48 COCC(O)CCC(C)C Amb27625588 [0,2,0,0,0,0|1,0,1]=4 10964 B9R0.48 COCC(O)CCN(C)C Amb28049409 [0,2,0,0,0,0|2,0,0]=4 10965 B9R0.48 COC[C@@H](O)CNC(C)=O Amb27663283 [0,2,0,0,0,0|1,0,0]=3 10966 B9R0.48 CO\N=C(/C)CCC(C)=O Amb24583507 [0,2,0,0,0,0|1,0,1]=4 10967 B9R0.48 CSCC(C)NCC(N)=O Amb27865220 [0,2,0,0,0,0|2,0,0]=4 10968 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [0,2,0,0,0,0|1,0,0]=3 10969 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [0,2,0,0,0,0|1,0,0]=3 10970 B9R0.48 CSSC(C)CCC(=O)O Amb27843301 [0,2,0,0,0,0|2,0,0]=4 10971 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,2,0,0,0,0|1,0,1]=4 10972 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,2,0,0,0,0|1,0,0]=3 10973 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [0,2,0,0,0,0|0,0,1]=3 10974 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [0,2,0,0,0,0|0,0,1]=3 10975 B9R0.48 C\C=C\C(O)CNC(C)=O Amb24480779 [0,2,0,0,0,0|0,0,2]=4 10976 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [0,2,0,0,0,0|1,0,0]=3 10977 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [0,2,0,0,0,0|1,0,0]=3 10978 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [0,2,0,0,0,0|1,0,0]=3 10979 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [0,2,0,0,0,0|1,0,0]=3 10980 B9R0.55 C=C(Br)CCCCC(N)=O Amb27449194 [0,2,0,0,0,0|1,0,1]=4 10981 B9R0.55 C=C(Br)CSCCC(C)C Amb27254768 [0,2,0,0,0,0|1,0,1]=4 10982 B9R0.55 C=C(C)C#CCCC(C)C Amb2721457 [0,2,0,0,0,0|1,0,1]=4 10983 B9R0.55 C=C(C)CCCCC(C)O Amb27590791 [0,2,0,0,0,0|1,0,0]=3 10984 B9R0.55 C=C(C)CCCNC(C)C Amb27806611 [0,2,0,0,0,0|1,0,0]=3 10985 B9R0.55 C=C(C)CCNCC(N)=O Amb27615175 [0,2,0,0,0,0|1,0,1]=4 10986 B9R0.55 C=C(C)CCNC[C@@H](C)O Amb27232911 [0,2,0,0,0,0|1,0,0]=3 10987 B9R0.55 C=C(C)CCOCC(C)=O Amb28318908 [0,2,0,0,0,0|0,0,1]=3 10988 B9R0.55 C=C(C)CCOCC(N)=O Amb28282201 [0,2,0,0,0,0|1,0,1]=4 10989 B9R0.55 C=C(C)CCONC(C)=O Amb28072263 [0,2,0,0,0,0|1,0,1]=4 10990 B9R0.55 C=C(C)CCSCC(C)=O Amb27469207 [0,2,0,0,0,0|0,0,1]=3 10991 B9R0.55 C=C(C)CNCCC(F)F Amb28049766 [0,2,0,0,0,0|2,0,0]=4 10992 B9R0.55 C=C(C)CNCCN(C)C Amb17309047 [0,2,0,0,0,0|2,0,0]=4 10993 B9R0.55 C=C(C)COCCC(=O)O Amb27882463 [0,2,0,0,0,0|1,0,1]=4 10994 B9R0.55 C=C(C)COCCC(C)O Amb28315218 [0,2,0,0,0,0|1,0,0]=3 10995 B9R0.55 C=C(C)CSCCN(C)C Amb21983415 [0,2,0,0,0,0|2,0,0]=4 10996 B9R0.55 C=C(C)\C=C\CCC(C)=O Amb26484309 [0,2,0,0,0,0|0,0,2]=4 10997 B9R0.55 C=C(Cl)CNCCC(C)C Amb18800600 [0,2,0,0,0,0|1,0,1]=4 10998 B9R0.55 C=C(F)CCCCC(=O)O Amb27949889 [0,2,0,0,0,0|1,0,1]=4 10999 B9R0.55 C=C(F)CCCOC(C)=O Amb22641472 [0,2,0,0,0,0|0,0,2]=4 11000 B9R0.55 CC(=N)NCCCC(C)C Amb27260700 [0,2,0,0,0,0|1,0,0]=3 11001 B9R0.55 CC(=N)NCCCC(C)N Amb27252018 [0,2,0,0,0,0|1,0,0]=3 11002 B9R0.55 CC(=O)CCCC=C(C)C Amb28053965 [0,2,0,0,0,0|0,0,1]=3 11003 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [0,2,0,0,0,0|0,0,1]=3 11004 B9R0.55 CC(=O)CCCCC(C)=O Amb17593600 [0,2,0,0,0,0|0,0,0]=2 11005 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [0,2,0,0,0,0|0,0,0]=2 11006 B9R0.55 CC(=O)CCCCC(Cl)Cl Amb27392324 [0,2,0,0,0,0|0,0,0]=2 11007 B9R0.55 CC(=O)CCCCN(C)C Amb9659130 [0,2,0,0,0,0|0,0,0]=2 11008 B9R0.55 CC(=O)CCCCS(C)=O Amb27412643 [0,2,0,0,0,0|0,0,0]=2 11009 B9R0.55 CC(=O)CCCNC(C)=O Amb28194645 [0,2,0,0,0,0|0,0,1]=3 11010 B9R0.55 CC(=O)CCCNC(C)C Amb27856985 [0,2,0,0,0,0|0,0,0]=2 11011 B9R0.55 CC(=O)CCCNS(C)=O Amb27774835 [0,2,0,0,0,0|1,0,0]=3 11012 B9R0.55 CC(=O)CCCOC(C)=O Amb1033031 [0,2,0,0,0,0|0,0,1]=3 11013 B9R0.55 CC(=O)CCCOC(C)C Amb9659686 [0,2,0,0,0,0|0,0,0]=2 11014 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,2,0,0,0,0|1,0,1]=4 11015 B9R0.55 CC(=O)CCNCC(C)C Amb26410166 [0,2,0,0,0,0|0,0,0]=2 11016 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,2,0,0,0,0|1,0,1]=4 11017 B9R0.55 CC(=O)CCOCC(C)C Amb7764634 [0,2,0,0,0,0|0,0,0]=2 11018 B9R0.55 CC(=O)CCSCC(=O)O Amb24443138 [0,2,0,0,0,0|1,0,1]=4 11019 B9R0.55 CC(=O)CCSCC(C)C Amb9283499 [0,2,0,0,0,0|0,0,0]=2 11020 B9R0.55 CC(=O)COCC=C(C)C Amb27951594 [0,2,0,0,0,0|0,0,2]=4 11021 B9R0.55 CC(=O)CSCC=C(C)C Amb28340640 [0,2,0,0,0,0|0,0,2]=4 11022 B9R0.55 CC(=O)CSCCC(C)C Amb27614926 [0,2,0,0,0,0|0,0,0]=2 11023 B9R0.55 CC(=O)CSCCC(F)F Amb27958686 [0,2,0,0,0,0|1,0,0]=3 11024 B9R0.55 CC(=O)CSCCC(N)=S Amb17503258 [0,2,0,0,0,0|1,0,1]=4 11025 B9R0.55 CC(=O)CSCCN(C)C Amb27485248 [0,2,0,0,0,0|1,0,0]=3 11026 B9R0.55 CC(=O)NCCCC(=N)N Amb27461138 [0,2,0,0,0,0|1,0,1]=4 11027 B9R0.55 CC(=O)NCCCC(=O)O Amb2778749 [0,2,0,0,0,0|1,0,1]=4 11028 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [0,2,0,0,0,0|0,0,0]=2 11029 B9R0.55 CC(=O)NCCCN(C)C Amb3358094 [0,2,0,0,0,0|1,0,0]=3 11030 B9R0.55 CC(=O)NCCCS(C)=O Amb27786571 [0,2,0,0,0,0|1,0,0]=3 11031 B9R0.55 CC(=O)NCCNC(C)=O Amb2522644 [0,2,0,0,0,0|1,0,1]=4 11032 B9R0.55 CC(=O)NCCNC(C)C Amb6732592 [0,2,0,0,0,0|1,0,0]=3 11033 B9R0.55 CC(=O)NCCOC(C)=O Amb2781669 [0,2,0,0,0,0|1,0,1]=4 11034 B9R0.55 CC(=O)NCOCC(C)C Amb28199237 [0,2,0,0,0,0|1,0,0]=3 11035 B9R0.55 CC(=O)OCC#CC(C)O Amb27757366 [0,2,0,0,0,0|0,0,2]=4 11036 B9R0.55 CC(=O)OCCCC(=O)O Amb24480808 [0,2,0,0,0,0|1,0,1]=4 11037 B9R0.55 CC(=O)OCCCC(C)Br Amb27643403 [0,2,0,0,0,0|0,0,0]=2 11038 B9R0.55 CC(=O)OCCCC(C)Cl Amb27645429 [0,2,0,0,0,0|0,0,0]=2 11039 B9R0.55 CC(=O)OCCCS(=O)Cl Amb32720405 [0,2,0,0,0,0|2,0,0]=4 11040 B9R0.55 CC(=O)OCCCS(=O)[O-] Amb32754824 [0,2,0,0,0,0|2,0,0]=4 11041 B9R0.55 CC(=O)OCCCS(N)=O Amb32720406 [0,2,0,0,0,0|2,0,0]=4 11042 B9R0.55 CC(=O)OCCC[C@@H](C)O Amb27775430 [0,2,0,0,0,0|0,0,0]=2 11043 B9R0.55 CC(=O)OCCNC(C)C Amb28344226 [0,2,0,0,0,0|1,0,0]=3 11044 B9R0.55 CC(=O)OCCOC(C)=O Amb8513772 [0,2,0,0,0,0|1,0,1]=4 11045 B9R0.55 CC(=O)OCCOC(C)C Amb25662885 [0,2,0,0,0,0|1,0,0]=3 11046 B9R0.55 CC(=O)OCCOC(C)Cl Amb27433920 [0,2,0,0,0,0|1,0,0]=3 11047 B9R0.55 CC(=O)SCCCC(=O)O Amb26356321 [0,2,0,0,0,0|1,0,1]=4 11048 B9R0.55 CC(=O)\C=C/NCC(C)C Amb26887251 [0,2,0,0,0,0|0,0,2]=4 11049 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [0,2,0,0,0,0|0,0,1]=3 11050 B9R0.55 CC(=O)\C=C\CCN(C)C Amb33271941 [0,2,0,0,0,0|0,0,2]=4 11051 B9R0.55 CC(=O)\C=C\COC(C)C Amb33274083 [0,2,0,0,0,0|0,0,2]=4 11052 B9R0.55 CC(=O)\C=C\NCC(C)C Amb25961808 [0,2,0,0,0,0|0,0,2]=4 11053 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [0,2,0,0,0,0|1,0,0]=3 11054 B9R0.55 CC(C)=C=CCCC(C)N Amb27473338 [0,2,0,0,0,0|1,0,1]=4 11055 B9R0.55 CC(C)=CCCCC(N)=O Amb27390535 [0,2,0,0,0,0|1,0,1]=4 11056 B9R0.55 CC(C)=CCNCC(C)Cl Amb27620237 [0,2,0,0,0,0|1,0,1]=4 11057 B9R0.55 CC(C)=CCOCC(C)O Amb27839572 [0,2,0,0,0,0|1,0,1]=4 11058 B9R0.55 CC(C)=COCCC(C)O Amb28281210 [0,2,0,0,0,0|1,0,1]=4 11059 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,2,0,0,0,0|1,0,1]=4 11060 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [0,2,0,0,0,0|1,0,1]=4 11061 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [0,2,0,0,0,0|1,0,0]=3 11062 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,2,0,0,0,0|1,0,0]=3 11063 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|1,0,1]=4 11064 B9R0.55 CC(C)CCCCC(C)N Amb27830700 [0,2,0,0,0,0|1,0,1]=4 11065 B9R0.55 CC(C)CCCCC(N)=O Amb2613088 [0,2,0,0,0,0|1,0,0]=3 11066 B9R0.55 CC(C)CCCCC(O)O Amb27761556 [0,2,0,0,0,0|1,0,1]=4 11067 B9R0.55 CC(C)CCCC[C@@H](C)N Amb33731285 [0,2,0,0,0,0|1,0,1]=4 11068 B9R0.55 CC(C)CCCC[C@H](C)N Amb33729329 [0,2,0,0,0,0|1,0,1]=4 11069 B9R0.55 CC(C)CCCNC(=N)N Amb27784893 [0,2,0,0,0,0|2,0,0]=4 11070 B9R0.55 CC(C)CCCNC(C)C Amb9214744 [0,2,0,0,0,0|1,0,1]=4 11071 B9R0.55 CC(C)CCCOC(=O)Cl Amb25885760 [0,2,0,0,0,0|1,0,0]=3 11072 B9R0.55 CC(C)CCCOC(C)Cl Amb32716000 [0,2,0,0,0,0|1,0,1]=4 11073 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,2,0,0,0,0|1,0,0]=3 11074 B9R0.55 CC(C)CCNCC(C)C Amb6692732 [0,2,0,0,0,0|1,0,1]=4 11075 B9R0.55 CC(C)CCNCC(N)=O Amb1112311 [0,2,0,0,0,0|1,0,0]=3 11076 B9R0.55 CC(C)CCNC[C@@H](C)O Amb27812132 [0,2,0,0,0,0|0,0,2]=4 11077 B9R0.55 CC(C)CCOCC(=O)Cl Amb27441228 [0,2,0,0,0,0|1,0,0]=3 11078 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,2,0,0,0,0|1,0,0]=3 11079 B9R0.55 CC(C)CCOCC(C)N Amb6661416 [0,2,0,0,0,0|1,0,1]=4 11080 B9R0.55 CC(C)CCOCC(N)=S Amb6262163 [0,2,0,0,0,0|1,1,0]=4 11081 B9R0.55 CC(C)CCOC[C@@H](C)O Amb28145728 [0,2,0,0,0,0|0,0,2]=4 11082 B9R0.55 CC(C)CCOC[C@H](C)N Amb28255350 [0,2,0,0,0,0|1,0,1]=4 11083 B9R0.55 CC(C)CCONC(N)=O Amb2899786 [0,2,0,0,0,0|2,0,0]=4 11084 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,2,0,0,0,0|1,0,0]=3 11085 B9R0.55 CC(C)CCSCC(C)N Amb28128185 [0,2,0,0,0,0|1,0,1]=4 11086 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [0,2,0,0,0,0|1,0,1]=4 11087 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,2,0,0,0,0|1,0,0]=3 11088 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,2,0,0,0,0|1,0,0]=3 11089 B9R0.55 CC(C)CNCCC(C)Cl Amb28256358 [0,2,0,0,0,0|1,0,1]=4 11090 B9R0.55 CC(C)CNCCC(N)=S Amb17232337 [0,2,0,0,0,0|1,1,0]=4 11091 B9R0.55 CC(C)CNCCN(C)C Amb1114677 [0,2,0,0,0,0|2,0,0]=4 11092 B9R0.55 CC(C)CNCC[C@@H](C)N Amb27216669 [0,2,0,0,0,0|1,0,1]=4 11093 B9R0.55 CC(C)CNCC[C@H](C)N Amb27804036 [0,2,0,0,0,0|1,0,1]=4 11094 B9R0.55 CC(C)COCCC(=N)N Amb6267452 [0,2,0,0,0,0|2,0,0]=4 11095 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,2,0,0,0,0|1,0,0]=3 11096 B9R0.55 CC(C)COCCC(N)=O Amb27463674 [0,2,0,0,0,0|1,0,0]=3 11097 B9R0.55 CC(C)COCCC(N)=S Amb6265253 [0,2,0,0,0,0|1,1,0]=4 11098 B9R0.55 CC(C)COCCN(C)C Amb27755711 [0,2,0,0,0,0|2,0,0]=4 11099 B9R0.55 CC(C)CSCCC(=N)N Amb7787496 [0,2,0,0,0,0|2,0,0]=4 11100 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,2,0,0,0,0|1,0,0]=3 11101 B9R0.55 CC(C)CSCCC(C)F Amb27484345 [0,2,0,0,0,0|1,0,1]=4 11102 B9R0.55 CC(C)CSCCC(N)=S Amb17503256 [0,2,0,0,0,0|1,1,0]=4 11103 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,2,0,0,0,0|2,0,0]=4 11104 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,2,0,0,0,0|1,0,0]=3 11105 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,2,0,0,0,0|1,0,0]=3 11106 B9R0.55 CC(C)NCCCN(C)C Amb6699320 [0,2,0,0,0,0|2,0,0]=4 11107 B9R0.55 CC(C)OCCCC(=N)N Amb6270622 [0,2,0,0,0,0|2,0,0]=4 11108 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,2,0,0,0,0|1,0,0]=3 11109 B9R0.55 CC(C)OCCC[C@@H](C)N Amb33274414 [0,2,0,0,0,0|1,0,1]=4 11110 B9R0.55 CC(C)OCCC[C@@H](C)O Amb33274398 [0,2,0,0,0,0|0,0,2]=4 11111 B9R0.55 CC(C)OCCC[C@H](C)N Amb33274369 [0,2,0,0,0,0|1,0,1]=4 11112 B9R0.55 CC(C)OCCC[C@H](C)O Amb33274415 [0,2,0,0,0,0|0,0,2]=4 11113 B9R0.55 CC(C)OCCC[N+](=O)[O-] Amb33274120 [0,2,0,0,0,0|2,0,0]=4 11114 B9R0.55 CC(C)OCCOC(=O)Cl Amb24465716 [0,2,0,0,0,0|2,0,0]=4 11115 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,2,0,0,0,0|2,0,0]=4 11116 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,2,0,0,0,0|2,0,0]=4 11117 B9R0.55 CC(C)ONCCS(C)=O Amb27795989 [0,2,0,0,0,0|2,0,0]=4 11118 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,2,0,0,0,0|1,0,0]=3 11119 B9R0.55 CC(C)SCCCN(C)C Amb27632204 [0,2,0,0,0,0|2,0,0]=4 11120 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,2,0,0,0,0|1,0,1]=4 11121 B9R0.55 CC(Cl)CCCCS(C)=O Amb28142480 [0,2,0,0,0,0|1,0,0]=3 11122 B9R0.55 CC(Cl)CCCNC(C)C Amb27754177 [0,2,0,0,0,0|1,0,1]=4 11123 B9R0.55 CC(Cl)CCCOC(C)C Amb18800871 [0,2,0,0,0,0|1,0,1]=4 11124 B9R0.55 CC(Cl)CCCSC(C)C Amb27830878 [0,2,0,0,0,0|1,0,1]=4 11125 B9R0.55 CC(Cl)CNCCN(C)C Amb28457955 [0,2,0,0,0,0|2,0,0]=4 11126 B9R0.55 CC(Cl)CNCCS(C)=O Amb27776246 [0,2,0,0,0,0|1,0,0]=3 11127 B9R0.55 CC(Cl)CSCCN(C)C Amb27478039 [0,2,0,0,0,0|2,0,0]=4 11128 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [0,2,0,0,0,0|1,0,0]=3 11129 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [0,2,0,0,0,0|1,0,0]=3 11130 B9R0.55 CC(N)CCC#CC(=O)O Amb33169012 [0,2,0,0,0,0|1,0,1]=4 11131 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [0,2,0,0,0,0|1,0,0]=3 11132 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [0,2,0,0,0,0|1,0,0]=3 11133 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [0,2,0,0,0,0|1,0,0]=3 11134 B9R0.55 CC(N)CCCCN(C)C Amb25978464 [0,2,0,0,0,0|1,0,1]=4 11135 B9R0.55 CC(N)CCCOC(C)C Amb26867093 [0,2,0,0,0,0|1,0,1]=4 11136 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [0,2,0,0,0,0|1,0,0]=3 11137 B9R0.55 CC(N)CCSCC(C)N Amb27771520 [0,2,0,0,0,0|1,0,1]=4 11138 B9R0.55 CC(N)CCSCC(C)O Amb27975275 [0,2,0,0,0,0|0,0,2]=4 11139 B9R0.55 CC(O)CCCCC(C)O Amb27839243 [0,2,0,0,0,0|0,0,2]=4 11140 B9R0.55 CC(O)CCCCN(C)C Amb24271124 [0,2,0,0,0,0|0,0,2]=4 11141 B9R0.55 CC(O)CCCCS(C)=O Amb28197304 [0,2,0,0,0,0|1,0,0]=3 11142 B9R0.55 CC(O)CCCOC(C)C Amb24450979 [0,2,0,0,0,0|0,0,2]=4 11143 B9R0.55 CC(O)CCCSC(C)C Amb27472017 [0,2,0,0,0,0|0,0,2]=4 11144 B9R0.55 CC(O)CCNCC(C)O Amb28382659 [0,2,0,0,0,0|0,0,2]=4 11145 B9R0.55 CC(O)CNCCN(C)C Amb5722654 [0,2,0,0,0,0|2,0,0]=4 11146 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [0,2,0,0,0,0|1,0,0]=3 11147 B9R0.55 CC(O)CSCCC(N)=O Amb27976132 [0,2,0,0,0,0|1,0,0]=3 11148 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,2,0,0,0,0|1,0,1]=4 11149 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [0,2,0,0,0,0|1,0,0]=3 11150 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [0,2,0,0,0,0|1,0,0]=3 11151 B9R0.55 CN(C)CCCCN(C)C Amb8513509 [0,2,0,0,0,0|2,0,0]=4 11152 B9R0.55 CN(C)CCCCS(=O)[O-] Amb32755795 [0,2,0,0,0,0|2,0,0]=4 11153 B9R0.55 CN(C)CCCC[N+](=O)[O-] Amb33271978 [0,2,0,0,0,0|2,0,0]=4 11154 B9R0.55 CN(C)CCCNC(=O)S Amb27823578 [0,2,0,0,0,0|2,0,0]=4 11155 B9R0.55 CN(C)CCCNC(N)=O Amb1125203 [0,2,0,0,0,0|2,0,0]=4 11156 B9R0.55 CN(C)CCCNC(N)=O Amb33552022 [0,2,0,0,0,0|2,0,0]=4 11157 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,2,0,0,0,0|2,0,0]=4 11158 B9R0.55 CN(C)CCOCC(=O)O Amb20667765 [0,2,0,0,0,0|2,0,0]=4 11159 B9R0.55 CN(C)CCOCC(=O)O Amb22059502 [0,2,0,0,0,0|2,0,0]=4 11160 B9R0.55 CN(C)CCSCC(=O)O Amb1138164 [0,2,0,0,0,0|2,0,0]=4 11161 B9R0.55 CN(C)CCSCC(=O)O Amb33329916 [0,2,0,0,0,0|2,0,0]=4 11162 B9R0.55 CP(C)CCCCP(C)C Amb28072921 [0,2,0,0,0,0|2,0,0]=4 11163 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [0,2,0,0,0,0|1,0,0]=3 11164 B9R0.55 CS(=O)CCNCC(F)F Amb28189772 [0,2,0,0,0,0|2,0,0]=4 11165 B9R0.55 CS(=O)CCNCC(N)=O Amb28140353 [0,2,0,0,0,0|2,0,0]=4 11166 B9R0.55 CS(=O)CCSCC(=O)O Amb27236300 [0,2,0,0,0,0|2,0,0]=4 11167 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [0,2,0,0,0,0|1,0,0]=3 11168 B9R0.55 C[C@@H](N)CCCCN(C)C Amb33272251 [0,2,0,0,0,0|1,0,1]=4 11169 B9R0.55 C[C@@H](O)CCCCN(C)C Amb33272253 [0,2,0,0,0,0|0,0,2]=4 11170 B9R0.55 C[C@@H](O)CSCCC(N)=O Amb27795743 [0,2,0,0,0,0|1,0,0]=3 11171 B9R0.55 C[C@H](N)CCCCN(C)C Amb33272250 [0,2,0,0,0,0|1,0,1]=4 11172 B9R0.55 C[C@H](N)CSCCC(N)=O Amb28367266 [0,2,0,0,0,0|1,0,0]=3 11173 B9R0.55 C[C@H](N)CSCCN(C)C Amb27852712 [0,2,0,0,0,0|2,0,0]=4 11174 B9R0.55 C[C@H](O)CCCCN(C)C Amb33272255 [0,2,0,0,0,0|0,0,2]=4 11175 B9R0.55 C[C@H](O)CNCCC(N)=O Amb27464472 [0,2,0,0,0,0|1,0,0]=3 11176 B9R0.55 C[C@H](O)CSCCC(N)=O Amb28195669 [0,2,0,0,0,0|1,0,0]=3 11177 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [0,2,0,0,0,0|1,0,1]=4 11178 B9R0.55 C\C(N)=N/CCCC(C)O Amb27399139 [0,2,0,0,0,0|1,0,0]=3 11179 B9R0.55 NC(=O)CCCCC(=O)O Amb9391119 [0,2,0,0,0,0|1,0,1]=4 11180 B9R0.55 NC(=O)CCCCC(N)=O Amb2793081 [0,2,0,0,0,0|1,0,1]=4 11181 B9R0.55 NC(=O)CNCCC(F)F Amb27255949 [0,2,0,0,0,0|2,0,0]=4 11182 B9R0.55 O=C(Cl)CCCCC(=O)Cl Amb3940243 [0,2,0,0,0,0|1,0,1]=4 11183 B9R0.55 O=C(O)CCCCC(=O)Cl Amb27614847 [0,2,0,0,0,0|1,0,1]=4 11184 B9R0.55 O=C(O)CCCCC(=O)O Amb22167453 [0,2,0,0,0,0|1,0,1]=4 11185 B9R0.55 O=C(O)CCCCC(=O)O Amb22336279 [0,2,0,0,0,0|1,0,1]=4 11186 B9R0.55 O=C(O)CCCCC(=O)O Amb2793031 [0,2,0,0,0,0|1,0,1]=4 11187 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [0,2,0,0,0,0|1,0,0]=3 11188 B9R0.55 O=C(O)CCCCN(F)F Amb27985922 [0,2,0,0,0,0|2,0,0]=4 11189 B9R0.55 O=C(O)CCCOC(F)F Amb27861059 [0,2,0,0,0,0|2,0,0]=4 11190 B9R0.55 O=C(O)CCOCC(F)F Amb26539468 [0,2,0,0,0,0|2,0,0]=4 11191 B9R0.55 O=C(O)COCCC(F)F Amb27848670 [0,2,0,0,0,0|2,0,0]=4 11192 B9R0.55 O=C([O-])CCCCC(=O)[O-] Amb22168121 [0,2,0,0,0,0|1,0,1]=4 11193 B9R0.3 CCCCC(C)C(C)(C)O Amb28204142 [0,2,0,0,0,0|0,0,2]=4 11194 B9R0.3 CCCCC(C)S(=O)(=O)Cl Amb18324731 [0,2,0,0,0,0|2,0,0]=4 11195 B9R0.3 CCCCC(C)S(=O)(=O)F Amb32717744 [0,2,0,0,0,0|2,0,0]=4 11196 B9R0.3 CCCCC(C)S(N)(=O)=O Amb18183522 [0,2,0,0,0,0|2,0,0]=4 11197 B9R0.3 CCCCC(N)C(C)(C)O Amb33214880 [0,2,0,0,0,0|0,0,2]=4 11198 B9R0.3 CCCCC(N)P(C)(=O)O Amb27863006 [0,2,0,0,0,0|1,0,0]=3 11199 B9R0.3 CCCCC(N)S(=O)(=O)O Amb27229977 [0,2,0,0,0,0|2,0,0]=4 11200 B9R0.3 CCCCC(O)C(C)(C)C Amb4020070 [0,2,0,0,0,0|1,0,1]=4 11201 B9R0.3 CCCCC(O)C(C)(C)O Amb27839540 [0,2,0,0,0,0|0,0,2]=4 11202 B9R0.3 CCCCC(O)P(=O)(O)O Amb25356317 [0,2,0,0,0,0|2,0,0]=4 11203 B9R0.3 CCCC[C@@H](N)C(C)(C)C Amb27390793 [0,2,0,0,0,0|1,0,1]=4 11204 B9R0.3 CCCC[C@H](O)C(C)(C)O Amb27427097 [0,2,0,0,0,0|0,0,2]=4 11205 B9R0.3 CCNCC(C)S(C)(=O)=O Amb27968614 [0,2,0,0,0,0|2,0,0]=4 11206 B9R0.7 C=C(C)C(=O)CCC(C)=O Amb28202297 [0,2,0,0,0,0|0,0,2]=4 11207 B9R0.7 C=C(C)C(=O)CCC(C)N Amb27765418 [0,2,0,0,0,0|1,0,1]=4 11208 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [0,2,0,0,0,0|1,0,1]=4 11209 B9R0.7 C=C(C)C(Cl)CCC(C)C Amb27402118 [0,2,0,0,0,0|1,0,0]=3 11210 B9R0.7 C=C(C)C(Cl)COC(C)=O Amb28137880 [0,2,0,0,0,0|1,0,1]=4 11211 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,2,0,0,0,0|1,0,1]=4 11212 B9R0.7 C=C(C)C(N)CCN(C)C Amb27855433 [0,2,0,0,0,0|2,0,0]=4 11213 B9R0.7 C=C(C)C(N)CSC(C)C Amb27828261 [0,2,0,0,0,0|2,0,0]=4 11214 B9R0.7 C=C(C)C(O)CCN(C)C Amb27613278 [0,2,0,0,0,0|2,0,0]=4 11215 B9R0.7 C=C(C)C(O)COC(C)=O Amb27170291 [0,2,0,0,0,0|1,0,1]=4 11216 B9R0.7 C=C(C)C(O)COC(C)C Amb28126844 [0,2,0,0,0,0|2,0,0]=4 11217 B9R0.7 C=C(C)CCC(=O)C(C)C Amb9031731 [0,2,0,0,0,0|1,0,1]=4 11218 B9R0.7 C=C(C)CCC(=O)C(C)N Amb28046434 [0,2,0,0,0,0|1,0,1]=4 11219 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,2,0,0,0,0|1,0,1]=4 11220 B9R0.7 C=C(C)CCC(C)C(C)=O Amb27753284 [0,2,0,0,0,0|0,0,1]=3 11221 B9R0.7 C=C(C)CCC(C)C(C)N Amb27948974 [0,2,0,0,0,0|1,0,0]=3 11222 B9R0.7 C=C(C)CCC(C)C(C)O Amb26940424 [0,2,0,0,0,0|1,0,0]=3 11223 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,2,0,0,0,0|1,0,1]=4 11224 B9R0.7 C=C(C)CCC(N)C(F)F Amb28144516 [0,2,0,0,0,0|2,0,0]=4 11225 B9R0.7 C=C(C)CCC(N)C(N)=O Amb27188568 [0,2,0,0,0,0|1,0,1]=4 11226 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,2,0,0,0,0|1,0,1]=4 11227 B9R0.7 C=C(C)CCC(O)C(C)C Amb27171665 [0,2,0,0,0,0|1,0,0]=3 11228 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,2,0,0,0,0|1,0,1]=4 11229 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,2,0,0,0,0|1,0,1]=4 11230 B9R0.7 C=C(C)CNC(C)C(C)O Amb27597773 [0,2,0,0,0,0|2,0,0]=4 11231 B9R0.7 C=C(C)COC(C)C(C)=O Amb27476278 [0,2,0,0,0,0|1,0,1]=4 11232 B9R0.7 C=C(C)CSC(C)C(C)=O Amb28381627 [0,2,0,0,0,0|1,0,1]=4 11233 B9R0.7 C=C(C)[C@@H](C)CCC(C)=O Amb24583145 [0,2,0,0,0,0|0,0,1]=3 11234 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,2,0,0,0,0|1,0,1]=4 11235 B9R0.7 C=C(CCC(C)=O)C(C)=O Amb25303019 [0,2,0,0,0,0|0,0,2]=4 11236 B9R0.7 CC(=O)C#CC(O)C(C)C Amb27858338 [0,2,0,0,0,0|0,0,2]=4 11237 B9R0.7 CC(=O)C(=O)NCC(C)C Amb17399879 [0,2,0,0,0,0|1,0,1]=4 11238 B9R0.7 CC(=O)C(=O)NCC(C)O Amb27197014 [0,2,0,0,0,0|1,0,1]=4 11239 B9R0.7 CC(=O)C(=O)OCC(C)C Amb28254557 [0,2,0,0,0,0|1,0,1]=4 11240 B9R0.7 CC(=O)C(Br)CC=C(C)C Amb27614912 [0,2,0,0,0,0|0,0,2]=4 11241 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [0,2,0,0,0,0|1,0,1]=4 11242 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [0,2,0,0,0,0|0,0,0]=2 11243 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,2,0,0,0,0|1,0,1]=4 11244 B9R0.7 CC(=O)C(C)CCN(C)C Amb27470904 [0,2,0,0,0,0|1,0,0]=3 11245 B9R0.7 CC(=O)C(C)CCS(C)=O Amb27783563 [0,2,0,0,0,0|1,0,0]=3 11246 B9R0.7 CC(=O)C(C)CNN(C)C Amb28049906 [0,2,0,0,0,0|2,0,0]=4 11247 B9R0.7 CC(=O)C(C)NCC(C)C Amb24480697 [0,2,0,0,0,0|1,0,0]=3 11248 B9R0.7 CC(=O)C(C)OCC(C)C Amb9665195 [0,2,0,0,0,0|1,0,0]=3 11249 B9R0.7 CC(=O)C(C)SCC(C)O Amb27651284 [0,2,0,0,0,0|1,0,0]=3 11250 B9R0.7 CC(=O)C(F)CC=C(C)C Amb27599420 [0,2,0,0,0,0|0,0,2]=4 11251 B9R0.7 CC(=O)C(F)CCC(=O)O Amb27620074 [0,2,0,0,0,0|1,0,1]=4 11252 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,2,0,0,0,0|1,0,1]=4 11253 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [0,2,0,0,0,0|1,0,1]=4 11254 B9R0.7 CC(=O)C(O)COC(C)C Amb28201134 [0,2,0,0,0,0|1,0,0]=3 11255 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,2,0,0,0,0|0,0,2]=4 11256 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,2,0,0,0,0|0,0,1]=3 11257 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,2,0,0,0,0|1,0,1]=4 11258 B9R0.7 CC(=O)CCC(C)=C(C)C Amb27799949 [0,2,0,0,0,0|0,0,2]=4 11259 B9R0.7 CC(=O)CCC(C)C(C)O Amb27838958 [0,2,0,0,0,0|0,0,0]=2 11260 B9R0.7 CC(=O)CCC(Cl)C(C)=O Amb27444965 [0,2,0,0,0,0|0,0,1]=3 11261 B9R0.7 CC(=O)CCC(Cl)C(C)C Amb27974244 [0,2,0,0,0,0|0,0,0]=2 11262 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,2,0,0,0,0|1,0,1]=4 11263 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,2,0,0,0,0|1,0,1]=4 11264 B9R0.7 CC(=O)CCC(N)C(N)=O Amb26649117 [0,2,0,0,0,0|1,0,1]=4 11265 B9R0.7 CC(=O)CCN(C)C(C)C Amb7777312 [0,2,0,0,0,0|1,0,0]=3 11266 B9R0.7 CC(=O)CC[C@@H](C)[C@@H](C)O Amb25984868 [0,2,0,0,0,0|0,0,0]=2 11267 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,2,0,0,0,0|1,0,1]=4 11268 B9R0.7 CC(=O)CC[C@H](C)C(C)C Amb27860337 [0,2,0,0,0,0|0,0,0]=2 11269 B9R0.7 CC(=O)CC[C@H](C)[C@@H](C)O Amb22747043 [0,2,0,0,0,0|0,0,0]=2 11270 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,2,0,0,0,0|1,0,1]=4 11271 B9R0.7 CC(=O)CNC(=O)C(C)Cl Amb26363906 [0,2,0,0,0,0|1,0,1]=4 11272 B9R0.7 CC(=O)CNS(=O)C(C)C Amb28194716 [0,2,0,0,0,0|2,0,0]=4 11273 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,2,0,0,0,0|1,0,1]=4 11274 B9R0.7 CC(=O)COC(C)C(C)C Amb27837849 [0,2,0,0,0,0|1,0,0]=3 11275 B9R0.7 CC(=O)CSC(C)C(C)C Amb27166652 [0,2,0,0,0,0|1,0,0]=3 11276 B9R0.7 CC(=O)CSC(C)C(C)O Amb28344436 [0,2,0,0,0,0|1,0,0]=3 11277 B9R0.7 CC(=O)C\C=C(/C)C(C)C Amb24725292 [0,2,0,0,0,0|0,0,2]=4 11278 B9R0.7 CC(=O)C\C=C(\C)C(C)C Amb24408897 [0,2,0,0,0,0|0,0,2]=4 11279 B9R0.7 CC(=O)N(C)CCC(C)Br Amb27393471 [0,2,0,0,0,0|1,0,0]=3 11280 B9R0.7 CC(=O)NCC(C)S(C)=O Amb28137643 [0,2,0,0,0,0|2,0,0]=4 11281 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,2,0,0,0,0|1,0,1]=4 11282 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [0,2,0,0,0,0|1,0,1]=4 11283 B9R0.7 CC(=O)OCC(N)C(C)C Amb27604557 [0,2,0,0,0,0|1,0,0]=3 11284 B9R0.7 CC(=O)OC[C@H](Br)C(C)C Amb28186618 [0,2,0,0,0,0|1,0,0]=3 11285 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [0,2,0,0,0,0|1,0,1]=4 11286 B9R0.7 CC(=O)OC[C@H](N)C(C)C Amb28401299 [0,2,0,0,0,0|1,0,0]=3 11287 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,2,0,0,0,0|1,0,1]=4 11288 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [0,2,0,0,0,0|1,0,1]=4 11289 B9R0.7 CC(=O)\C(C)=N\CC(C)O Amb27434278 [0,2,0,0,0,0|1,0,1]=4 11290 B9R0.7 CC(=O)\C=C\[C@H](C)C(C)C Amb27859468 [0,2,0,0,0,0|0,0,2]=4 11291 B9R0.7 CC(C)=CCC(C)C(C)O Amb28381787 [0,2,0,0,0,0|1,0,1]=4 11292 B9R0.7 CC(C)=CCC(N)C(C)C Amb30029404 [0,2,0,0,0,0|1,0,1]=4 11293 B9R0.7 CC(C)C(C)CNC(=O)Cl Amb35633392 [0,2,0,0,0,0|2,0,0]=4 11294 B9R0.7 CC(C)C(C)COC(N)=O Amb27174302 [0,2,0,0,0,0|2,0,0]=4 11295 B9R0.7 CC(C)C(C)OCC(N)=O Amb27837847 [0,2,0,0,0,0|2,0,0]=4 11296 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,2,0,0,0,0|1,0,0]=3 11297 B9R0.7 CC(C)C(N)CCS(C)=O Amb27222830 [0,2,0,0,0,0|1,0,0]=3 11298 B9R0.7 CC(C)C(N)CNC(N)=O Amb27832804 [0,2,0,0,0,0|2,0,0]=4 11299 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,2,0,0,0,0|1,0,0]=3 11300 B9R0.7 CC(C)C(O)CCN(C)C Amb28049411 [0,2,0,0,0,0|2,0,0]=4 11301 B9R0.7 CC(C)C(O)CC[C@@H](C)O Amb27213851 [0,2,0,0,0,0|0,0,2]=4 11302 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,2,0,0,0,0|1,0,1]=4 11303 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,2,0,0,0,0|1,0,0]=3 11304 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,2,0,0,0,0|1,0,0]=3 11305 B9R0.7 CC(C)CCC(C)C(C)Cl Amb18183502 [0,2,0,0,0,0|1,0,1]=4 11306 B9R0.7 CC(C)CCC(C)C(C)O Amb25262988 [0,2,0,0,0,0|0,0,2]=4 11307 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,2,0,0,0,0|1,0,0]=3 11308 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [0,2,0,0,0,0|1,0,0]=3 11309 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,2,0,0,0,0|1,0,0]=3 11310 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,2,0,0,0,0|1,0,0]=3 11311 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [0,2,0,0,0,0|1,0,0]=3 11312 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,2,0,0,0,0|1,0,0]=3 11313 B9R0.7 CC(C)CCC(O)C(C)C Amb22228388 [0,2,0,0,0,0|1,0,1]=4 11314 B9R0.7 CC(C)CCC(O)C(C)N Amb27444287 [0,2,0,0,0,0|1,0,1]=4 11315 B9R0.7 CC(C)CCN(C)C(=O)Cl Amb27617143 [0,2,0,0,0,0|2,0,0]=4 11316 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,2,0,0,0,0|1,0,0]=3 11317 B9R0.7 CC(C)CC[C@@H](Cl)C(=O)Cl Amb27164122 [0,2,0,0,0,0|1,0,0]=3 11318 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,2,0,0,0,0|1,0,0]=3 11319 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,2,0,0,0,0|1,0,0]=3 11320 B9R0.7 CC(C)CC[C@@H](N)C(C)C Amb28130207 [0,2,0,0,0,0|1,0,1]=4 11321 B9R0.7 CC(C)CC[C@@H](O)C(=O)[O-] Amb27218868 [0,2,0,0,0,0|1,0,0]=3 11322 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,2,0,0,0,0|1,0,0]=3 11323 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,2,0,0,0,0|1,0,0]=3 11324 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,2,0,0,0,0|1,0,0]=3 11325 B9R0.7 CC(C)CC[C@H](N)[C@H](C)O Amb28119956 [0,2,0,0,0,0|0,0,2]=4 11326 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,2,0,0,0,0|2,0,0]=4 11327 B9R0.7 CC(C)CNC(C)C(N)=O Amb9203289 [0,2,0,0,0,0|2,0,0]=4 11328 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,2,0,0,0,0|2,0,0]=4 11329 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,2,0,0,0,0|2,0,0]=4 11330 B9R0.7 CC(C)COC(C)C(N)=O Amb19960054 [0,2,0,0,0,0|2,0,0]=4 11331 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,2,0,0,0,0|2,0,0]=4 11332 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,2,0,0,0,0|2,0,0]=4 11333 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,2,0,0,0,0|2,0,0]=4 11334 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,2,0,0,0,0|2,0,0]=4 11335 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,2,0,0,0,0|2,0,0]=4 11336 B9R0.7 CC(C)NCC(C)C(N)=O Amb8944544 [0,2,0,0,0,0|2,0,0]=4 11337 B9R0.7 CC(C)NCC(C)S(C)=O Amb27474158 [0,2,0,0,0,0|2,0,0]=4 11338 B9R0.7 CC(C)NCC(N)C(N)=O Amb27812569 [0,2,0,0,0,0|2,0,0]=4 11339 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,2,0,0,0,0|2,0,0]=4 11340 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,2,0,0,0,0|2,0,0]=4 11341 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,2,0,0,0,0|2,0,0]=4 11342 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,2,0,0,0,0|2,0,0]=4 11343 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,2,0,0,0,0|2,0,0]=4 11344 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,2,0,0,0,0|2,0,0]=4 11345 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,2,0,0,0,0|2,0,0]=4 11346 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,2,0,0,0,0|2,0,0]=4 11347 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,2,0,0,0,0|2,0,0]=4 11348 B9R0.7 CC(C)OC[C@H](N)C(N)=O Amb27184033 [0,2,0,0,0,0|2,0,0]=4 11349 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,2,0,0,0,0|2,0,0]=4 11350 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,2,0,0,0,0|1,0,0]=3 11351 B9R0.7 CC(C)[C@@H](O)CC[C@@H](C)O Amb28455603 [0,2,0,0,0,0|0,0,2]=4 11352 B9R0.7 CC(C)[C@H](O)CC[C@@H](C)O Amb28079178 [0,2,0,0,0,0|0,0,2]=4 11353 B9R0.7 CC(CCC(=O)O)N(C)C Amb32654401 [0,2,0,0,0,0|2,0,0]=4 11354 B9R0.7 CC(CCC(=O)O)N(C)C Amb8010013 [0,2,0,0,0,0|2,0,0]=4 11355 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [0,2,0,0,0,0|2,0,0]=4 11356 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [0,2,0,0,0,0|2,0,0]=4 11357 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [0,2,0,0,0,0|2,0,0]=4 11358 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [0,2,0,0,0,0|2,0,0]=4 11359 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,2,0,0,0,0|1,0,1]=4 11360 B9R0.7 CC(Cl)CCC(C)N(C)C Amb27201320 [0,2,0,0,0,0|2,0,0]=4 11361 B9R0.7 CC(F)C(N)CCC(=O)O Amb27207659 [0,2,0,0,0,0|1,0,0]=3 11362 B9R0.7 CC(N)C(C)CCS(C)=O Amb27785304 [0,2,0,0,0,0|1,0,0]=3 11363 B9R0.7 CC(N)C(O)CCC(=O)O Amb27881667 [0,2,0,0,0,0|1,0,0]=3 11364 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [0,2,0,0,0,0|1,0,0]=3 11365 B9R0.7 CC(N)CCN(C)C(N)=O Amb27643169 [0,2,0,0,0,0|2,0,0]=4 11366 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,2,0,0,0,0|2,0,0]=4 11367 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,2,0,0,0,0|2,0,0]=4 11368 B9R0.7 CC(NC[C@H](C)O)C(N)=O Amb27596825 [0,2,0,0,0,0|2,0,0]=4 11369 B9R0.7 CC(O)C(C)CCC(=O)O Amb27424805 [0,2,0,0,0,0|1,0,0]=3 11370 B9R0.7 CC(O)C(C)NCC(=O)O Amb27444950 [0,2,0,0,0,0|2,0,0]=4 11371 B9R0.7 CC(O)C(C)NCC(N)=O Amb27476355 [0,2,0,0,0,0|2,0,0]=4 11372 B9R0.7 CC(O)C(O)CCC(N)=O Amb28146727 [0,2,0,0,0,0|1,0,0]=3 11373 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,2,0,0,0,0|1,0,1]=4 11374 B9R0.7 CC(O)CCC(C)C(C)O Amb28044350 [0,2,0,0,0,0|0,0,2]=4 11375 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,2,0,0,0,0|1,0,0]=3 11376 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [0,2,0,0,0,0|1,0,0]=3 11377 B9R0.7 CC(O)CC[C@@H](C)[C@H](C)O Amb27213872 [0,2,0,0,0,0|0,0,2]=4 11378 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,2,0,0,0,0|1,0,0]=3 11379 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,2,0,0,0,0|1,0,0]=3 11380 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,2,0,0,0,0|2,0,0]=4 11381 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,2,0,0,0,0|2,0,0]=4 11382 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,2,0,0,0,0|2,0,0]=4 11383 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,2,0,0,0,0|2,0,0]=4 11384 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [0,2,0,0,0,0|2,0,0]=4 11385 B9R0.7 CN(C)CCC(F)C(=O)O Amb27959150 [0,2,0,0,0,0|2,0,0]=4 11386 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [0,2,0,0,0,0|2,0,0]=4 11387 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [0,2,0,0,0,0|2,0,0]=4 11388 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [0,2,0,0,0,0|2,0,0]=4 11389 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [0,2,0,0,0,0|2,0,0]=4 11390 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [0,2,0,0,0,0|2,0,0]=4 11391 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [0,2,0,0,0,0|2,0,0]=4 11392 B9R0.7 CN(C)CC[C@H](N)C(N)=O Amb28364893 [0,2,0,0,0,0|2,0,0]=4 11393 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [0,2,0,0,0,0|2,0,0]=4 11394 B9R0.7 CS(=N)CCC(N)C(=O)O Amb25243030 [0,2,0,0,0,0|2,0,0]=4 11395 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,2,0,0,0,0|2,0,0]=4 11396 B9R0.7 CS(=O)CCC(N)C(N)=O Amb25869966 [0,2,0,0,0,0|2,0,0]=4 11397 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [0,2,0,0,0,0|2,0,0]=4 11398 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,2,0,0,0,0|2,0,0]=4 11399 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,2,0,0,0,0|2,0,0]=4 11400 B9R0.7 C[C@@H](F)[C@@H](N)CCC(=O)O Amb27604296 [0,2,0,0,0,0|1,0,0]=3 11401 B9R0.7 C[C@@H](F)[C@H](O)CCC(=O)O Amb28256347 [0,2,0,0,0,0|1,0,0]=3 11402 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [0,2,0,0,0,0|1,0,0]=3 11403 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,2,0,0,0,0|2,0,0]=4 11404 B9R0.7 C[C@@H](N)[C@@H](O)CCC(=O)O Amb27655533 [0,2,0,0,0,0|1,0,0]=3 11405 B9R0.7 C[C@@H](O)[C@H](O)CCC(=O)O Amb27628876 [0,2,0,0,0,0|1,0,0]=3 11406 B9R0.7 C[C@H](F)[C@H](O)CCC(=O)O Amb28126864 [0,2,0,0,0,0|1,0,0]=3 11407 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,2,0,0,0,0|2,0,0]=4 11408 B9R0.7 C[C@H](O)[C@H](N)CCC(=O)O Amb27217393 [0,2,0,0,0,0|1,0,0]=3 11409 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [0,2,0,0,0,0|2,0,0]=4 11410 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [0,2,0,0,0,0|2,0,0]=4 11411 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [0,2,0,0,0,0|2,0,0]=4 11412 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [0,2,0,0,0,0|2,0,0]=4 11413 B9R0.7 C[S+](C)CCC(O)C(=O)[O-] Amb28069582 [0,2,0,0,0,0|2,0,0]=4 11414 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [0,2,0,0,0,0|2,0,0]=4 11415 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [0,2,0,0,0,0|2,0,0]=4 11416 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [0,2,0,0,0,0|2,0,0]=4 11417 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [0,2,0,0,0,0|2,0,0]=4 11418 B9R0.7 NC(CCC(=O)O)C(F)F Amb19148415 [0,2,0,0,0,0|2,0,0]=4 11419 B9R0.13 C=C(C)C(C#N)NCCC Amb28190390 [0,2,0,0,0,0|2,0,0]=4 11420 B9R0.13 C=C(C)C(CBr)CCCC Amb27963319 [0,2,0,0,0,0|1,0,0]=3 11421 B9R0.13 C=C(C)C(CC)NCCC Amb27864838 [0,2,0,0,0,0|2,0,0]=4 11422 B9R0.13 C=C(C)C(CCCC)NC Amb28319659 [0,2,0,0,0,0|1,0,0]=3 11423 B9R0.13 C=C(C)C(CCCCl)NN Amb27587764 [0,2,0,0,0,0|2,0,0]=4 11424 B9R0.13 C=C(C)C(CCl)COCC Amb27601918 [0,2,0,0,0,0|2,0,0]=4 11425 B9R0.13 C=C(C)C(CO)CCCC Amb27772592 [0,2,0,0,0,0|1,0,0]=3 11426 B9R0.13 C=C(C)C(CO)COCC Amb27981657 [0,2,0,0,0,0|2,0,0]=4 11427 B9R0.13 C=C(C)C(COCC)NC Amb28046170 [0,2,0,0,0,0|2,0,0]=4 11428 B9R0.13 C=C=C(CCCC)C(=O)O Amb27489813 [0,2,0,0,0,0|1,0,1]=4 11429 B9R0.13 C=C=C(CCCC)C(C)=O Amb24479207 [0,2,0,0,0,0|0,0,1]=3 11430 B9R0.13 C=CC(CCCC)C(=O)O Amb27759693 [0,2,0,0,0,0|1,0,0]=3 11431 B9R0.13 C=CC(CCCCl)C(=O)O Amb28072929 [0,2,0,0,0,0|2,0,0]=4 11432 B9R0.13 C=CC(NCCC)C(=O)O Amb28454234 [0,2,0,0,0,0|2,0,0]=4 11433 B9R0.13 C=CC(SCCC)C(=O)O Amb27207894 [0,2,0,0,0,0|2,0,0]=4 11434 B9R0.13 C=CCCC(OC)C(C)=O Amb27267298 [0,2,0,0,0,0|0,0,2]=4 11435 B9R0.13 C=C[C@@H](CCCC)C(=O)O Amb28050245 [0,2,0,0,0,0|1,0,0]=3 11436 B9R0.13 C=C[C@H](CCCC)C(=O)O Amb27838910 [0,2,0,0,0,0|1,0,0]=3 11437 B9R0.13 CC#CCC(C#N)C(C)=O Amb28199860 [0,2,0,0,0,0|0,0,2]=4 11438 B9R0.13 CC(=O)C(CO)CCCCl Amb27249647 [0,2,0,0,0,0|1,0,0]=3 11439 B9R0.13 CC(=O)N(CCCCl)N=O Amb28067742 [0,2,0,0,0,0|2,0,0]=4 11440 B9R0.13 CCC(CCOC)C(=O)O Amb25289946 [0,2,0,0,0,0|2,0,0]=4 11441 B9R0.13 CCC(CCOC)C(C)=O Amb27601590 [0,2,0,0,0,0|1,0,0]=3 11442 B9R0.13 CCC(CCSC)C(=O)O Amb24373794 [0,2,0,0,0,0|2,0,0]=4 11443 B9R0.13 CCCCC(C#N)C(=O)O Amb27202774 [0,2,0,0,0,0|1,0,0]=3 11444 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [0,2,0,0,0,0|0,0,0]=2 11445 B9R0.13 CCCCC(C#N)C(N)=O Amb27403940 [0,2,0,0,0,0|1,0,0]=3 11446 B9R0.13 CCCCC(CBr)C(=O)O Amb27799965 [0,2,0,0,0,0|1,0,0]=3 11447 B9R0.13 CCCCC(CBr)C(C)C Amb24751694 [0,2,0,0,0,0|1,0,1]=4 11448 B9R0.13 CCCCC(CC)=C(C)C Amb25839850 [0,2,0,0,0,0|1,0,1]=4 11449 B9R0.13 CCCCC(CC)C(=N)N Amb27622913 [0,2,0,0,0,0|2,0,0]=4 11450 B9R0.13 CCCCC(CC)C(=O)Cl Amb3939067 [0,2,0,0,0,0|1,0,0]=3 11451 B9R0.13 CCCCC(CC)C(=O)O Amb3939821 [0,2,0,0,0,0|1,0,0]=3 11452 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22043361 [0,2,0,0,0,0|1,0,0]=3 11453 B9R0.13 CCCCC(CC)C(=O)[O-] Amb22053863 [0,2,0,0,0,0|1,0,0]=3 11454 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387188 [0,2,0,0,0,0|1,0,0]=3 11455 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8387190 [0,2,0,0,0,0|1,0,0]=3 11456 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8515519 [0,2,0,0,0,0|1,0,0]=3 11457 B9R0.13 CCCCC(CC)C(=O)[O-] Amb8516528 [0,2,0,0,0,0|1,0,0]=3 11458 B9R0.13 CCCCC(CC)C(C)N Amb24437807 [0,2,0,0,0,0|1,0,1]=4 11459 B9R0.13 CCCCC(CC)C(C)O Amb10807396 [0,2,0,0,0,0|0,0,2]=4 11460 B9R0.13 CCCCC(CC)C(N)=O Amb3886579 [0,2,0,0,0,0|1,0,0]=3 11461 B9R0.13 CCCCC(CC)[C@@H](C)N Amb33731288 [0,2,0,0,0,0|1,0,1]=4 11462 B9R0.13 CCCCC(CC)[C@H](C)N Amb33729332 [0,2,0,0,0,0|1,0,1]=4 11463 B9R0.13 CCCCC(CCl)C(C)C Amb27485250 [0,2,0,0,0,0|1,0,1]=4 11464 B9R0.13 CCCCC(CN)C(=O)O Amb26978768 [0,2,0,0,0,0|1,0,0]=3 11465 B9R0.13 CCCCC(CO)C(=O)O Amb27834958 [0,2,0,0,0,0|1,0,0]=3 11466 B9R0.13 CCCCC(CO)C(C)C Amb28203923 [0,2,0,0,0,0|1,0,1]=4 11467 B9R0.13 CCCCC(CO)C(C)Cl Amb28208474 [0,2,0,0,0,0|1,0,1]=4 11468 B9R0.13 CCCCC(CO)C(C)O Amb2781829 [0,2,0,0,0,0|0,0,2]=4 11469 B9R0.13 CCCCC(CO)N(C)C Amb24116645 [0,2,0,0,0,0|2,0,0]=4 11470 B9R0.13 CCCCC(NC)C(=O)O Amb24116642 [0,2,0,0,0,0|1,0,0]=3 11471 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [0,2,0,0,0,0|1,0,0]=3 11472 B9R0.13 CCCCC(NCl)C(=O)O Amb27863591 [0,2,0,0,0,0|1,0,0]=3 11473 B9R0.13 CCCCC(NN)C(=O)O Amb18644274 [0,2,0,0,0,0|1,0,0]=3 11474 B9R0.13 CCCCC(NO)C(=O)O Amb27619251 [0,2,0,0,0,0|1,0,0]=3 11475 B9R0.13 CCCCC(OC)C(=O)O Amb25889001 [0,2,0,0,0,0|1,0,0]=3 11476 B9R0.13 CCCCC(OC)C(C)=O Amb27465061 [0,2,0,0,0,0|0,0,0]=2 11477 B9R0.13 CCCCN(C#N)C(N)=O Amb28388588 [0,2,0,0,0,0|2,0,0]=4 11478 B9R0.13 CCCCN(CC)C(=O)Cl Amb17563080 [0,2,0,0,0,0|2,0,0]=4 11479 B9R0.13 CCCCN(CC)C(N)=O Amb6246594 [0,2,0,0,0,0|2,0,0]=4 11480 B9R0.13 CCCCN(CCl)C(=O)Cl Amb27985843 [0,2,0,0,0,0|2,0,0]=4 11481 B9R0.13 CCCCN(N=O)C(N)=O Amb24074260 [0,2,0,0,0,0|2,0,0]=4 11482 B9R0.13 CCCC[C@@H](CC)C(=O)O Amb28398235 [0,2,0,0,0,0|1,0,0]=3 11483 B9R0.13 CCCC[C@@H](CC)C(C)=O Amb27973070 [0,2,0,0,0,0|0,0,0]=2 11484 B9R0.13 CCCC[C@@H](CC)[C@@H](C)O Amb27839212 [0,2,0,0,0,0|0,0,2]=4 11485 B9R0.13 CCCC[C@@H](CN)C(=O)O Amb27812140 [0,2,0,0,0,0|1,0,0]=3 11486 B9R0.13 CCCC[C@@H](CO)[C@H](C)Cl Amb27657521 [0,2,0,0,0,0|1,0,1]=4 11487 B9R0.13 CCCC[C@@H](CO)[C@H](C)O Amb27979004 [0,2,0,0,0,0|0,0,2]=4 11488 B9R0.13 CCCC[C@@H](NC)C(=O)O Amb22799980 [0,2,0,0,0,0|1,0,0]=3 11489 B9R0.13 CCCC[C@@H](NO)C(=O)O Amb27162541 [0,2,0,0,0,0|1,0,0]=3 11490 B9R0.13 CCCC[C@H](CC)C(=O)O Amb24671282 [0,2,0,0,0,0|1,0,0]=3 11491 B9R0.13 CCCC[C@H](CO)C(=O)O Amb16232529 [0,2,0,0,0,0|1,0,0]=3 11492 B9R0.13 CCCC[C@H](NC)C(=O)O Amb25887554 [0,2,0,0,0,0|1,0,0]=3 11493 B9R0.13 CCCC[C@H](NC)C(N)=O Amb27264530 [0,2,0,0,0,0|1,0,0]=3 11494 B9R0.13 CCCC\C(=N/O)C(=O)O Amb28347572 [0,2,0,0,0,0|1,0,1]=4 11495 B9R0.13 CCCC\C(=N/O)C(C)=O Amb27963521 [0,2,0,0,0,0|0,0,1]=3 11496 B9R0.13 CCCC\C(=N\O)C(C)=O Amb26348647 [0,2,0,0,0,0|0,0,1]=3 11497 B9R0.13 CCCC\C(C=O)=C(/C)Cl Amb27837980 [0,2,0,0,0,0|1,0,1]=4 11498 B9R0.13 CCCC\C(CO)=C(/C)Cl Amb28069761 [0,2,0,0,0,0|1,0,1]=4 11499 B9R0.13 CCCNC(CC)C(N)=O Amb27873895 [0,2,0,0,0,0|2,0,0]=4 11500 B9R0.13 CCCN[C@@H](CS)C(=O)O Amb27645159 [0,2,0,0,0,0|2,0,0]=4 11501 B9R0.13 CCCN[C@H](CO)C(=O)O Amb28125350 [0,2,0,0,0,0|2,0,0]=4 11502 B9R0.13 CCCOC(CC)C(=O)O Amb9675479 [0,2,0,0,0,0|2,0,0]=4 11503 B9R0.13 CCCSC(CC)C(=O)O Amb9675504 [0,2,0,0,0,0|2,0,0]=4 11504 B9R0.13 CCCSC(CN)C(=O)O Amb27233967 [0,2,0,0,0,0|2,0,0]=4 11505 B9R0.13 CCCSC(CO)C(=O)O Amb27629095 [0,2,0,0,0,0|2,0,0]=4 11506 B9R0.13 CCC\C=C(/CC)C(C)=O Amb4017066 [0,2,0,0,0,0|0,0,2]=4 11507 B9R0.13 CCC\C=C(\CC)C(C)=O Amb25926099 [0,2,0,0,0,0|0,0,2]=4 11508 B9R0.13 CCN(CCCN)C(C)=O Amb8829408 [0,2,0,0,0,0|2,0,0]=4 11509 B9R0.13 CCOCC(SC)C(N)=O Amb28146021 [0,2,0,0,0,0|2,0,0]=4 11510 B9R0.13 CCOC[C@H](NC)C(=O)O Amb33347475 [0,2,0,0,0,0|2,0,0]=4 11511 B9R0.13 CCSCC(CC)C(=O)O Amb24482439 [0,2,0,0,0,0|2,0,0]=4 11512 B9R0.13 CCSCC(CN)C(=O)O Amb33324076 [0,2,0,0,0,0|2,0,0]=4 11513 B9R0.13 CC[C@@H](OCOC)C(C)=O Amb27203395 [0,2,0,0,0,0|2,0,0]=4 11514 B9R0.13 CNC(CCCN)C(=O)O Amb18644280 [0,2,0,0,0,0|2,0,0]=4 11515 B9R0.13 CNC(CCSC)C(=O)O Amb18792506 [0,2,0,0,0,0|2,0,0]=4 11516 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [0,2,0,0,0,0|2,0,0]=4 11517 B9R0.13 CN[C@@H](CCOC)C(N)=O Amb27175032 [0,2,0,0,0,0|2,0,0]=4 11518 B9R0.13 CN[C@@H](CCSC)C(=O)O Amb26844419 [0,2,0,0,0,0|2,0,0]=4 11519 B9R0.13 CN[C@H](CCCN)C(=O)O Amb28060751 [0,2,0,0,0,0|2,0,0]=4 11520 B9R0.13 CN[C@H](CCSC)C(=O)O Amb27974159 [0,2,0,0,0,0|2,0,0]=4 11521 B9R0.13 COC(CCCF)C(=O)O Amb33196102 [0,2,0,0,0,0|2,0,0]=4 11522 B9R0.13 COC(CCSC)C(=O)O Amb28288804 [0,2,0,0,0,0|2,0,0]=4 11523 B9R0.13 COC(SCCO)C(C)=O Amb27835655 [0,2,0,0,0,0|2,0,0]=4 11524 B9R0.13 COCCC(CN)C(=O)O Amb24697893 [0,2,0,0,0,0|2,0,0]=4 11525 B9R0.13 COCCC(OC)C(=O)O Amb33428673 [0,2,0,0,0,0|2,0,0]=4 11526 B9R0.13 CSCCC(CN)C(=O)O Amb24618199 [0,2,0,0,0,0|2,0,0]=4 11527 B9R0.13 CSCCC(NCl)C(=O)O Amb27635192 [0,2,0,0,0,0|2,0,0]=4 11528 B9R0.13 CSCCC(NF)C(=O)O Amb27233599 [0,2,0,0,0,0|2,0,0]=4 11529 B9R0.13 CSCC[C@@H](CN)C(=O)O Amb28458297 [0,2,0,0,0,0|2,0,0]=4 11530 B9R0.13 C\C=C\CC(CC)C(C)=O Amb27465073 [0,2,0,0,0,0|0,0,2]=4 11531 B9R0.13 NCCCC(CS)C(=O)O Amb28458435 [0,2,0,0,0,0|2,0,0]=4 11532 B9R0.13 NCCC[C@@H](NN)C(=O)O Amb27768758 [0,2,0,0,0,0|2,0,0]=4 11533 B9R0.42 C=C(C)C(N)CC(C)CC Amb28064517 [0,2,0,0,0,0|1,0,0]=3 11534 B9R0.42 C=C(C)[C@@H](O)CC(=O)CC Amb28126621 [0,2,0,0,0,0|1,0,1]=4 11535 B9R0.42 C=C(C)[C@H](O)CC(=O)CC Amb27760878 [0,2,0,0,0,0|1,0,1]=4 11536 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [0,2,0,0,0,0|1,0,1]=4 11537 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,2,0,0,0,0|1,0,1]=4 11538 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,2,0,0,0,0|1,0,1]=4 11539 B9R0.42 C=C(CC)CC(N)C(N)=O Amb24429018 [0,2,0,0,0,0|1,0,1]=4 11540 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,2,0,0,0,0|1,0,1]=4 11541 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,2,0,0,0,0|1,0,1]=4 11542 B9R0.42 C=C(C[C@@H](C)CC)C(C)=O Amb26853718 [0,2,0,0,0,0|0,0,1]=3 11543 B9R0.42 C=C[C@H](C)C[C@@H](C)C(C)=O Amb27787532 [0,2,0,0,0,0|0,0,2]=4 11544 B9R0.42 CC(=O)C(=O)CC(O)CO Amb28253841 [0,2,0,0,0,0|1,0,1]=4 11545 B9R0.42 CC(=O)C(C)CC(C)C#N Amb18643436 [0,2,0,0,0,0|1,0,1]=4 11546 B9R0.42 CC(=O)C(C)CC(O)CO Amb27616537 [0,2,0,0,0,0|1,0,0]=3 11547 B9R0.42 CC(=O)C(C)OC(C)CN Amb18110684 [0,2,0,0,0,0|2,0,0]=4 11548 B9R0.42 CC(=O)C(Cl)CC(Cl)C#N Amb18648320 [0,2,0,0,0,0|1,0,1]=4 11549 B9R0.42 CC(=O)C(O)CC(O)CO Amb28049878 [0,2,0,0,0,0|1,0,0]=3 11550 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,2,0,0,0,0|2,0,0]=4 11551 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,2,0,0,0,0|2,0,0]=4 11552 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,2,0,0,0,0|2,0,0]=4 11553 B9R0.42 CC(CO)CC(N)C(N)=O Amb32787927 [0,2,0,0,0,0|2,0,0]=4 11554 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,2,0,0,0,0|2,0,0]=4 11555 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,2,0,0,0,0|2,0,0]=4 11556 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,2,0,0,0,0|2,0,0]=4 11557 B9R0.42 CCC(=O)CC(=O)C(C)=O Amb25110491 [0,2,0,0,0,0|0,0,2]=4 11558 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,2,0,0,0,0|1,0,1]=4 11559 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,2,0,0,0,0|1,0,1]=4 11560 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,2,0,0,0,0|1,0,1]=4 11561 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,2,0,0,0,0|1,0,1]=4 11562 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,2,0,0,0,0|1,0,1]=4 11563 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,2,0,0,0,0|1,0,1]=4 11564 B9R0.42 CCC(=O)OC(C)C(C)=O Amb26063123 [0,2,0,0,0,0|1,0,1]=4 11565 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [0,2,0,0,0,0|1,0,1]=4 11566 B9R0.42 CCC(C)CC(Br)C(C)=O Amb27224857 [0,2,0,0,0,0|0,0,0]=2 11567 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,2,0,0,0,0|1,0,0]=3 11568 B9R0.42 CCC(C)CC(C)C(C)C Amb27455148 [0,2,0,0,0,0|1,0,1]=4 11569 B9R0.42 CCC(C)CC(C)C(C)N Amb27953251 [0,2,0,0,0,0|1,0,1]=4 11570 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [0,2,0,0,0,0|0,0,2]=4 11571 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,2,0,0,0,0|1,0,0]=3 11572 B9R0.42 CCC(C)CC(Cl)C(C)C Amb28291137 [0,2,0,0,0,0|1,0,1]=4 11573 B9R0.42 CCC(C)CC(Cl)C(N)=O Amb27669368 [0,2,0,0,0,0|1,0,0]=3 11574 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,2,0,0,0,0|1,0,0]=3 11575 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,2,0,0,0,0|1,0,0]=3 11576 B9R0.42 CCC(C)CC(N)C(C)C Amb18311331 [0,2,0,0,0,0|1,0,1]=4 11577 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [0,2,0,0,0,0|1,0,0]=3 11578 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,2,0,0,0,0|1,0,0]=3 11579 B9R0.42 CCC(C)CC(O)C(C)C Amb27396277 [0,2,0,0,0,0|1,0,1]=4 11580 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,2,0,0,0,0|1,0,0]=3 11581 B9R0.42 CCC(C)CN(C)C(=O)Cl Amb27837817 [0,2,0,0,0,0|2,0,0]=4 11582 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,2,0,0,0,0|1,0,0]=3 11583 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,2,0,0,0,0|1,0,0]=3 11584 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,2,0,0,0,0|1,0,0]=3 11585 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,2,0,0,0,0|1,0,0]=3 11586 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [0,2,0,0,0,0|1,0,0]=3 11587 B9R0.42 CCC(C)NC(=O)C(C)=O Amb17399880 [0,2,0,0,0,0|1,0,1]=4 11588 B9R0.42 CCC(C)NC(C)C(N)=O Amb9203258 [0,2,0,0,0,0|2,0,0]=4 11589 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,2,0,0,0,0|2,0,0]=4 11590 B9R0.42 CCC(C)OC(=O)C(C)=O Amb28198630 [0,2,0,0,0,0|1,0,1]=4 11591 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,2,0,0,0,0|2,0,0]=4 11592 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,2,0,0,0,0|2,0,0]=4 11593 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [0,2,0,0,0,0|2,0,0]=4 11594 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,2,0,0,0,0|2,0,0]=4 11595 B9R0.42 CCC(N)CC(C)C(C)C Amb27255759 [0,2,0,0,0,0|1,0,1]=4 11596 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [0,2,0,0,0,0|1,0,0]=3 11597 B9R0.42 CCC(N)C[C@H](O)[C@H](C)O Amb27473755 [0,2,0,0,0,0|0,0,2]=4 11598 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,2,0,0,0,0|1,0,0]=3 11599 B9R0.42 CCC(O)CC(C)C(C)O Amb28126010 [0,2,0,0,0,0|0,0,2]=4 11600 B9R0.42 CCC(O)CC(C)N(C)C Amb27969032 [0,2,0,0,0,0|2,0,0]=4 11601 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,2,0,0,0,0|1,0,0]=3 11602 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,2,0,0,0,0|1,0,0]=3 11603 B9R0.42 CCC(O)CC(N)C(C)C Amb27838019 [0,2,0,0,0,0|1,0,1]=4 11604 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [0,2,0,0,0,0|1,0,0]=3 11605 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,2,0,0,0,0|1,0,0]=3 11606 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,2,0,0,0,0|1,0,0]=3 11607 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,2,0,0,0,0|1,0,0]=3 11608 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [0,2,0,0,0,0|2,0,0]=4 11609 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [0,2,0,0,0,0|2,0,0]=4 11610 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,2,0,0,0,0|2,0,0]=4 11611 B9R0.42 CCN(C)CC(N)C(N)=O Amb27768725 [0,2,0,0,0,0|2,0,0]=4 11612 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,2,0,0,0,0|2,0,0]=4 11613 B9R0.42 CCS(=O)CC(Cl)C(N)=O Amb28121099 [0,2,0,0,0,0|2,0,0]=4 11614 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,2,0,0,0,0|2,0,0]=4 11615 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,2,0,0,0,0|2,0,0]=4 11616 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,2,0,0,0,0|1,0,0]=3 11617 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,2,0,0,0,0|1,0,0]=3 11618 B9R0.42 CC[C@@H](N)C[C@H](O)C(C)C Amb19929611 [0,2,0,0,0,0|1,0,1]=4 11619 B9R0.42 CC[C@@H](O)C[C@@H](N)C(C)C Amb27204219 [0,2,0,0,0,0|1,0,1]=4 11620 B9R0.42 CC[C@@H](O)C[C@H](N)C(C)C Amb19929610 [0,2,0,0,0,0|1,0,1]=4 11621 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [0,2,0,0,0,0|1,0,1]=4 11622 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,2,0,0,0,0|1,0,0]=3 11623 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,2,0,0,0,0|1,0,0]=3 11624 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,2,0,0,0,0|1,0,0]=3 11625 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,2,0,0,0,0|1,0,0]=3 11626 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,2,0,0,0,0|1,0,0]=3 11627 B9R0.42 CC[C@H](C)\C=C(/C)C(C)=O Amb24586848 [0,2,0,0,0,0|0,0,2]=4 11628 B9R0.42 CC[C@H](N)C[C@H](O)C(C)C Amb19929612 [0,2,0,0,0,0|1,0,1]=4 11629 B9R0.42 CNC(C)CC(C)S(C)=O Amb27437059 [0,2,0,0,0,0|2,0,0]=4 11630 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,2,0,0,0,0|1,0,1]=4 11631 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,2,0,0,0,0|1,0,1]=4 11632 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,2,0,0,0,0|1,0,1]=4 11633 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,2,0,0,0,0|1,0,1]=4 11634 B9R0.42 COC(C)CC(C)C(C)=O Amb27841945 [0,2,0,0,0,0|1,0,0]=3 11635 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,2,0,0,0,0|2,0,0]=4 11636 B9R0.42 COC(C)CC(N)C(N)=O Amb25349298 [0,2,0,0,0,0|2,0,0]=4 11637 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,2,0,0,0,0|2,0,0]=4 11638 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,2,0,0,0,0|2,0,0]=4 11639 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,2,0,0,0,0|2,0,0]=4 11640 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,2,0,0,0,0|2,0,0]=4 11641 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,2,0,0,0,0|2,0,0]=4 11642 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,2,0,0,0,0|2,0,0]=4 11643 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,2,0,0,0,0|2,0,0]=4 11644 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,2,0,0,0,0|2,0,0]=4 11645 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,2,0,0,0,0|2,0,0]=4 11646 B9R0.42 NC(=O)C(N)CC(O)CF Amb33308795 [0,2,0,0,0,0|2,0,0]=4 11647 B9R0.42 NC(=O)C(N)CC(O)CO Amb33066193 [0,2,0,0,0,0|2,0,0]=4 11648 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,2,0,0,0,0|2,0,0]=4 11649 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,2,0,0,0,0|2,0,0]=4 11650 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,2,0,0,0,0|2,0,0]=4 11651 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,2,0,0,0,0|2,0,0]=4 11652 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [0,2,0,0,0,0|2,0,0]=4 11653 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,2,0,0,0,0|2,0,0]=4 11654 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,2,0,0,0,0|2,0,0]=4 11655 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,2,0,0,0,0|2,0,0]=4 11656 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,2,0,0,0,0|2,0,0]=4 11657 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,2,0,0,0,0|2,0,0]=4 11658 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,2,0,0,0,0|2,0,0]=4 11659 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,2,0,0,0,0|2,0,0]=4 11660 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,2,0,0,0,0|2,0,0]=4 11661 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [0,2,0,0,0,0|2,0,0]=4 11662 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,2,0,0,0,0|2,0,0]=4 11663 B9R0.51 C=C(C)C(C)(C)CCCBr Amb28422286 [0,2,0,0,0,0|2,0,0]=4 11664 B9R0.51 C=C(C)C(C)(O)CCCC Amb27191545 [0,2,0,0,0,0|1,0,0]=3 11665 B9R0.51 C=C(C)C(C)(O)CCCN Amb27759192 [0,2,0,0,0,0|2,0,0]=4 11666 B9R0.51 C=C(C)C(C)(O)CCNC Amb27950404 [0,2,0,0,0,0|2,0,0]=4 11667 B9R0.51 C=C(C)C(C)(O)CCOC Amb28124211 [0,2,0,0,0,0|2,0,0]=4 11668 B9R0.51 CC(=O)C(C)(C)CCC#N Amb18643431 [0,2,0,0,0,0|1,0,1]=4 11669 B9R0.51 CC(=O)C(C)(Cl)CCCCl Amb28244745 [0,2,0,0,0,0|1,0,0]=3 11670 B9R0.51 CC(=O)C(F)(F)CCCO Amb27838959 [0,2,0,0,0,0|1,0,0]=3 11671 B9R0.51 CC(C)(CCCCl)C(=O)O Amb27601953 [0,2,0,0,0,0|2,0,0]=4 11672 B9R0.51 CC(C)(CCCF)C(=O)O Amb28049560 [0,2,0,0,0,0|2,0,0]=4 11673 B9R0.51 CC(C)(CCCN)C(=O)O Amb26855022 [0,2,0,0,0,0|2,0,0]=4 11674 B9R0.51 CC(C)(CCCN)C(=O)O Amb27601033 [0,2,0,0,0,0|2,0,0]=4 11675 B9R0.51 CC(C)(CCCO)C(=O)O Amb28410873 [0,2,0,0,0,0|2,0,0]=4 11676 B9R0.51 CC(C)(CCCO)C(=O)[O-] Amb32674658 [0,2,0,0,0,0|2,0,0]=4 11677 B9R0.51 CC(N)(CCCF)C(=O)O Amb32670154 [0,2,0,0,0,0|2,0,0]=4 11678 B9R0.51 CC(N)(CCCN)C(=O)O Amb18644277 [0,2,0,0,0,0|2,0,0]=4 11679 B9R0.51 CC(N)(CCCN)C(=O)O Amb2697838 [0,2,0,0,0,0|2,0,0]=4 11680 B9R0.51 CC(O)(CCCF)C(=O)O Amb33196095 [0,2,0,0,0,0|2,0,0]=4 11681 B9R0.51 CCCCC(C)(Br)C(=O)O Amb28198025 [0,2,0,0,0,0|1,0,0]=3 11682 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [0,2,0,0,0,0|1,0,0]=3 11683 B9R0.51 CCCCC(C)(C)C(=O)O Amb2687527 [0,2,0,0,0,0|1,0,0]=3 11684 B9R0.51 CCCCC(C)(F)C(=O)O Amb24444856 [0,2,0,0,0,0|1,0,0]=3 11685 B9R0.51 CCCCC(C)(F)C(C)N Amb27617733 [0,2,0,0,0,0|1,0,1]=4 11686 B9R0.51 CCCCC(C)(N)C(=O)O Amb33743440 [0,2,0,0,0,0|1,0,0]=3 11687 B9R0.51 CCCCC(C)(N)C(=O)O Amb4134834 [0,2,0,0,0,0|1,0,0]=3 11688 B9R0.51 CCCCC(C)(N)C(C)C Amb18312893 [0,2,0,0,0,0|1,0,1]=4 11689 B9R0.51 CCCCC(C)(O)C(=O)O Amb17593657 [0,2,0,0,0,0|1,0,0]=3 11690 B9R0.51 CCCCC(C)(O)C(C)=O Amb27621354 [0,2,0,0,0,0|0,0,0]=2 11691 B9R0.51 CCCCC(C)(O)C(C)C Amb10807398 [0,2,0,0,0,0|1,0,1]=4 11692 B9R0.51 CCCCC(Cl)(Cl)C(=O)O Amb2720177 [0,2,0,0,0,0|1,0,0]=3 11693 B9R0.51 CCCCC(F)(F)C(=O)O Amb19929267 [0,2,0,0,0,0|1,0,0]=3 11694 B9R0.51 CCCCC(O)(O)C(=O)O Amb28059576 [0,2,0,0,0,0|1,0,0]=3 11695 B9R0.51 CCCC[C@@](C)(N)C(=O)O Amb26346904 [0,2,0,0,0,0|1,0,0]=3 11696 B9R0.51 CCCC[C@@](C)(O)C(=O)O Amb27221053 [0,2,0,0,0,0|1,0,0]=3 11697 B9R0.51 CCCC[C@@](C)(O)[C@H](C)Cl Amb27232769 [0,2,0,0,0,0|1,0,1]=4 11698 B9R0.51 CCCC[C@](C)(N)C(=O)O Amb25961122 [0,2,0,0,0,0|1,0,0]=3 11699 B9R0.51 CCCC[C@](C)(O)C(=O)O Amb27615053 [0,2,0,0,0,0|1,0,0]=3 11700 B9R0.51 CCCNC(C)(C)C(=O)O Amb9620095 [0,2,0,0,0,0|2,0,0]=4 11701 B9R0.51 CCCSC(C)(C)C(=O)O Amb17501481 [0,2,0,0,0,0|2,0,0]=4 11702 B9R0.51 CCCSC(F)(F)C(=O)O Amb27483837 [0,2,0,0,0,0|2,0,0]=4 11703 B9R0.51 CCNCC(C)(C)C(N)=O Amb27248039 [0,2,0,0,0,0|2,0,0]=4 11704 B9R0.51 CCNCC(F)(F)C(=O)O Amb33170567 [0,2,0,0,0,0|2,0,0]=4 11705 B9R0.51 CCNCC(F)(F)C(N)=O Amb33188921 [0,2,0,0,0,0|2,0,0]=4 11706 B9R0.51 CCOCC(C)(C)C(=O)O Amb27810825 [0,2,0,0,0,0|2,0,0]=4 11707 B9R0.51 CCOCC(C)(N)C(=O)O Amb27404396 [0,2,0,0,0,0|2,0,0]=4 11708 B9R0.51 CCOCC(C)(N)C(N)=O Amb27253744 [0,2,0,0,0,0|2,0,0]=4 11709 B9R0.51 CCOCC(C)(O)C(=O)O Amb27949919 [0,2,0,0,0,0|2,0,0]=4 11710 B9R0.51 CCOCC(C)(O)C(N)=O Amb28350523 [0,2,0,0,0,0|2,0,0]=4 11711 B9R0.51 CCOCC(F)(F)C(=O)O Amb33171237 [0,2,0,0,0,0|2,0,0]=4 11712 B9R0.51 CCSCC(C)(C)C(=O)O Amb26439975 [0,2,0,0,0,0|2,0,0]=4 11713 B9R0.51 CCSCC(C)(N)C(=O)O Amb18788224 [0,2,0,0,0,0|2,0,0]=4 11714 B9R0.51 CCSCC(F)(F)C(=O)O Amb33171137 [0,2,0,0,0,0|2,0,0]=4 11715 B9R0.51 CCSCC(F)(F)C(N)=O Amb2687941 [0,2,0,0,0,0|2,0,0]=4 11716 B9R0.51 COCCC(C)(C)C(=O)O Amb19029437 [0,2,0,0,0,0|2,0,0]=4 11717 B9R0.51 COCCC(C)(Cl)C(=O)O Amb27878699 [0,2,0,0,0,0|2,0,0]=4 11718 B9R0.51 COCCC(C)(O)C(=O)O Amb23454643 [0,2,0,0,0,0|2,0,0]=4 11719 B9R0.51 COCCC(F)(F)C(=O)O Amb33476906 [0,2,0,0,0,0|2,0,0]=4 11720 B9R0.51 COCC[C@](C)(N)C(=O)O Amb27425033 [0,2,0,0,0,0|2,0,0]=4 11721 B9R0.51 CSCCC(C)(C)C(=O)O Amb10844081 [0,2,0,0,0,0|2,0,0]=4 11722 B9R0.51 CSCCC(C)(O)C(=O)O Amb33271718 [0,2,0,0,0,0|2,0,0]=4 11723 B9R0.51 CSCCC(F)(F)C(=O)O Amb33010112 [0,2,0,0,0,0|2,0,0]=4 11724 B9R0.51 CSCC[C@@](C)(N)C(=O)O Amb24482190 [0,2,0,0,0,0|2,0,0]=4 11725 B9R0.51 C[C@@](N)(CCCN)C(=O)O Amb27468967 [0,2,0,0,0,0|2,0,0]=4 11726 B9R0.51 C[C@](O)(CCCO)C(=O)O Amb27252130 [0,2,0,0,0,0|2,0,0]=4 11727 B9R0.51 C\C=C\C[C@@](C)(O)C(C)=O Amb26946376 [0,2,0,0,0,0|0,0,2]=4 11728 B9R0.51 NC(=O)C(Cl)(Cl)CCCCl Amb27643983 [0,2,0,0,0,0|2,0,0]=4 11729 B9R0.51 NCCCC(Cl)(Cl)C(=O)O Amb17594797 [0,2,0,0,0,0|2,0,0]=4 11730 B9R0.51 O=C(O)C(F)(F)CCCF Amb33482365 [0,2,0,0,0,0|2,0,0]=4 11731 B9R0.51 O=C(O)C(F)(F)CCCO Amb24652882 [0,2,0,0,0,0|2,0,0]=4 11732 B9R0.21 CC(CBr)CCS(C)(=O)=O Amb25796734 [0,2,0,0,0,0|2,0,0]=4 11733 B9R0.21 CC(CCl)CCS(C)(=O)=O Amb24363403 [0,2,0,0,0,0|2,0,0]=4 11734 B9R0.21 CC(CN)CCS(C)(=O)=O Amb18312080 [0,2,0,0,0,0|2,0,0]=4 11735 B9R0.21 CCC(Br)CNS(C)(=O)=O Amb27241608 [0,2,0,0,0,0|2,0,0]=4 11736 B9R0.21 CCC(C)CCC(C)(C)N Amb33318486 [0,2,0,0,0,0|1,0,1]=4 11737 B9R0.21 CCC(C)CCS(=O)(=O)Cl Amb27778335 [0,2,0,0,0,0|2,0,0]=4 11738 B9R0.21 CCC(C)CCS(=O)(=O)F Amb33352888 [0,2,0,0,0,0|2,0,0]=4 11739 B9R0.21 CCC(C)CCS(N)(=O)=O Amb25371078 [0,2,0,0,0,0|2,0,0]=4 11740 B9R0.21 CCC(C)CNS(C)(=O)=O Amb28367091 [0,2,0,0,0,0|2,0,0]=4 11741 B9R0.21 CCC(Cl)CCS(=O)(=O)Cl Amb27597282 [0,2,0,0,0,0|2,0,0]=4 11742 B9R0.21 CCC(Cl)CC[N+](C)(C)C Amb27827818 [0,2,0,0,0,0|2,0,0]=4 11743 B9R0.21 CCC(N)CCC(C)(C)C Amb19026128 [0,2,0,0,0,0|1,0,1]=4 11744 B9R0.21 CCC(N)CN=S(C)(C)=O Amb27644862 [0,2,0,0,0,0|2,0,0]=4 11745 B9R0.21 CCC(N)CNS(C)(=O)=O Amb25309044 [0,2,0,0,0,0|2,0,0]=4 11746 B9R0.21 CCC(N)CNS(C)(=O)=O Amb33532514 [0,2,0,0,0,0|2,0,0]=4 11747 B9R0.21 CCC(O)CCC(C)(C)C Amb27755750 [0,2,0,0,0,0|1,0,1]=4 11748 B9R0.21 CCC(O)CCC(C)(C)O Amb27650906 [0,2,0,0,0,0|0,0,2]=4 11749 B9R0.21 CC[C@@H](N)CCC(C)(C)O Amb27810874 [0,2,0,0,0,0|0,0,2]=4 11750 B9R0.21 CC[C@@H](N)COS(C)(=O)=O Amb27777335 [0,2,0,0,0,0|2,0,0]=4 11751 B9R0.21 CC[C@@H](O)CCC(C)(C)O Amb27397117 [0,2,0,0,0,0|0,0,2]=4 11752 B9R0.21 CC[C@H](C)CCS(=O)(=O)Cl Amb27229585 [0,2,0,0,0,0|2,0,0]=4 11753 B9R0.21 CC[C@H](C)COS(C)(=O)=O Amb22367081 [0,2,0,0,0,0|2,0,0]=4 11754 B9R0.21 CC[C@H](N)COS(C)(=O)=O Amb27875505 [0,2,0,0,0,0|2,0,0]=4 11755 B9R0.21 CS(=O)(=O)CCC(F)CN Amb28136067 [0,2,0,0,0,0|2,0,0]=4 11756 B9R0.21 CS(=O)(=O)CCC(N)CN Amb32752749 [0,2,0,0,0,0|2,0,0]=4 11757 B9R0.21 CS(=O)(=O)CCC(N)CO Amb24413059 [0,2,0,0,0,0|2,0,0]=4 11758 B9R0.21 CS(=O)(=O)CCC(O)CBr Amb33481762 [0,2,0,0,0,0|2,0,0]=4 11759 B9R0.21 CS(=O)(=O)CCC(O)CCl Amb33411143 [0,2,0,0,0,0|2,0,0]=4 11760 B9R0.21 CS(=O)(=O)CCC(O)CF Amb33053936 [0,2,0,0,0,0|2,0,0]=4 11761 B9R0.21 CS(=O)(=O)CCC(O)CN Amb25803143 [0,2,0,0,0,0|2,0,0]=4 11762 B9R0.21 CS(=O)(=O)CCC(O)CO Amb33053787 [0,2,0,0,0,0|2,0,0]=4 11763 B9R0.21 CS(=O)(=O)CC[C@@H](N)CO Amb26516525 [0,2,0,0,0,0|2,0,0]=4 11764 B9R0.21 CS(=O)(=O)CC[C@@H](O)CN Amb33053762 [0,2,0,0,0,0|2,0,0]=4 11765 B9R0.21 CS(=O)(=O)CC[C@H](N)CN Amb32654882 [0,2,0,0,0,0|2,0,0]=4 11766 B9R0.21 CS(=O)(=O)CC[C@H](N)CO Amb26939652 [0,2,0,0,0,0|2,0,0]=4 11767 B9R0.21 CS(=O)(=O)CC[C@H](O)CN Amb33053766 [0,2,0,0,0,0|2,0,0]=4 11768 B9R0.43 C#CC(CC)CCC(N)=O Amb27960862 [0,2,0,0,0,0|1,0,0]=3 11769 B9R0.43 C#CC(CC)NCC(=C)C Amb27253879 [0,2,0,0,0,0|2,0,0]=4 11770 B9R0.43 C#CC(CC)NCC(=O)O Amb28453722 [0,2,0,0,0,0|2,0,0]=4 11771 B9R0.43 C#CC(CC)NCC(N)=O Amb27232404 [0,2,0,0,0,0|2,0,0]=4 11772 B9R0.43 C#CC(CO)CCC(=C)C Amb28065550 [0,2,0,0,0,0|2,0,0]=4 11773 B9R0.43 C=C(C)CCC(CC)CC Amb28134762 [0,2,0,0,0,0|1,0,0]=3 11774 B9R0.43 C=C(C)CCC(CC)NC Amb27458876 [0,2,0,0,0,0|1,0,0]=3 11775 B9R0.43 C=C(C)CCN(CC)CC Amb27235851 [0,2,0,0,0,0|2,0,0]=4 11776 B9R0.43 C=C(C)CSC(CC)CC Amb28281616 [0,2,0,0,0,0|2,0,0]=4 11777 B9R0.43 C=CC(C=O)CCC(C)=O Amb24619623 [0,2,0,0,0,0|0,0,2]=4 11778 B9R0.43 C=CC(CO)COC(C)=O Amb28400888 [0,2,0,0,0,0|2,0,0]=4 11779 B9R0.43 CC(=O)CCC(C#N)C#N Amb25320040 [0,2,0,0,0,0|1,0,1]=4 11780 B9R0.43 CC(=O)OCC(CO)CO Amb27839393 [0,2,0,0,0,0|2,0,0]=4 11781 B9R0.43 CC(=O)SCC(CN)CN Amb28995117 [0,2,0,0,0,0|2,0,0]=4 11782 B9R0.43 CCC(C#N)CCC(=O)O Amb18643712 [0,2,0,0,0,0|1,0,0]=3 11783 B9R0.43 CCC(C#N)CCC(C)=O Amb18643428 [0,2,0,0,0,0|0,0,0]=2 11784 B9R0.43 CCC(C#N)CCC(C)O Amb27197169 [0,2,0,0,0,0|0,0,2]=4 11785 B9R0.43 CCC(C#N)NCC(N)=O Amb27787632 [0,2,0,0,0,0|2,0,0]=4 11786 B9R0.43 CCC(C#N)OCC(=O)O Amb27426226 [0,2,0,0,0,0|2,0,0]=4 11787 B9R0.43 CCC(C#N)SCC(=O)O Amb18182420 [0,2,0,0,0,0|2,0,0]=4 11788 B9R0.43 CCC(C=O)CC=C(C)C Amb18643625 [0,2,0,0,0,0|1,0,1]=4 11789 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [0,2,0,0,0,0|0,0,0]=2 11790 B9R0.43 CCC(C=O)CCC(C)C Amb27876026 [0,2,0,0,0,0|1,0,1]=4 11791 B9R0.43 CCC(C=O)COC(C)=O Amb28321979 [0,2,0,0,0,0|1,0,0]=3 11792 B9R0.43 CCC(CBr)CCC(C)C Amb25334410 [0,2,0,0,0,0|1,0,1]=4 11793 B9R0.43 CCC(CBr)CCS(C)=O Amb25292711 [0,2,0,0,0,0|1,0,0]=3 11794 B9R0.43 CCC(CBr)COC(C)=O Amb27831455 [0,2,0,0,0,0|1,0,0]=3 11795 B9R0.43 CCC(CC)CCC(=O)Cl Amb28421704 [0,2,0,0,0,0|1,0,0]=3 11796 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,2,0,0,0,0|1,0,0]=3 11797 B9R0.43 CCC(CC)CCC(C)=O Amb26444168 [0,2,0,0,0,0|0,0,0]=2 11798 B9R0.43 CCC(CC)CCC(C)Br Amb27605501 [0,2,0,0,0,0|1,0,1]=4 11799 B9R0.43 CCC(CC)CCC(C)N Amb25147370 [0,2,0,0,0,0|1,0,1]=4 11800 B9R0.43 CCC(CC)CCC(C)O Amb4017702 [0,2,0,0,0,0|0,0,2]=4 11801 B9R0.43 CCC(CC)CC[C@@H](C)N Amb33313778 [0,2,0,0,0,0|1,0,1]=4 11802 B9R0.43 CCC(CC)CC[C@@H](C)O Amb28350101 [0,2,0,0,0,0|0,0,2]=4 11803 B9R0.43 CCC(CC)CC[C@H](C)N Amb33313777 [0,2,0,0,0,0|1,0,1]=4 11804 B9R0.43 CCC(CC)CC[C@H](C)O Amb33313780 [0,2,0,0,0,0|0,0,2]=4 11805 B9R0.43 CCC(CC)CC[N+](=O)[O-] Amb33313764 [0,2,0,0,0,0|2,0,0]=4 11806 B9R0.43 CCC(CC)CNC(C)=N Amb27834251 [0,2,0,0,0,0|2,0,0]=4 11807 B9R0.43 CCC(CC)CNC(C)=O Amb27814537 [0,2,0,0,0,0|1,0,0]=3 11808 B9R0.43 CCC(CC)COC(=O)Cl Amb25142812 [0,2,0,0,0,0|2,0,0]=4 11809 B9R0.43 CCC(CC)COC(C)=O Amb2687794 [0,2,0,0,0,0|1,0,0]=3 11810 B9R0.43 CCC(CC)COC(N)=O Amb28050143 [0,2,0,0,0,0|2,0,0]=4 11811 B9R0.43 CCC(CC)OCC(=O)O Amb28051262 [0,2,0,0,0,0|2,0,0]=4 11812 B9R0.43 CCC(CC)ONC(C)=O Amb27452962 [0,2,0,0,0,0|2,0,0]=4 11813 B9R0.43 CCC(CC)SCC(=O)O Amb28182473 [0,2,0,0,0,0|2,0,0]=4 11814 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,2,0,0,0,0|1,0,0]=3 11815 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,2,0,0,0,0|1,0,0]=3 11816 B9R0.43 CCC(CCC(C)=O)OC Amb26981457 [0,2,0,0,0,0|0,0,0]=2 11817 B9R0.43 CCC(CCC(C)C)NN Amb28057372 [0,2,0,0,0,0|1,0,1]=4 11818 B9R0.43 CCC(CCC(C)Cl)OC Amb27617114 [0,2,0,0,0,0|1,0,1]=4 11819 B9R0.43 CCC(CCC(C)N)OC Amb26580036 [0,2,0,0,0,0|1,0,1]=4 11820 B9R0.43 CCC(CCC(C)O)OC Amb28050767 [0,2,0,0,0,0|0,0,2]=4 11821 B9R0.43 CCC(CCN(C)C)NC Amb27628286 [0,2,0,0,0,0|2,0,0]=4 11822 B9R0.43 CCC(CC[C@@H](C)N)OC Amb33325782 [0,2,0,0,0,0|1,0,1]=4 11823 B9R0.43 CCC(CC[C@@H](C)O)OC Amb33325784 [0,2,0,0,0,0|0,0,2]=4 11824 B9R0.43 CCC(CC[C@H](C)N)OC Amb33224358 [0,2,0,0,0,0|1,0,1]=4 11825 B9R0.43 CCC(CC[C@H](C)O)OC Amb33325785 [0,2,0,0,0,0|0,0,2]=4 11826 B9R0.43 CCC(CC[N+](=O)[O-])OC Amb33325771 [0,2,0,0,0,0|2,0,0]=4 11827 B9R0.43 CCC(CCl)CCC(C)C Amb25726963 [0,2,0,0,0,0|1,0,1]=4 11828 B9R0.43 CCC(CCl)CCS(C)=O Amb24617545 [0,2,0,0,0,0|1,0,0]=3 11829 B9R0.43 CCC(CN)CCN(C)C Amb27590545 [0,2,0,0,0,0|2,0,0]=4 11830 B9R0.43 CCC(CNC(C)=N)OC Amb28292060 [0,2,0,0,0,0|2,0,0]=4 11831 B9R0.43 CCC(CNC(N)=O)OC Amb28184895 [0,2,0,0,0,0|2,0,0]=4 11832 B9R0.43 CCC(CO)CCC(C)=O Amb8395984 [0,2,0,0,0,0|0,0,0]=2 11833 B9R0.43 CCC(CO)CCC(C)C Amb28126755 [0,2,0,0,0,0|1,0,1]=4 11834 B9R0.43 CCC(CO)CCC(C)O Amb8395987 [0,2,0,0,0,0|0,0,2]=4 11835 B9R0.43 CCC(CO)CCS(C)=O Amb27874513 [0,2,0,0,0,0|1,0,0]=3 11836 B9R0.43 CCC(COC(C)=O)OC Amb24323241 [0,2,0,0,0,0|1,0,0]=3 11837 B9R0.43 CCC(OC)OCC(=O)O Amb33341549 [0,2,0,0,0,0|2,0,0]=4 11838 B9R0.43 CCC(\C=C\C(C)=O)CC Amb26977622 [0,2,0,0,0,0|0,0,2]=4 11839 B9R0.43 CCC(\C=C\C(C)=O)OC Amb33326146 [0,2,0,0,0,0|0,0,2]=4 11840 B9R0.43 CCN(C=O)CCC(C)=O Amb24458250 [0,2,0,0,0,0|1,0,0]=3 11841 B9R0.43 CCN(CC)CCC(=O)O Amb6651899 [0,2,0,0,0,0|2,0,0]=4 11842 B9R0.43 CCN(CC)CCC(=O)O Amb8513118 [0,2,0,0,0,0|2,0,0]=4 11843 B9R0.43 CCN(CC)CCC(C)=O Amb965734 [0,2,0,0,0,0|1,0,0]=3 11844 B9R0.43 CCN(CC)CCC(N)=O Amb17231985 [0,2,0,0,0,0|2,0,0]=4 11845 B9R0.43 CCN(CC)CCS(C)=O Amb28142457 [0,2,0,0,0,0|2,0,0]=4 11846 B9R0.43 CCN(COC(C)=O)N=O Amb25887659 [0,2,0,0,0,0|2,0,0]=4 11847 B9R0.43 CCP(CC)CCC(C)=O Amb27267092 [0,2,0,0,0,0|1,0,0]=3 11848 B9R0.43 CCP(CC)CCC(N)=O Amb28399366 [0,2,0,0,0,0|2,0,0]=4 11849 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [0,2,0,0,0,0|0,0,0]=2 11850 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,2,0,0,0,0|1,0,1]=4 11851 B9R0.43 COC(CCC(=O)O)OC Amb24657204 [0,2,0,0,0,0|2,0,0]=4 11852 B9R0.43 COC(CCl)COC(C)=O Amb27205285 [0,2,0,0,0,0|2,0,0]=4 11853 B9R0.43 COC(CNC(C)=O)OC Amb10808671 [0,2,0,0,0,0|2,0,0]=4 11854 B9R0.43 COC(CO)COC(C)=O Amb27838147 [0,2,0,0,0,0|2,0,0]=4 11855 B9R0.43 CO[C@@H](CO)COC(C)=O Amb27874052 [0,2,0,0,0,0|2,0,0]=4 11856 B9R0.43 CS(=O)CCC(C#N)CBr Amb27883171 [0,2,0,0,0,0|2,0,0]=4 11857 B9R0.43 CS(=O)CCC(CBr)CBr Amb27787292 [0,2,0,0,0,0|2,0,0]=4 11858 B9R0.43 CS(=O)CCC(CCl)CCl Amb27449496 [0,2,0,0,0,0|2,0,0]=4 11859 B9R0.43 C\C=C(/CC)CCC(C)=O Amb25857597 [0,2,0,0,0,0|0,0,1]=3 11860 B9R0.64 C#CC(C)(O)CCC(C)=O Amb27954164 [0,2,0,0,0,0|0,0,2]=4 11861 B9R0.64 C=C(C)CCC(C)(C)CN Amb27231016 [0,2,0,0,0,0|2,0,0]=4 11862 B9R0.64 C=C(C)CCC(C)(C)CO Amb27839434 [0,2,0,0,0,0|2,0,0]=4 11863 B9R0.64 C=C(C)CNC(C)(C)CC Amb27628332 [0,2,0,0,0,0|2,0,0]=4 11864 B9R0.64 CC(=O)CCC(C)(C)C#N Amb18124540 [0,2,0,0,0,0|1,0,1]=4 11865 B9R0.64 CC(=O)CCC(C)(C)C=O Amb18643910 [0,2,0,0,0,0|1,0,1]=4 11866 B9R0.64 CC(=O)CCC(C)(C)CO Amb33200191 [0,2,0,0,0,0|1,0,0]=3 11867 B9R0.64 CC(=O)CCS(=O)(=O)CF Amb27793848 [0,2,0,0,0,0|2,0,0]=4 11868 B9R0.64 CC(=O)NCC(C)(C)CCl Amb28049432 [0,2,0,0,0,0|2,0,0]=4 11869 B9R0.64 CC(=O)NCC(C)(C)CN Amb25810145 [0,2,0,0,0,0|2,0,0]=4 11870 B9R0.64 CC(=O)SCC(C)(C)CO Amb27983021 [0,2,0,0,0,0|2,0,0]=4 11871 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,2,0,0,0,0|2,0,0]=4 11872 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,2,0,0,0,0|2,0,0]=4 11873 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,2,0,0,0,0|1,0,0]=3 11874 B9R0.64 CCC(C)(C)CCC(C)=O Amb25926360 [0,2,0,0,0,0|0,0,0]=2 11875 B9R0.64 CCC(C)(C)CCC(C)N Amb27613054 [0,2,0,0,0,0|1,0,1]=4 11876 B9R0.64 CCC(C)(C)CCC(C)O Amb25168708 [0,2,0,0,0,0|0,0,2]=4 11877 B9R0.64 CCC(C)(C)CCS(=O)Cl Amb32720887 [0,2,0,0,0,0|2,0,0]=4 11878 B9R0.64 CCC(C)(C)CCS(=O)[O-] Amb32755576 [0,2,0,0,0,0|2,0,0]=4 11879 B9R0.64 CCC(C)(C)CCS(N)=O Amb32720855 [0,2,0,0,0,0|2,0,0]=4 11880 B9R0.64 CCC(C)(C)CC[C@@H](C)N Amb33266612 [0,2,0,0,0,0|1,0,1]=4 11881 B9R0.64 CCC(C)(C)CC[C@@H](C)O Amb33266336 [0,2,0,0,0,0|0,0,2]=4 11882 B9R0.64 CCC(C)(C)CC[C@H](C)N Amb33266611 [0,2,0,0,0,0|1,0,1]=4 11883 B9R0.64 CCC(C)(C)CC[C@H](C)O Amb33266337 [0,2,0,0,0,0|0,0,2]=4 11884 B9R0.64 CCC(C)(C)CC[N+](=O)[O-] Amb33266301 [0,2,0,0,0,0|2,0,0]=4 11885 B9R0.64 CCC(C)(C)CNC(=O)Cl Amb35633498 [0,2,0,0,0,0|2,0,0]=4 11886 B9R0.64 CCC(C)(C)CNC(C)=N Amb27806673 [0,2,0,0,0,0|2,0,0]=4 11887 B9R0.64 CCC(C)(C)CNC(C)=O Amb27217830 [0,2,0,0,0,0|1,0,0]=3 11888 B9R0.64 CCC(C)(C)COC(N)=O Amb28340947 [0,2,0,0,0,0|2,0,0]=4 11889 B9R0.64 CCC(C)(C)OCC(=O)O Amb9208491 [0,2,0,0,0,0|2,0,0]=4 11890 B9R0.64 CCC(C)(C)OCC(C)=O Amb9667104 [0,2,0,0,0,0|1,0,0]=3 11891 B9R0.64 CCC(C)(C)OCC(N)=O Amb27791287 [0,2,0,0,0,0|2,0,0]=4 11892 B9R0.64 CCC(C)(C)\C=C\C(C)=O Amb32954786 [0,2,0,0,0,0|0,0,2]=4 11893 B9R0.64 CCC(C)(C)\N=C/C(C)=O Amb27265391 [0,2,0,0,0,0|1,0,1]=4 11894 B9R0.64 CCC(C)(N)CC=C(C)C Amb30029630 [0,2,0,0,0,0|1,0,1]=4 11895 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,2,0,0,0,0|1,0,0]=3 11896 B9R0.64 CCC(C)(N)CCN(C)C Amb26576427 [0,2,0,0,0,0|2,0,0]=4 11897 B9R0.64 CCC(C)(N)CCS(C)=O Amb27449521 [0,2,0,0,0,0|1,0,0]=3 11898 B9R0.64 CCC(C)(N)COC(N)=O Amb28071815 [0,2,0,0,0,0|2,0,0]=4 11899 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,2,0,0,0,0|1,0,0]=3 11900 B9R0.64 CCC(C)(O)CCC(C)C Amb4011931 [0,2,0,0,0,0|1,0,1]=4 11901 B9R0.64 CCC(C)(O)CNC(C)=O Amb27795587 [0,2,0,0,0,0|1,0,0]=3 11902 B9R0.64 CCC(C)(O)C\N=C(/C)N Amb27399450 [0,2,0,0,0,0|2,0,0]=4 11903 B9R0.64 CCC(F)(F)CNC(=O)Cl Amb35633329 [0,2,0,0,0,0|2,0,0]=4 11904 B9R0.64 CCC(F)(F)CNC(C)=N Amb35631690 [0,2,0,0,0,0|2,0,0]=4 11905 B9R0.64 CCC(F)(F)CNC(C)=O Amb35631520 [0,2,0,0,0,0|1,0,0]=3 11906 B9R0.64 CCC(F)(F)CNC(N)=O Amb35647259 [0,2,0,0,0,0|2,0,0]=4 11907 B9R0.64 CCP(N)(=O)CCC(N)=O Amb27975054 [0,2,0,0,0,0|2,0,0]=4 11908 B9R0.64 CCS(=O)(=O)CCC(=O)O Amb6266853 [0,2,0,0,0,0|2,0,0]=4 11909 B9R0.64 CCS(=O)(=O)CCC(C)=O Amb28189559 [0,2,0,0,0,0|1,0,0]=3 11910 B9R0.64 CCS(=O)(=O)CCC(N)=O Amb28315921 [0,2,0,0,0,0|2,0,0]=4 11911 B9R0.64 CCS(=O)(=O)NCC(C)=O Amb27807137 [0,2,0,0,0,0|2,0,0]=4 11912 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,2,0,0,0,0|1,0,0]=3 11913 B9R0.64 CNC(C)(C)CNC(C)=O Amb27969171 [0,2,0,0,0,0|2,0,0]=4 11914 B9R0.64 COC(C)(C)CCC(=O)O Amb27835401 [0,2,0,0,0,0|2,0,0]=4 11915 B9R0.64 COC(C)(C)CCC(C)=O Amb25767114 [0,2,0,0,0,0|1,0,0]=3 11916 B9R0.64 COC(C)(C)CNC(C)=O Amb28255406 [0,2,0,0,0,0|2,0,0]=4 11917 B9R0.64 CS(=O)CCC(C)(C)CBr Amb25292710 [0,2,0,0,0,0|2,0,0]=4 11918 B9R0.64 CS(=O)CCC(C)(C)CCl Amb26541565 [0,2,0,0,0,0|2,0,0]=4 11919 B9R0.64 CSC(C)(C)CCC(=O)O Amb28245393 [0,2,0,0,0,0|2,0,0]=4 11920 B9R0.64 O=C(O)CCC(F)(F)CCl Amb27477848 [0,2,0,0,0,0|2,0,0]=4 11921 B9R0.64 O=C(O)CCC(F)(F)CO Amb33620699 [0,2,0,0,0,0|2,0,0]=4 11922 B9R0.56 C=C(Br)CCCC(C)(C)C Amb27860453 [0,2,0,0,0,0|1,0,1]=4 11923 B9R0.56 C=C(C)CCCC(C)(C)C Amb26001485 [0,2,0,0,0,0|1,0,0]=3 11924 B9R0.56 C=C(C)CCCC(C)(C)O Amb22353103 [0,2,0,0,0,0|1,0,0]=3 11925 B9R0.56 C=C(C)CCCC(F)(F)F Amb27972212 [0,2,0,0,0,0|2,0,0]=4 11926 B9R0.56 C=C(C)CCSC(C)(C)C Amb27811470 [0,2,0,0,0,0|2,0,0]=4 11927 B9R0.56 C=C(C)CNCC(C)(C)C Amb27765012 [0,2,0,0,0,0|2,0,0]=4 11928 B9R0.56 C=C(C)COCC(C)(C)N Amb18630818 [0,2,0,0,0,0|2,0,0]=4 11929 B9R0.56 C=C(C)CSCC(C)(C)O Amb27800955 [0,2,0,0,0,0|2,0,0]=4 11930 B9R0.56 C=C(Cl)CCCC(C)(C)C Amb28120618 [0,2,0,0,0,0|1,0,1]=4 11931 B9R0.56 CC(=N)NCCC(C)(C)C Amb27765040 [0,2,0,0,0,0|2,0,0]=4 11932 B9R0.56 CC(=N)NCCC(C)(C)F Amb29872536 [0,2,0,0,0,0|2,0,0]=4 11933 B9R0.56 CC(=O)C#CCC(C)(C)O Amb27626465 [0,2,0,0,0,0|0,0,2]=4 11934 B9R0.56 CC(=O)CC#CC(C)(C)C Amb28241583 [0,2,0,0,0,0|0,0,2]=4 11935 B9R0.56 CC(=O)CCCC(C)(C)C Amb27466157 [0,2,0,0,0,0|0,0,0]=2 11936 B9R0.56 CC(=O)CCCC(C)(C)O Amb17593627 [0,2,0,0,0,0|0,0,0]=2 11937 B9R0.56 CC(=O)CCCC(F)(F)F Amb26983612 [0,2,0,0,0,0|1,0,0]=3 11938 B9R0.56 CC(=O)CCCS(=O)(=O)Cl Amb33076751 [0,2,0,0,0,0|2,0,0]=4 11939 B9R0.56 CC(=O)CCCS(C)(=O)=O Amb18180080 [0,2,0,0,0,0|1,0,0]=3 11940 B9R0.56 CC(=O)CCC[Si](C)(C)C Amb25879079 [0,2,0,0,0,0|0,1,0]=3 11941 B9R0.56 CC(=O)CCNC(C)(C)C Amb24478983 [0,2,0,0,0,0|1,0,0]=3 11942 B9R0.56 CC(=O)CCNS(C)(=O)=O Amb17102926 [0,2,0,0,0,0|2,0,0]=4 11943 B9R0.56 CC(=O)CCOC(C)(C)C Amb7793019 [0,2,0,0,0,0|1,0,0]=3 11944 B9R0.56 CC(=O)CNCC(F)(F)F Amb28313967 [0,2,0,0,0,0|2,0,0]=4 11945 B9R0.56 CC(=O)COCC(C)(C)N Amb18106342 [0,2,0,0,0,0|1,0,0]=3 11946 B9R0.56 CC(=O)NCCC(C)(C)N Amb35720691 [0,2,0,0,0,0|1,0,0]=3 11947 B9R0.56 CC(=O)NCCS(C)(=O)=O Amb16971455 [0,2,0,0,0,0|2,0,0]=4 11948 B9R0.56 CC(=O)NCC[Si](C)(C)C Amb27985894 [0,2,0,0,0,0|1,1,0]=4 11949 B9R0.56 CC(=O)OCCC(C)(C)O Amb28454807 [0,2,0,0,0,0|1,0,0]=3 11950 B9R0.56 CC(=O)OCCC(C)(C)S Amb27969153 [0,2,0,0,0,0|1,0,0]=3 11951 B9R0.56 CC(=O)OCCS(C)(=O)=O Amb28289177 [0,2,0,0,0,0|2,0,0]=4 11952 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb3940923 [0,2,0,0,0,0|2,0,0]=4 11953 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8514749 [0,2,0,0,0,0|2,0,0]=4 11954 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8516476 [0,2,0,0,0,0|2,0,0]=4 11955 B9R0.56 CC(=O)OCC[N+](C)(C)[O-] Amb28400650 [0,2,0,0,0,0|2,0,0]=4 11956 B9R0.56 CC(=O)OCC[Si](C)(C)C Amb27155978 [0,2,0,0,0,0|1,1,0]=4 11957 B9R0.56 CC(=O)OCC[Si](C)(C)Cl Amb19893511 [0,2,0,0,0,0|1,1,0]=4 11958 B9R0.56 CC(=O)OCC[Si](C)(Cl)Cl Amb19893512 [0,2,0,0,0,0|1,1,0]=4 11959 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb3429518 [0,2,0,0,0,0|2,0,0]=4 11960 B9R0.56 CC(=O)SCC[Si](C)(C)C Amb27666582 [0,2,0,0,0,0|1,1,0]=4 11961 B9R0.56 CC(=O)\C=C\CC(C)(C)C Amb33473937 [0,2,0,0,0,0|0,0,2]=4 11962 B9R0.56 CC(Br)CCCS(C)(=O)=O Amb24513822 [0,2,0,0,0,0|1,0,0]=3 11963 B9R0.56 CC(Br)CCNS(C)(=O)=O Amb28049450 [0,2,0,0,0,0|2,0,0]=4 11964 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [0,2,0,0,0,0|1,0,0]=3 11965 B9R0.56 CC(C)(C)CCCC(N)=O Amb25268901 [0,2,0,0,0,0|1,0,0]=3 11966 B9R0.56 CC(C)(C)CCCS(=O)Cl Amb32720706 [0,2,0,0,0,0|2,0,0]=4 11967 B9R0.56 CC(C)(C)CCCS(=O)[O-] Amb32754908 [0,2,0,0,0,0|2,0,0]=4 11968 B9R0.56 CC(C)(C)CCCS(N)=O Amb32720707 [0,2,0,0,0,0|2,0,0]=4 11969 B9R0.56 CC(C)(C)CCC[N+](=O)[O-] Amb33362527 [0,2,0,0,0,0|2,0,0]=4 11970 B9R0.56 CC(C)(C)CCNC(=O)Cl Amb35625532 [0,2,0,0,0,0|2,0,0]=4 11971 B9R0.56 CC(C)(C)CCOC(N)=O Amb24575181 [0,2,0,0,0,0|2,0,0]=4 11972 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,2,0,0,0,0|2,0,0]=4 11973 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,2,0,0,0,0|2,0,0]=4 11974 B9R0.56 CC(C)(C)COCC(=O)Cl Amb21964966 [0,2,0,0,0,0|2,0,0]=4 11975 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [0,2,0,0,0,0|2,0,0]=4 11976 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [0,2,0,0,0,0|2,0,0]=4 11977 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [0,2,0,0,0,0|2,0,0]=4 11978 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [0,2,0,0,0,0|2,0,0]=4 11979 B9R0.56 CC(C)(C)NCCC(N)=O Amb8842940 [0,2,0,0,0,0|2,0,0]=4 11980 B9R0.56 CC(C)(C)OCCC(=O)O Amb2691288 [0,2,0,0,0,0|2,0,0]=4 11981 B9R0.56 CC(C)(C)OCCC(N)=O Amb28398446 [0,2,0,0,0,0|2,0,0]=4 11982 B9R0.56 CC(C)(C)SCCC(=O)O Amb6680208 [0,2,0,0,0,0|2,0,0]=4 11983 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [0,2,0,0,0,0|1,0,0]=3 11984 B9R0.56 CC(C)(F)CCNC(=O)Cl Amb35636875 [0,2,0,0,0,0|2,0,0]=4 11985 B9R0.56 CC(C)(F)CCNC(N)=O Amb35655516 [0,2,0,0,0,0|2,0,0]=4 11986 B9R0.56 CC(C)(N)CNCC(N)=O Amb28321690 [0,2,0,0,0,0|2,0,0]=4 11987 B9R0.56 CC(C)(N)COCC(=O)O Amb18630788 [0,2,0,0,0,0|2,0,0]=4 11988 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [0,2,0,0,0,0|1,0,0]=3 11989 B9R0.56 CC(C)(O)CCCC(=O)[O-] Amb32653027 [0,2,0,0,0,0|1,0,0]=3 11990 B9R0.56 CC(C)(O)CSCC(=O)O Amb18307056 [0,2,0,0,0,0|2,0,0]=4 11991 B9R0.56 CC(C)(O)CSCC(N)=O Amb27763121 [0,2,0,0,0,0|2,0,0]=4 11992 B9R0.56 CC(C)=CCCC(C)(C)C Amb35582948 [0,2,0,0,0,0|1,0,1]=4 11993 B9R0.56 CC(C)=CCCC(C)(C)N Amb35738438 [0,2,0,0,0,0|1,0,1]=4 11994 B9R0.56 CC(C)CCCC(C)(C)Br Amb27949712 [0,2,0,0,0,0|1,0,1]=4 11995 B9R0.56 CC(C)CCCC(C)(C)N Amb27412164 [0,2,0,0,0,0|1,0,1]=4 11996 B9R0.56 CC(C)CCCC(C)(N)O Amb27768620 [0,2,0,0,0,0|0,0,2]=4 11997 B9R0.56 CC(C)CCCS(=O)(=O)Cl Amb24478902 [0,2,0,0,0,0|2,0,0]=4 11998 B9R0.56 CC(C)CCCS(=O)(=O)F Amb32717696 [0,2,0,0,0,0|2,0,0]=4 11999 B9R0.56 CC(C)CCCS(N)(=O)=O Amb24479274 [0,2,0,0,0,0|2,0,0]=4 12000 B9R0.56 CC(C)CCNS(C)(=O)=O Amb1777719 [0,2,0,0,0,0|2,0,0]=4 12001 B9R0.56 CC(C)NCCS(C)(=O)=O Amb18800964 [0,2,0,0,0,0|2,0,0]=4 12002 B9R0.56 CC(Cl)CCCC(C)(C)Cl Amb28126751 [0,2,0,0,0,0|1,0,1]=4 12003 B9R0.56 CC(Cl)CCCS(=O)(=O)Cl Amb27881538 [0,2,0,0,0,0|2,0,0]=4 12004 B9R0.56 CC(Cl)CCC[N+](C)(C)C Amb27166118 [0,2,0,0,0,0|2,0,0]=4 12005 B9R0.56 CC(Cl)CCNS(C)(=O)=O Amb27761694 [0,2,0,0,0,0|2,0,0]=4 12006 B9R0.56 CC(F)(F)CCCC(=O)O Amb17593778 [0,2,0,0,0,0|1,0,0]=3 12007 B9R0.56 CC(F)(F)CCCS(=O)Cl Amb32720990 [0,2,0,0,0,0|2,0,0]=4 12008 B9R0.56 CC(F)(F)CCCS(=O)[O-] Amb32755710 [0,2,0,0,0,0|2,0,0]=4 12009 B9R0.56 CC(F)(F)CCCS(N)=O Amb32720991 [0,2,0,0,0,0|2,0,0]=4 12010 B9R0.56 CC(F)(F)CCNC(=O)Cl Amb35636877 [0,2,0,0,0,0|2,0,0]=4 12011 B9R0.56 CC(N)CCCC(C)(C)C Amb19018535 [0,2,0,0,0,0|1,0,1]=4 12012 B9R0.56 CC(N)CCCC(C)(C)Cl Amb28194864 [0,2,0,0,0,0|1,0,1]=4 12013 B9R0.56 CC(N)CCCC(C)(C)O Amb1089414 [0,2,0,0,0,0|0,0,2]=4 12014 B9R0.56 CC(N)CCCC(C)(C)O Amb2099767 [0,2,0,0,0,0|0,0,2]=4 12015 B9R0.56 CC(N)CCCC(C)(C)S Amb28119901 [0,2,0,0,0,0|0,1,1]=4 12016 B9R0.56 CC(N)CCCP(=O)(O)O Amb27232848 [0,2,0,0,0,0|2,0,0]=4 12017 B9R0.56 CC(N)CCCS(=O)(=O)F Amb33463868 [0,2,0,0,0,0|2,0,0]=4 12018 B9R0.56 CC(N)CCCS(C)(=O)=O Amb19029752 [0,2,0,0,0,0|1,0,0]=3 12019 B9R0.56 CC(N)CCC[Si](C)(C)C Amb27259298 [0,2,0,0,0,0|1,1,0]=4 12020 B9R0.56 CC(N)CCN=S(C)(C)=O Amb27435781 [0,2,0,0,0,0|2,0,0]=4 12021 B9R0.56 CC(O)CCCC(C)(C)C Amb27205826 [0,2,0,0,0,0|0,0,2]=4 12022 B9R0.56 CC(O)CCCS(C)(=O)=O Amb18801118 [0,2,0,0,0,0|1,0,0]=3 12023 B9R0.56 CC(O)CCC[N+](C)(C)C Amb27833684 [0,2,0,0,0,0|2,0,0]=4 12024 B9R0.56 CN(C)CCCC(C)(C)N Amb18202382 [0,2,0,0,0,0|2,0,0]=4 12025 B9R0.56 CN(C)CCCC(C)(C)N Amb32662601 [0,2,0,0,0,0|2,0,0]=4 12026 B9R0.56 CN(C)CCCC(C)(C)O Amb26553899 [0,2,0,0,0,0|2,0,0]=4 12027 B9R0.56 CN(C)CCCS(C)(=N)=O Amb35788947 [0,2,0,0,0,0|2,0,0]=4 12028 B9R0.56 CN(C)CCCS(C)(=N)=O Amb35789510 [0,2,0,0,0,0|2,0,0]=4 12029 B9R0.56 CN(O)CCCS(C)(=O)=O Amb33053752 [0,2,0,0,0,0|2,0,0]=4 12030 B9R0.56 CP(=O)(O)CCCC(=O)O Amb24524573 [0,2,0,0,0,0|2,0,0]=4 12031 B9R0.56 CS(=O)(=O)CCCC(=O)Cl Amb27865991 [0,2,0,0,0,0|2,0,0]=4 12032 B9R0.56 CS(=O)(=O)CCCC(=O)O Amb17503668 [0,2,0,0,0,0|2,0,0]=4 12033 B9R0.56 C[C@@H](N)CCCC(C)(C)C Amb33380505 [0,2,0,0,0,0|1,0,1]=4 12034 B9R0.56 C[C@@H](N)CCCS(C)(=O)=O Amb33055790 [0,2,0,0,0,0|1,0,0]=3 12035 B9R0.56 C[C@@H](O)CCCC(C)(C)C Amb33380506 [0,2,0,0,0,0|0,0,2]=4 12036 B9R0.56 C[C@@H](O)CCCC(C)(C)O Amb27979592 [0,2,0,0,0,0|0,0,2]=4 12037 B9R0.56 C[C@@H](O)CCCS(C)(=O)=O Amb33055767 [0,2,0,0,0,0|1,0,0]=3 12038 B9R0.56 C[C@@H](O)CCNS(C)(=O)=O Amb27591280 [0,2,0,0,0,0|2,0,0]=4 12039 B9R0.56 C[C@H](N)CCCC(C)(C)C Amb33380504 [0,2,0,0,0,0|1,0,1]=4 12040 B9R0.56 C[C@H](N)CCCS(C)(=O)=O Amb33055791 [0,2,0,0,0,0|1,0,0]=3 12041 B9R0.56 C[C@H](O)CCCC(C)(C)C Amb33380507 [0,2,0,0,0,0|0,0,2]=4 12042 B9R0.56 C[C@H](O)CCCS(C)(=O)=O Amb33055789 [0,2,0,0,0,0|1,0,0]=3 12043 B9R0.56 C[N+](C)(C)CCCC(=O)O Amb9825976 [0,2,0,0,0,0|2,0,0]=4 12044 B9R0.56 C[N+](C)(C)CCCC(=O)[O-] Amb25961797 [0,2,0,0,0,0|2,0,0]=4 12045 B9R0.56 C[Si](C)(C)CCCC(=O)O Amb26455818 [0,2,0,0,0,0|1,1,0]=4 12046 B9R0.56 C[Si](C)(Cl)CCCC(=O)Cl Amb27623945 [0,2,0,0,0,0|1,1,0]=4 12047 B9R0.56 NC(=O)CCCC(F)(F)F Amb27804588 [0,2,0,0,0,0|2,0,0]=4 12048 B9R0.56 O=C(Cl)CCCC(F)(F)F Amb28292953 [0,2,0,0,0,0|2,0,0]=4 12049 B9R0.56 O=C(O)CCCC(Cl)(Cl)Cl Amb8480058 [0,2,0,0,0,0|2,0,0]=4 12050 B9R0.56 O=C(O)CCCC(F)(F)F Amb33544347 [0,2,0,0,0,0|2,0,0]=4 12051 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [1,0,0,1,0,0|2,0,0]=4 12052 B7R1.2 C=C1COC(C)C1 Amb35695393 [1,0,0,1,0,0|2,0,0]=4 12053 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,0,0,1,0,0|0,0,2]=4 12054 B7R1.2 CC1=CC(C)CC1 Amb24479860 [1,0,0,1,0,0|1,0,0]=3 12055 B7R1.2 CC1=CC(C)NC1 Amb17593062 [1,0,0,1,0,0|2,0,0]=4 12056 B7R1.2 CC1=CC(N)CC1 Amb28186103 [1,0,0,1,0,0|2,0,0]=4 12057 B7R1.2 CC1=NC(C)CN1 Amb22733191 [1,0,0,1,0,0|2,0,0]=4 12058 B7R1.2 CC1=NC(C)CO1 Amb9805507 [1,0,0,1,0,0|2,0,0]=4 12059 B7R1.2 CC1=NCC(C)S1 Amb26396899 [1,0,0,1,0,0|1,1,0]=4 12060 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,0,0,1,0,0|0,0,2]=4 12061 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|1,0,0]=3 12062 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,0,0,1,0,0|1,0,0]=3 12063 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,0]=3 12064 B7R1.2 CC1CC(=O)NN1 Amb493880 [1,0,0,1,0,0|2,0,0]=4 12065 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|0,0,0]=2 12066 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|1,0,0]=3 12067 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|1,0,0]=3 12068 B7R1.2 CC1CCC(=O)S1 Amb27252897 [1,0,0,1,0,0|1,0,0]=3 12069 B7R1.2 CC1CCC(=S)N1 Amb27849283 [1,0,0,1,0,0|1,1,0]=4 12070 B7R1.2 CC1CCC(Br)C1 Amb26339047 [1,0,0,1,0,0|1,0,1]=4 12071 B7R1.2 CC1CCC(C)N1 Amb20626165 [1,0,0,1,0,0|1,0,1]=4 12072 B7R1.2 CC1CCC(C)N1 Amb5716833 [1,0,0,1,0,0|1,0,1]=4 12073 B7R1.2 CC1CCC(Cl)C1 Amb25129430 [1,0,0,1,0,0|1,0,1]=4 12074 B7R1.2 CC1CCC(I)C1 Amb27402602 [1,0,0,1,0,0|1,0,1]=4 12075 B7R1.2 CC1CCC(N)C1 Amb20669202 [1,0,0,1,0,0|1,0,1]=4 12076 B7R1.2 CC1CCC(N)C1 Amb24062164 [1,0,0,1,0,0|1,0,1]=4 12077 B7R1.2 CC1CCC(O)C1 Amb4605822 [1,0,0,1,0,0|0,0,2]=4 12078 B7R1.2 CC1CCC(S)C1 Amb25829470 [1,0,0,1,0,0|0,1,1]=4 12079 B7R1.2 CC1CCN(N)C1 Amb24385963 [1,0,0,1,0,0|2,0,0]=4 12080 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|1,0,0]=3 12081 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 12082 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|2,0,0]=4 12083 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 12084 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 12085 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|2,0,0]=4 12086 B7R1.2 CC1CSC(=O)N1 Amb28320497 [1,0,0,1,0,0|2,0,0]=4 12087 B7R1.2 CC1NC(=O)CS1 Amb27806202 [1,0,0,1,0,0|2,0,0]=4 12088 B7R1.2 CC1NCC(=O)N1 Amb28456791 [1,0,0,1,0,0|2,0,0]=4 12089 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|2,0,0]=4 12090 B7R1.2 CN1CCC(=O)C1 Amb22236123 [1,0,0,1,0,0|1,0,0]=3 12091 B7R1.2 CN1CCC(=O)C1 Amb8947873 [1,0,0,1,0,0|1,0,0]=3 12092 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,0,0,1,0,0|2,0,0]=4 12093 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,0,0,1,0,0|0,0,2]=4 12094 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,0]=2 12095 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|1,0,0]=3 12096 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|1,0,0]=3 12097 B7R1.2 C[C@@H]1CC[C@@H](Br)C1 Amb27791803 [1,0,0,1,0,0|1,0,1]=4 12098 B7R1.2 C[C@@H]1CC[C@@H](C)C1 Amb25176920 [1,0,0,1,0,0|1,0,1]=4 12099 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb17613372 [1,0,0,1,0,0|1,0,1]=4 12100 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [1,0,0,1,0,0|1,0,1]=4 12101 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [1,0,0,1,0,0|0,0,2]=4 12102 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,0]=3 12103 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|2,0,0]=4 12104 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 12105 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 12106 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|2,0,0]=4 12107 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,0,0,1,0,0|0,0,2]=4 12108 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|1,0,0]=3 12109 B7R1.2 C[C@H]1CC[C@@H](C)N1 Amb10567751 [1,0,0,1,0,0|1,0,1]=4 12110 B7R1.2 C[C@H]1CC[C@H](C)C1 Amb22747863 [1,0,0,1,0,0|1,0,1]=4 12111 B7R1.2 C[C@H]1CC[C@H](C)N1 Amb26580691 [1,0,0,1,0,0|1,0,1]=4 12112 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|1,0,0]=3 12113 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [1,0,0,1,0,0|2,0,0]=4 12114 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 12115 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,0,0,1,0,0|2,0,0]=4 12116 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|2,0,0]=4 12117 B7R1.2 NC1CCC(=O)C1 Amb22494268 [1,0,0,1,0,0|1,0,0]=3 12118 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,0,0,1,0,0|2,0,0]=4 12119 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,0,0,1,0,0|2,0,0]=4 12120 B7R1.2 NC1CCS(=O)C1 Amb19149072 [1,0,0,1,0,0|2,0,0]=4 12121 B7R1.2 NC1CCS(=O)C1 Amb25133789 [1,0,0,1,0,0|2,0,0]=4 12122 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 12123 B7R1.2 NC1CNC(=O)C1 Amb33544169 [1,0,0,1,0,0|2,0,0]=4 12124 B7R1.2 NC1COC(=O)C1 Amb30594428 [1,0,0,1,0,0|2,0,0]=4 12125 B7R1.2 NC1COC(=O)C1 Amb9782136 [1,0,0,1,0,0|2,0,0]=4 12126 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 12127 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 12128 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [1,0,0,1,0,0|2,0,0]=4 12129 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [1,0,0,1,0,0|2,0,0]=4 12130 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [1,0,0,1,0,0|2,0,0]=4 12131 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [1,0,0,1,0,0|2,0,0]=4 12132 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 12133 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [1,0,0,1,0,0|2,0,0]=4 12134 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|2,0,0]=4 12135 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|2,0,0]=4 12136 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|2,0,0]=4 12137 B7R1.2 O=C1CC(I)CO1 Amb27401189 [1,0,0,1,0,0|2,0,0]=4 12138 B7R1.2 O=C1CC(O)CN1 Amb19958404 [1,0,0,1,0,0|2,0,0]=4 12139 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,0,0,1,0,0|2,0,0]=4 12140 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|2,0,0]=4 12141 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [1,0,0,1,0,0|1,0,1]=4 12142 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [1,0,0,1,0,0|1,0,0]=3 12143 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [1,0,0,1,0,0|2,0,0]=4 12144 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,0,0,1,0,0|2,0,0]=4 12145 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [1,0,0,1,0,0|1,0,0]=3 12146 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [1,0,0,1,0,0|2,0,0]=4 12147 B7R1.2 O=C1CCC(F)C1 Amb21963553 [1,0,0,1,0,0|1,0,0]=3 12148 B7R1.2 O=C1CCC(O)C1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 12149 B7R1.2 O=C1CCC(O)O1 Amb22740957 [1,0,0,1,0,0|2,0,0]=4 12150 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [1,0,0,1,0,0|2,0,0]=4 12151 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [1,0,0,1,0,0|1,0,0]=3 12152 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [1,0,0,1,0,0|2,0,0]=4 12153 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [1,0,0,1,0,0|1,0,0]=3 12154 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [1,0,0,1,0,0|2,0,0]=4 12155 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [1,0,0,1,0,0|2,0,0]=4 12156 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,0,0,1,0,0|2,0,0]=4 12157 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|2,0,0]=4 12158 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [1,0,0,1,0,0|2,0,0]=4 12159 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,0,0,1,0,0|2,0,0]=4 12160 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|2,0,0]=4 12161 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [1,0,0,1,0,0|2,0,0]=4 12162 B7R1.2 O=S1CCC(O)C1 Amb26600157 [1,0,0,1,0,0|2,0,0]=4 12163 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [1,0,0,1,0,0|2,0,0]=4 12164 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 12165 B7R1.3 BrC1=CCCCC1 Amb21856761 [1,0,0,1,0,0|1,0,1]=4 12166 B7R1.3 BrC1CCCCC1 Amb3940351 [1,0,0,1,0,0|1,0,1]=4 12167 B7R1.3 C=C1CCCCC1 Amb8515603 [1,0,0,1,0,0|1,0,0]=3 12168 B7R1.3 C=C1CCCCN1 Amb27801038 [1,0,0,1,0,0|1,0,1]=4 12169 B7R1.3 C=C1CCCCO1 Amb28345156 [1,0,0,1,0,0|0,0,2]=4 12170 B7R1.3 C=C1CCCNC1 Amb19514641 [1,0,0,1,0,0|2,0,0]=4 12171 B7R1.3 C=C1CCCNC1 Amb22059305 [1,0,0,1,0,0|2,0,0]=4 12172 B7R1.3 C=C1CCCOC1 Amb27594580 [1,0,0,1,0,0|2,0,0]=4 12173 B7R1.3 C=C1CCCSC1 Amb22494848 [1,0,0,1,0,0|2,0,0]=4 12174 B7R1.3 C=C1CCNCC1 Amb19514763 [1,0,0,1,0,0|2,0,0]=4 12175 B7R1.3 C=C1CCNCC1 Amb24079604 [1,0,0,1,0,0|2,0,0]=4 12176 B7R1.3 C=C1CCNCC1 Amb33715165 [1,0,0,1,0,0|2,0,0]=4 12177 B7R1.3 C=C1CCOCC1 Amb22000865 [1,0,0,1,0,0|2,0,0]=4 12178 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|1,0,0]=3 12179 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|0,0,2]=4 12180 B7R1.3 CC1=CCCNC1 Amb23439963 [1,0,0,1,0,0|2,0,0]=4 12181 B7R1.3 CC1=CCCNC1 Amb25063349 [1,0,0,1,0,0|2,0,0]=4 12182 B7R1.3 CC1=CCNCC1 Amb18639053 [1,0,0,1,0,0|2,0,0]=4 12183 B7R1.3 CC1=CCNCC1 Amb21961140 [1,0,0,1,0,0|2,0,0]=4 12184 B7R1.3 CC1=CCOCC1 Amb24070517 [1,0,0,1,0,0|2,0,0]=4 12185 B7R1.3 CC1=NCCCC1 Amb27459940 [1,0,0,1,0,0|1,0,0]=3 12186 B7R1.3 CC1=NCCCN1 Amb3650246 [1,0,0,1,0,0|2,0,0]=4 12187 B7R1.3 CC1=NCCCS1 Amb25808748 [1,0,0,1,0,0|1,1,0]=4 12188 B7R1.3 CC1=NCCNC1 Amb22755966 [1,0,0,1,0,0|2,0,0]=4 12189 B7R1.3 CC1CCCCN1 Amb2792828 [1,0,0,1,0,0|1,0,1]=4 12190 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|0,0,2]=4 12191 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,1]=4 12192 B7R1.3 CN1CCCCC1 Amb8387007 [1,0,0,1,0,0|2,0,0]=4 12193 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,1]=4 12194 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [1,0,0,1,0,0|1,0,1]=4 12195 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [1,0,0,1,0,0|1,0,1]=4 12196 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [1,0,0,1,0,0|0,1,1]=4 12197 B7R1.3 ClC1=CCCCC1 Amb9785147 [1,0,0,1,0,0|1,0,1]=4 12198 B7R1.3 ClC1CCCCC1 Amb3940352 [1,0,0,1,0,0|1,0,1]=4 12199 B7R1.3 ClN1CCCCC1 Amb25950915 [1,0,0,1,0,0|2,0,0]=4 12200 B7R1.3 FC1CCCCC1 Amb2688084 [1,0,0,1,0,0|1,0,1]=4 12201 B7R1.3 IC1=CCCCC1 Amb27750996 [1,0,0,1,0,0|1,0,1]=4 12202 B7R1.3 IC1CCCCC1 Amb6608670 [1,0,0,1,0,0|1,0,1]=4 12203 B7R1.3 N=C1CCCCC1 Amb26924126 [1,0,0,1,0,0|1,0,0]=3 12204 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,1,0,0|2,0,0]=4 12205 B7R1.3 N=C1CCCCN1 Amb2780013 [1,0,0,1,0,0|2,0,0]=4 12206 B7R1.3 NC1=CCCCC1 Amb28456773 [1,0,0,1,0,0|1,0,1]=4 12207 B7R1.3 NC1=NCCCC1 Amb3997189 [1,0,0,1,0,0|2,0,0]=4 12208 B7R1.3 NC1CCCCC1 Amb2792843 [1,0,0,1,0,0|1,0,1]=4 12209 B7R1.3 NC1CCCCC1 Amb4035820 [1,0,0,1,0,0|1,0,1]=4 12210 B7R1.3 NC1CCCCC1 Amb6366094 [1,0,0,1,0,0|1,0,1]=4 12211 B7R1.3 NN1CCCCC1 Amb535734 [1,0,0,1,0,0|2,0,0]=4 12212 B7R1.3 NN1CCCCC1 Amb6892706 [1,0,0,1,0,0|2,0,0]=4 12213 B7R1.3 O=C1C=CCCC1 Amb17843126 [1,0,0,1,0,0|0,0,2]=4 12214 B7R1.3 O=C1CCCCC1 Amb2793026 [1,0,0,1,0,0|0,0,0]=2 12215 B7R1.3 O=C1CCCCN1 Amb6892006 [1,0,0,1,0,0|1,0,0]=3 12216 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|1,0,0]=3 12217 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,1,0,0|1,0,0]=3 12218 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|1,0,0]=3 12219 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|1,0,0]=3 12220 B7R1.3 O=C1CCCNC1 Amb19958010 [1,0,0,1,0,0|1,0,0]=3 12221 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,1,0,0|2,0,0]=4 12222 B7R1.3 O=C1CCCOC1 Amb19373430 [1,0,0,1,0,0|1,0,0]=3 12223 B7R1.3 O=C1CCCON1 Amb26560803 [1,0,0,1,0,0|2,0,0]=4 12224 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|1,0,0]=3 12225 B7R1.3 O=C1CCNCC1 Amb2690392 [1,0,0,1,0,0|1,0,0]=3 12226 B7R1.3 O=C1CCNCC1 Amb2793002 [1,0,0,1,0,0|1,0,0]=3 12227 B7R1.3 O=C1CCNCC1 Amb8394939 [1,0,0,1,0,0|1,0,0]=3 12228 B7R1.3 O=C1CCNCN1 Amb27458283 [1,0,0,1,0,0|2,0,0]=4 12229 B7R1.3 O=C1CCOCC1 Amb2725565 [1,0,0,1,0,0|1,0,0]=3 12230 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,1,0,0|1,0,0]=3 12231 B7R1.3 O=C1CNCCN1 Amb4138465 [1,0,0,1,0,0|2,0,0]=4 12232 B7R1.3 O=C1CNCCN1 Amb6334808 [1,0,0,1,0,0|2,0,0]=4 12233 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|2,0,0]=4 12234 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|2,0,0]=4 12235 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4 12236 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|2,0,0]=4 12237 B7R1.3 O=C1CSCCN1 Amb674722 [1,0,0,1,0,0|2,0,0]=4 12238 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|2,0,0]=4 12239 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,1,0,0|2,0,0]=4 12240 B7R1.3 O=C1CSCSC1 Amb19148039 [1,0,0,1,0,0|2,0,0]=4 12241 B7R1.3 O=C1NCCCN1 Amb4034594 [1,0,0,1,0,0|2,0,0]=4 12242 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|2,0,0]=4 12243 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,1,0,0|2,0,0]=4 12244 B7R1.3 O=C1OCCCO1 Amb4034896 [1,0,0,1,0,0|2,0,0]=4 12245 B7R1.3 O=S1CCCNC1 Amb27195521 [1,0,0,1,0,0|2,0,0]=4 12246 B7R1.3 O=S1CCNCC1 Amb18943760 [1,0,0,1,0,0|2,0,0]=4 12247 B7R1.3 O=S1CCNCC1 Amb6307179 [1,0,0,1,0,0|2,0,0]=4 12248 B7R1.3 O=S1CCOCC1 Amb26535052 [1,0,0,1,0,0|2,0,0]=4 12249 B7R1.3 O=S1CCSCC1 Amb25679286 [1,0,0,1,0,0|2,0,0]=4 12250 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|0,0,2]=4 12251 B7R1.3 ON1CCCCC1 Amb6468702 [1,0,0,1,0,0|1,0,1]=4 12252 B7R1.3 S=C1CCCCN1 Amb5720520 [1,0,0,1,0,0|1,1,0]=4 12253 B7R1.3 S=C1CCNCC1 Amb27232690 [1,0,0,1,0,0|1,1,0]=4 12254 B7R1.3 SC1CCCCC1 Amb6608750 [1,0,0,1,0,0|0,1,1]=4 12255 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,1]=4 12256 B7R1.5 C=C1CC1CCI Amb27838218 [1,0,0,1,0,0|2,0,0]=4 12257 B7R1.5 C=C1CC1CCN Amb27850014 [1,0,0,1,0,0|2,0,0]=4 12258 B7R1.5 CCCC1CC1Cl Amb28193341 [1,0,0,1,0,0|1,0,1]=4 12259 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,1]=4 12260 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,1]=4 12261 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|1,0,1]=4 12262 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [1,0,0,1,0,0|1,0,1]=4 12263 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [1,0,0,1,0,0|1,0,1]=4 12264 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [1,0,0,1,0,0|1,0,1]=4 12265 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,2]=4 12266 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,2]=4 12267 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,2]=4 12268 B7R1.10 C#CC1CC(=O)C1 Amb27874486 [1,0,0,1,0,0|0,0,2]=4 12269 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [1,0,0,1,0,0|2,0,0]=4 12270 B7R1.10 C=C1CC(CCl)C1 Amb33804034 [1,0,0,1,0,0|2,0,0]=4 12271 B7R1.10 C=C1CC(CN)C1 Amb10071401 [1,0,0,1,0,0|2,0,0]=4 12272 B7R1.10 C=C1CC(CN)C1 Amb10976021 [1,0,0,1,0,0|2,0,0]=4 12273 B7R1.10 C=C1CC(CO)C1 Amb25854323 [1,0,0,1,0,0|2,0,0]=4 12274 B7R1.10 C=C1CC(NC)C1 Amb16230428 [1,0,0,1,0,0|2,0,0]=4 12275 B7R1.10 C=C1CC(NC)C1 Amb33734454 [1,0,0,1,0,0|2,0,0]=4 12276 B7R1.10 C=CC1CC(=O)C1 Amb26409138 [1,0,0,1,0,0|0,0,2]=4 12277 B7R1.10 CCC1CC(=O)C1 Amb24406738 [1,0,0,1,0,0|0,0,0]=2 12278 B7R1.10 CCC1CC(N)C1 Amb26430936 [1,0,0,1,0,0|1,0,1]=4 12279 B7R1.10 CCC1CN(N)C1 Amb27493542 [1,0,0,1,0,0|2,0,0]=4 12280 B7R1.10 CNC1CS(=O)C1 Amb32794923 [1,0,0,1,0,0|2,0,0]=4 12281 B7R1.10 COC1CC(=O)C1 Amb22754340 [1,0,0,1,0,0|1,0,0]=3 12282 B7R1.10 COC1CC(=O)N1 Amb27802279 [1,0,0,1,0,0|2,0,0]=4 12283 B7R1.10 CSC1CC(=O)C1 Amb32655823 [1,0,0,1,0,0|1,0,0]=3 12284 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 12285 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [1,0,0,1,0,0|2,0,0]=4 12286 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [1,0,0,1,0,0|1,0,1]=4 12287 B7R1.10 NCC1CC(=O)C1 Amb18251063 [1,0,0,1,0,0|1,0,0]=3 12288 B7R1.10 NCC1CC(=O)C1 Amb22406094 [1,0,0,1,0,0|1,0,0]=3 12289 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|2,0,0]=4 12290 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [1,0,0,1,0,0|1,0,0]=3 12291 B7R1.10 O=C1CC(CBr)O1 Amb26981027 [1,0,0,1,0,0|2,0,0]=4 12292 B7R1.10 O=C1CC(CCl)C1 Amb10610581 [1,0,0,1,0,0|1,0,0]=3 12293 B7R1.10 O=C1CC(CCl)O1 Amb28322279 [1,0,0,1,0,0|2,0,0]=4 12294 B7R1.10 O=C1CC(CF)C1 Amb26416198 [1,0,0,1,0,0|1,0,0]=3 12295 B7R1.10 O=C1CC(CI)N1 Amb27838210 [1,0,0,1,0,0|2,0,0]=4 12296 B7R1.10 O=C1CC(CO)C1 Amb16231082 [1,0,0,1,0,0|1,0,0]=3 12297 B7R1.10 O=C1CC(CO)N1 Amb22388379 [1,0,0,1,0,0|2,0,0]=4 12298 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [1,0,0,1,0,0|2,0,0]=4 12299 B7R1.12 C=C(C)C1CC1N Amb33199895 [1,0,0,1,0,0|2,0,0]=4 12300 B7R1.12 C=C(C)[C@@H]1C[C@H]1N Amb33199897 [1,0,0,1,0,0|2,0,0]=4 12301 B7R1.12 CC(=O)C1CC1C Amb25720437 [1,0,0,1,0,0|0,0,0]=2 12302 B7R1.12 CC(=O)C1N=C1C Amb28050540 [1,0,0,1,0,0|1,0,1]=4 12303 B7R1.12 CC(=O)C1OC1C Amb25920285 [1,0,0,1,0,0|1,0,0]=3 12304 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [1,0,0,1,0,0|0,0,0]=2 12305 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [1,0,0,1,0,0|1,0,0]=3 12306 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [1,0,0,1,0,0|0,0,0]=2 12307 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [1,0,0,1,0,0|1,0,0]=3 12308 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [1,0,0,1,0,0|1,0,0]=3 12309 B7R1.12 CC(N)C1CC1C Amb24592597 [1,0,0,1,0,0|1,0,1]=4 12310 B7R1.12 CC(N)C1CC1C Amb32663793 [1,0,0,1,0,0|1,0,1]=4 12311 B7R1.12 CC(N)[C@@H]1C[C@H]1C Amb24120602 [1,0,0,1,0,0|1,0,1]=4 12312 B7R1.12 CC(O)[C@H]1C[C@@H]1C Amb27443623 [1,0,0,1,0,0|0,0,2]=4 12313 B7R1.12 CC(S)C1CC1C Amb25102055 [1,0,0,1,0,0|0,1,1]=4 12314 B7R1.12 CC1CC1C(=N)N Amb25139920 [1,0,0,1,0,0|2,0,0]=4 12315 B7R1.12 CC1CC1C(=N)N Amb32667599 [1,0,0,1,0,0|2,0,0]=4 12316 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [1,0,0,1,0,0|1,0,0]=3 12317 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|1,0,0]=3 12318 B7R1.12 CC1CC1C(N)=O Amb8858378 [1,0,0,1,0,0|1,0,0]=3 12319 B7R1.12 CC1CC1C(N)=S Amb25302556 [1,0,0,1,0,0|1,1,0]=4 12320 B7R1.12 CC1CC1[C@@H](C)N Amb26911780 [1,0,0,1,0,0|1,0,1]=4 12321 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [1,0,0,1,0,0|0,0,2]=4 12322 B7R1.12 CC1CC1[C@H](C)N Amb25687220 [1,0,0,1,0,0|1,0,1]=4 12323 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [1,0,0,1,0,0|0,0,2]=4 12324 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|2,0,0]=4 12325 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|2,0,0]=4 12326 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|2,0,0]=4 12327 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|1,0,0]=3 12328 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb27252052 [1,0,0,1,0,0|2,0,0]=4 12329 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb33483860 [1,0,0,1,0,0|2,0,0]=4 12330 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,0]=3 12331 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|1,0,0]=3 12332 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [1,0,0,1,0,0|1,0,0]=3 12333 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|2,0,0]=4 12334 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|2,0,0]=4 12335 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|2,0,0]=4 12336 B7R1.12 C[C@H](N)[C@H]1C[C@@H]1C Amb27874335 [1,0,0,1,0,0|1,0,1]=4 12337 B7R1.12 C[C@H](O)[C@@H]1C[C@H]1C Amb28065317 [1,0,0,1,0,0|0,0,2]=4 12338 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|1,0,0]=3 12339 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [1,0,0,1,0,0|1,0,0]=3 12340 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|1,0,0]=3 12341 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|2,0,0]=4 12342 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|2,0,0]=4 12343 B7R1.12 NC(=O)C1CC1Br Amb27838278 [1,0,0,1,0,0|2,0,0]=4 12344 B7R1.12 NC(=O)C1CC1F Amb26026786 [1,0,0,1,0,0|2,0,0]=4 12345 B7R1.12 NC(=O)C1CC1N Amb18279694 [1,0,0,1,0,0|2,0,0]=4 12346 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [1,0,0,1,0,0|2,0,0]=4 12347 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [1,0,0,1,0,0|2,0,0]=4 12348 B7R1.12 NC1CC1C(=O)O Amb7762823 [1,0,0,1,0,0|2,0,0]=4 12349 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [1,0,0,1,0,0|2,0,0]=4 12350 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [1,0,0,1,0,0|2,0,0]=4 12351 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [1,0,0,1,0,0|2,0,0]=4 12352 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [1,0,0,1,0,0|2,0,0]=4 12353 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [1,0,0,1,0,0|2,0,0]=4 12354 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 12355 B7R1.12 O=C(O)C1CC1Br Amb27760446 [1,0,0,1,0,0|2,0,0]=4 12356 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [1,0,0,1,0,0|2,0,0]=4 12357 B7R1.12 O=C(O)C1CC1F Amb22490547 [1,0,0,1,0,0|2,0,0]=4 12358 B7R1.12 O=C(O)C1CC1I Amb26047069 [1,0,0,1,0,0|2,0,0]=4 12359 B7R1.12 O=C(O)C1CC1S Amb20246988 [1,0,0,1,0,0|2,0,0]=4 12360 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [1,0,0,1,0,0|2,0,0]=4 12361 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [1,0,0,1,0,0|2,0,0]=4 12362 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|2,0,0]=4 12363 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [1,0,0,1,0,0|2,0,0]=4 12364 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|2,0,0]=4 12365 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|2,0,0]=4 12366 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [1,0,0,1,0,0|2,0,0]=4 12367 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|2,0,0]=4 12368 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [1,0,0,1,0,0|2,0,0]=4 12369 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [1,0,0,1,0,0|2,0,0]=4 12370 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|2,0,0]=4 12371 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [1,0,0,1,0,0|2,0,0]=4 12372 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|2,0,0]=4 12373 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|2,0,0]=4 12374 B7R1.14 CC1(Br)CCCC1 Amb24612443 [1,0,0,1,0,0|1,0,1]=4 12375 B7R1.14 CC1(C)CCCC1 Amb4019558 [1,0,0,1,0,0|1,0,1]=4 12376 B7R1.14 CC1(N)CCCC1 Amb10609055 [1,0,0,1,0,0|1,0,1]=4 12377 B7R1.14 CC1(N)CCCC1 Amb9477037 [1,0,0,1,0,0|1,0,1]=4 12378 B7R1.14 CC1(O)CCCC1 Amb4037281 [1,0,0,1,0,0|0,0,2]=4 12379 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [1,0,0,1,0,0|1,1,0]=4 12380 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [1,0,0,1,0,0|1,1,0]=4 12381 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [1,0,0,1,0,0|2,0,0]=4 12382 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [1,0,0,1,0,0|2,0,0]=4 12383 B7R1.17 CC1CCS1(=O)=O Amb22364950 [1,0,0,1,0,0|2,0,0]=4 12384 B7R1.17 C[C@H]1CCS1(=O)=O Amb27661382 [1,0,0,1,0,0|2,0,0]=4 12385 B7R1.18 C=C(C)C1CCC1 Amb25662691 [1,0,0,1,0,0|1,0,0]=3 12386 B7R1.18 C=C(C)C1CCN1 Amb33199611 [1,0,0,1,0,0|2,0,0]=4 12387 B7R1.18 C=C(C)C1CNC1 Amb33226197 [1,0,0,1,0,0|2,0,0]=4 12388 B7R1.18 C=C(F)C1CCC1 Amb27403200 [1,0,0,1,0,0|1,0,1]=4 12389 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [1,0,0,1,0,0|0,0,2]=4 12390 B7R1.18 CC(=O)C1CCC1 Amb4037098 [1,0,0,1,0,0|0,0,0]=2 12391 B7R1.18 CC(=O)C1CCN1 Amb28142364 [1,0,0,1,0,0|1,0,0]=3 12392 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,1,0,0|1,0,0]=3 12393 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,1,0,0|1,0,0]=3 12394 B7R1.18 CC(=O)C1CNC1 Amb33473586 [1,0,0,1,0,0|1,0,0]=3 12395 B7R1.18 CC(=O)C1COC1 Amb27397483 [1,0,0,1,0,0|1,0,0]=3 12396 B7R1.18 CC(=O)C1CSC1 Amb29849423 [1,0,0,1,0,0|1,0,0]=3 12397 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|1,0,0]=3 12398 B7R1.18 CC(Br)C1CCC1 Amb26336046 [1,0,0,1,0,0|1,0,1]=4 12399 B7R1.18 CC(C)C1CCC1 Amb24479859 [1,0,0,1,0,0|1,0,1]=4 12400 B7R1.18 CC(N)C1CCC1 Amb24183538 [1,0,0,1,0,0|1,0,1]=4 12401 B7R1.18 CC(N)C1CCC1 Amb8011026 [1,0,0,1,0,0|1,0,1]=4 12402 B7R1.18 CC(O)C1CCC1 Amb10603414 [1,0,0,1,0,0|0,0,2]=4 12403 B7R1.18 CC(S)C1CCC1 Amb24509376 [1,0,0,1,0,0|0,1,1]=4 12404 B7R1.18 CS(=O)C1CNC1 Amb34155891 [1,0,0,1,0,0|2,0,0]=4 12405 B7R1.18 C[C@@H](N)C1CCC1 Amb22747302 [1,0,0,1,0,0|1,0,1]=4 12406 B7R1.18 C[C@@H](N)C1CCC1 Amb31308336 [1,0,0,1,0,0|1,0,1]=4 12407 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,1,0,0|0,0,2]=4 12408 B7R1.18 C[C@H](N)C1CCC1 Amb33805305 [1,0,0,1,0,0|1,0,1]=4 12409 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,1,0,0|0,0,2]=4 12410 B7R1.18 N=C(N)C1CCC1 Amb2695056 [1,0,0,1,0,0|2,0,0]=4 12411 B7R1.18 N=C(N)C1CCC1 Amb33528962 [1,0,0,1,0,0|2,0,0]=4 12412 B7R1.18 NC(=O)C1CCC1 Amb33552668 [1,0,0,1,0,0|1,0,0]=3 12413 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|2,0,0]=4 12414 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|2,0,0]=4 12415 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,1,0,0|2,0,0]=4 12416 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,1,0,0|2,0,0]=4 12417 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,1,0,0|2,0,0]=4 12418 B7R1.18 NC(=O)C1CSC1 Amb27209831 [1,0,0,1,0,0|2,0,0]=4 12419 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,1,0,0|2,0,0]=4 12420 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [1,0,0,1,0,0|2,0,0]=4 12421 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,1,0,0|1,1,0]=4 12422 B7R1.18 NS(=O)C1CCC1 Amb32720395 [1,0,0,1,0,0|2,0,0]=4 12423 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [1,0,0,1,0,0|1,0,0]=3 12424 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [1,0,0,1,0,0|1,0,0]=3 12425 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [1,0,0,1,0,0|2,0,0]=4 12426 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|1,0,0]=3 12427 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|2,0,0]=4 12428 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|2,0,0]=4 12429 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|2,0,0]=4 12430 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|2,0,0]=4 12431 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,1,0,0|2,0,0]=4 12432 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,1,0,0|2,0,0]=4 12433 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,1,0,0|2,0,0]=4 12434 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,1,0,0|2,0,0]=4 12435 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|2,0,0]=4 12436 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|2,0,0]=4 12437 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|2,0,0]=4 12438 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|2,0,0]=4 12439 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|2,0,0]=4 12440 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|2,0,0]=4 12441 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [1,0,0,1,0,0|2,0,0]=4 12442 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [1,0,0,1,0,0|2,0,0]=4 12443 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [1,0,0,1,0,0|2,0,0]=4 12444 B7R1.20 C=C(C)CC1CC1 Amb27207160 [1,0,0,1,0,0|1,0,0]=3 12445 B7R1.20 C=C(C)CC1CO1 Amb33199536 [1,0,0,1,0,0|2,0,0]=4 12446 B7R1.20 CC(=O)C=C1CC1 Amb28201596 [1,0,0,1,0,0|0,0,2]=4 12447 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|0,0,0]=2 12448 B7R1.20 CC(=O)NC1CC1 Amb3366973 [1,0,0,1,0,0|1,0,0]=3 12449 B7R1.20 CC(=O)OC1CO1 Amb25261586 [1,0,0,1,0,0|2,0,0]=4 12450 B7R1.20 CC(=S)NC1CC1 Amb28131466 [1,0,0,1,0,0|1,1,0]=4 12451 B7R1.20 CC(Br)CC1CC1 Amb26322577 [1,0,0,1,0,0|1,0,1]=4 12452 B7R1.20 CC(Cl)CC1CC1 Amb24635709 [1,0,0,1,0,0|1,0,1]=4 12453 B7R1.20 CC(N)CC1CC1 Amb18958998 [1,0,0,1,0,0|1,0,1]=4 12454 B7R1.20 CC(N)CC1CC1 Amb33038528 [1,0,0,1,0,0|1,0,1]=4 12455 B7R1.20 CC(O)CC1CC1 Amb26536953 [1,0,0,1,0,0|0,0,2]=4 12456 B7R1.20 CC(S)CC1CC1 Amb26515240 [1,0,0,1,0,0|0,1,1]=4 12457 B7R1.20 CN(C)CC1CC1 Amb1795989 [1,0,0,1,0,0|2,0,0]=4 12458 B7R1.20 CN(N)CC1CC1 Amb28131647 [1,0,0,1,0,0|2,0,0]=4 12459 B7R1.20 CN(O)CC1CC1 Amb33429117 [1,0,0,1,0,0|1,0,1]=4 12460 B7R1.20 C[C@@H](N)CC1CC1 Amb26067529 [1,0,0,1,0,0|1,0,1]=4 12461 B7R1.20 C[C@@H](N)CC1CC1 Amb33483221 [1,0,0,1,0,0|1,0,1]=4 12462 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [1,0,0,1,0,0|0,0,2]=4 12463 B7R1.20 C[C@H](N)CC1CC1 Amb25883521 [1,0,0,1,0,0|1,0,1]=4 12464 B7R1.20 C[C@H](N)CC1CC1 Amb33447139 [1,0,0,1,0,0|1,0,1]=4 12465 B7R1.20 C[C@H](O)CC1CC1 Amb28050168 [1,0,0,1,0,0|0,0,2]=4 12466 B7R1.20 N=C(N)CC1CC1 Amb21964664 [1,0,0,1,0,0|2,0,0]=4 12467 B7R1.20 N=C(N)CC1CC1 Amb9423215 [1,0,0,1,0,0|2,0,0]=4 12468 B7R1.20 NC(=O)CC1CC1 Amb33552967 [1,0,0,1,0,0|1,0,0]=3 12469 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 12470 B7R1.20 NC(=O)OC1CC1 Amb27265645 [1,0,0,1,0,0|2,0,0]=4 12471 B7R1.20 NC(=S)CC1CC1 Amb9423151 [1,0,0,1,0,0|1,1,0]=4 12472 B7R1.20 NS(=O)CC1CC1 Amb32720358 [1,0,0,1,0,0|2,0,0]=4 12473 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,0]=3 12474 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [1,0,0,1,0,0|2,0,0]=4 12475 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 12476 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|1,0,0]=3 12477 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|2,0,0]=4 12478 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|2,0,0]=4 12479 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|2,0,0]=4 12480 B7R1.20 O=S(Cl)CC1CC1 Amb25914604 [1,0,0,1,0,0|2,0,0]=4 12481 B7R1.20 O=S([O-])CC1CC1 Amb27483189 [1,0,0,1,0,0|2,0,0]=4 12482 B7R1.23 CCC1CC1(C)N Amb27627409 [1,0,0,1,0,0|1,0,1]=4 12483 B7R1.23 CC[C@@H]1C[C@@]1(C)N Amb27975744 [1,0,0,1,0,0|1,0,1]=4 12484 B7R1.1 BrC=C1CCCC1 Amb27592183 [1,0,0,1,0,0|1,0,1]=4 12485 B7R1.1 BrCC1C=CCC1 Amb28385457 [1,0,0,1,0,0|1,0,1]=4 12486 B7R1.1 BrCC1CC=CC1 Amb25216921 [1,0,0,1,0,0|1,0,1]=4 12487 B7R1.1 BrCC1CCCC1 Amb8631537 [1,0,0,1,0,0|1,0,1]=4 12488 B7R1.1 BrCC1CCNC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 12489 B7R1.1 BrCC1CCNC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 12490 B7R1.1 BrCC1CCNC1 Amb33483362 [1,0,0,1,0,0|2,0,0]=4 12491 B7R1.1 BrCC1CCOC1 Amb8835455 [1,0,0,1,0,0|2,0,0]=4 12492 B7R1.1 BrCC1CCSC1 Amb27630698 [1,0,0,1,0,0|2,0,0]=4 12493 B7R1.1 BrC[C@@H]1C=CCC1 Amb27233396 [1,0,0,1,0,0|1,0,1]=4 12494 B7R1.1 C#CC1CCCC1 Amb8396063 [1,0,0,1,0,0|0,0,2]=4 12495 B7R1.1 C=CC1CCCC1 Amb17934190 [1,0,0,1,0,0|0,0,1]=3 12496 B7R1.1 C=CC1CCCN1 Amb23536605 [1,0,0,1,0,0|1,0,1]=4 12497 B7R1.1 C=CC1CCCN1 Amb24082686 [1,0,0,1,0,0|1,0,1]=4 12498 B7R1.1 C=CC1CCCO1 Amb28137321 [1,0,0,1,0,0|1,0,1]=4 12499 B7R1.1 C=CC1CCCS1 Amb33415623 [1,0,0,1,0,0|1,0,1]=4 12500 B7R1.1 C=CC1CCNC1 Amb22587509 [1,0,0,1,0,0|1,0,1]=4 12501 B7R1.1 C=CC1CCOC1 Amb24478877 [1,0,0,1,0,0|1,0,1]=4 12502 B7R1.1 C=CC1CCSC1 Amb28065280 [1,0,0,1,0,0|1,0,1]=4 12503 B7R1.1 C=CN1CCCC1 Amb25133406 [1,0,0,1,0,0|1,0,1]=4 12504 B7R1.1 CC=C1CCCC1 Amb4035880 [1,0,0,1,0,0|0,0,1]=3 12505 B7R1.1 CCC1C=CCC1 Amb4020582 [1,0,0,1,0,0|0,0,1]=3 12506 B7R1.1 CCC1C=CCN1 Amb10608188 [1,0,0,1,0,0|1,0,1]=4 12507 B7R1.1 CCC1C=CCN1 Amb22587170 [1,0,0,1,0,0|1,0,1]=4 12508 B7R1.1 CCC1CC=CC1 Amb30033009 [1,0,0,1,0,0|0,0,1]=3 12509 B7R1.1 CCC1CC=NN1 Amb32694405 [1,0,0,1,0,0|2,0,0]=4 12510 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|0,0,1]=3 12511 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,1]=4 12512 B7R1.1 CCC1CCCN1 Amb3788096 [1,0,0,1,0,0|1,0,1]=4 12513 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,1]=4 12514 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [1,0,0,1,0,0|1,0,1]=4 12515 B7R1.1 CCC1CCNC1 Amb18946548 [1,0,0,1,0,0|1,0,0]=3 12516 B7R1.1 CCC1CCNC1 Amb20630619 [1,0,0,1,0,0|1,0,0]=3 12517 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|2,0,0]=4 12518 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,1]=4 12519 B7R1.1 CCN1CCOC1 Amb26603215 [1,0,0,1,0,0|2,0,0]=4 12520 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,1]=4 12521 B7R1.1 CC[C@@H]1CCNC1 Amb33801216 [1,0,0,1,0,0|1,0,0]=3 12522 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,1]=4 12523 B7R1.1 CC[C@H]1CCNC1 Amb27458282 [1,0,0,1,0,0|1,0,0]=3 12524 B7R1.1 CC[C@H]1CCNC1 Amb30594227 [1,0,0,1,0,0|1,0,0]=3 12525 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|1,0,0]=3 12526 B7R1.1 CNC1CCCC1 Amb9677383 [1,0,0,1,0,0|1,0,0]=3 12527 B7R1.1 CNC1CCCO1 Amb27254048 [1,0,0,1,0,0|2,0,0]=4 12528 B7R1.1 CNC1CCNC1 Amb22491402 [1,0,0,1,0,0|2,0,0]=4 12529 B7R1.1 CNC1CCNC1 Amb8396671 [1,0,0,1,0,0|2,0,0]=4 12530 B7R1.1 CNC1CCNC1 Amb8397135 [1,0,0,1,0,0|2,0,0]=4 12531 B7R1.1 CNC1CCOC1 Amb20241377 [1,0,0,1,0,0|2,0,0]=4 12532 B7R1.1 CNC1CCOC1 Amb8009837 [1,0,0,1,0,0|2,0,0]=4 12533 B7R1.1 CNC1CCSC1 Amb22741543 [1,0,0,1,0,0|2,0,0]=4 12534 B7R1.1 CNC1CCSC1 Amb31291647 [1,0,0,1,0,0|2,0,0]=4 12535 B7R1.1 CNC1CCSC1 Amb9711007 [1,0,0,1,0,0|2,0,0]=4 12536 B7R1.1 CN[C@@H]1CCNC1 Amb8396672 [1,0,0,1,0,0|2,0,0]=4 12537 B7R1.1 CN[C@@H]1CCNC1 Amb8397134 [1,0,0,1,0,0|2,0,0]=4 12538 B7R1.1 CN[C@@H]1CCOC1 Amb20241026 [1,0,0,1,0,0|2,0,0]=4 12539 B7R1.1 CN[C@@H]1CCOC1 Amb33330851 [1,0,0,1,0,0|2,0,0]=4 12540 B7R1.1 CN[C@H]1CCNC1 Amb8396673 [1,0,0,1,0,0|2,0,0]=4 12541 B7R1.1 CN[C@H]1CCNC1 Amb8397133 [1,0,0,1,0,0|2,0,0]=4 12542 B7R1.1 CN[C@H]1CCOC1 Amb20240861 [1,0,0,1,0,0|2,0,0]=4 12543 B7R1.1 CN[C@H]1CCOC1 Amb20241500 [1,0,0,1,0,0|2,0,0]=4 12544 B7R1.1 COC1C=CCC1 Amb4016570 [1,0,0,1,0,0|1,0,1]=4 12545 B7R1.1 COC1CC=CC1 Amb27421499 [1,0,0,1,0,0|1,0,1]=4 12546 B7R1.1 COC1CCCC1 Amb8517656 [1,0,0,1,0,0|1,0,0]=3 12547 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|2,0,0]=4 12548 B7R1.1 COC1CCNC1 Amb10603699 [1,0,0,1,0,0|2,0,0]=4 12549 B7R1.1 COC1CCNC1 Amb8011289 [1,0,0,1,0,0|2,0,0]=4 12550 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [1,0,0,1,0,0|2,0,0]=4 12551 B7R1.1 CO[C@@H]1CCNC1 Amb10603225 [1,0,0,1,0,0|2,0,0]=4 12552 B7R1.1 CO[C@@H]1CCNC1 Amb10603226 [1,0,0,1,0,0|2,0,0]=4 12553 B7R1.1 CO[C@H]1CCNC1 Amb10603275 [1,0,0,1,0,0|2,0,0]=4 12554 B7R1.1 CO[C@H]1CCNC1 Amb20241379 [1,0,0,1,0,0|2,0,0]=4 12555 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|1,0,0]=3 12556 B7R1.1 CSC1CCNC1 Amb18279428 [1,0,0,1,0,0|2,0,0]=4 12557 B7R1.1 CSC1CCNC1 Amb32662537 [1,0,0,1,0,0|2,0,0]=4 12558 B7R1.1 C\C=C1/CCNC1 Amb31161498 [1,0,0,1,0,0|1,0,1]=4 12559 B7R1.1 C\C=C1/CCNC1 Amb33611505 [1,0,0,1,0,0|1,0,1]=4 12560 B7R1.1 ClC=C1CCCC1 Amb28118913 [1,0,0,1,0,0|1,0,1]=4 12561 B7R1.1 ClCC1CC=CC1 Amb25059951 [1,0,0,1,0,0|1,0,1]=4 12562 B7R1.1 ClCC1CCCC1 Amb9004338 [1,0,0,1,0,0|1,0,1]=4 12563 B7R1.1 ClCC1CCOC1 Amb9754529 [1,0,0,1,0,0|2,0,0]=4 12564 B7R1.1 ClCC1CCSC1 Amb28423424 [1,0,0,1,0,0|2,0,0]=4 12565 B7R1.1 ClC[C@@H]1CCNC1 Amb26551071 [1,0,0,1,0,0|2,0,0]=4 12566 B7R1.1 ClC[C@H]1CCNC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 12567 B7R1.1 FCC1CCNC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 12568 B7R1.1 FCC1CCNC1 Amb32676678 [1,0,0,1,0,0|2,0,0]=4 12569 B7R1.1 FC[C@@H]1CCNC1 Amb27246397 [1,0,0,1,0,0|2,0,0]=4 12570 B7R1.1 FC[C@@H]1CCNC1 Amb33874890 [1,0,0,1,0,0|2,0,0]=4 12571 B7R1.1 FC[C@H]1CCNC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 12572 B7R1.1 FC[C@H]1CCNC1 Amb28435036 [1,0,0,1,0,0|2,0,0]=4 12573 B7R1.1 ICC1CCCC1 Amb8517132 [1,0,0,1,0,0|1,0,1]=4 12574 B7R1.1 ICC1CCOC1 Amb23439064 [1,0,0,1,0,0|2,0,0]=4 12575 B7R1.1 N#CC1CCCC1 Amb2721544 [1,0,0,1,0,0|1,0,1]=4 12576 B7R1.1 NCC1C=CCC1 Amb18119742 [1,0,0,1,0,0|1,0,1]=4 12577 B7R1.1 NCC1C=CCC1 Amb30584689 [1,0,0,1,0,0|1,0,1]=4 12578 B7R1.1 NCC1CC=CC1 Amb22301490 [1,0,0,1,0,0|1,0,1]=4 12579 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,1]=4 12580 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,1]=4 12581 B7R1.1 NCC1CCCC1 Amb6892868 [1,0,0,1,0,0|1,0,1]=4 12582 B7R1.1 NCC1CCOC1 Amb33536658 [1,0,0,1,0,0|2,0,0]=4 12583 B7R1.1 NCC1CCOC1 Amb7969615 [1,0,0,1,0,0|2,0,0]=4 12584 B7R1.1 NCC1CCSC1 Amb18198289 [1,0,0,1,0,0|2,0,0]=4 12585 B7R1.1 NC[C@@H]1CCOC1 Amb26870648 [1,0,0,1,0,0|2,0,0]=4 12586 B7R1.1 NC[C@@H]1CCOC1 Amb31204704 [1,0,0,1,0,0|2,0,0]=4 12587 B7R1.1 NC[C@H]1CCNC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 12588 B7R1.1 NC[C@H]1CCOC1 Amb23439065 [1,0,0,1,0,0|2,0,0]=4 12589 B7R1.1 NC[C@H]1CCOC1 Amb23439174 [1,0,0,1,0,0|2,0,0]=4 12590 B7R1.1 NNC1CCCC1 Amb10071294 [1,0,0,1,0,0|2,0,0]=4 12591 B7R1.1 NNC1CCCC1 Amb2785873 [1,0,0,1,0,0|2,0,0]=4 12592 B7R1.1 NNC1CCCC1 Amb8371028 [1,0,0,1,0,0|2,0,0]=4 12593 B7R1.1 NOC1CCCC1 Amb17101093 [1,0,0,1,0,0|2,0,0]=4 12594 B7R1.1 O=C=C1CCCC1 Amb17673796 [1,0,0,1,0,0|0,0,2]=4 12595 B7R1.1 O=CC1=CCCC1 Amb17138358 [1,0,0,1,0,0|0,0,2]=4 12596 B7R1.1 O=CC1C=CCC1 Amb27229924 [1,0,0,1,0,0|0,0,2]=4 12597 B7R1.1 O=CC1CC=CC1 Amb18638871 [1,0,0,1,0,0|0,0,2]=4 12598 B7R1.1 O=CC1CCCC1 Amb31292855 [1,0,0,1,0,0|0,0,0]=2 12599 B7R1.1 O=CC1CCCC1 Amb4605847 [1,0,0,1,0,0|0,0,0]=2 12600 B7R1.1 O=CC1CCCC1 Amb6297186 [1,0,0,1,0,0|0,0,0]=2 12601 B7R1.1 O=CC1CCCO1 Amb3939388 [1,0,0,1,0,0|1,0,0]=3 12602 B7R1.1 O=CC1CCCS1 Amb27214645 [1,0,0,1,0,0|1,0,0]=3 12603 B7R1.1 O=CC1CCNC1 Amb18197564 [1,0,0,1,0,0|1,0,0]=3 12604 B7R1.1 O=CC1CCOC1 Amb6608994 [1,0,0,1,0,0|1,0,0]=3 12605 B7R1.1 O=CC1CCSC1 Amb18199140 [1,0,0,1,0,0|1,0,0]=3 12606 B7R1.1 O=CC1OCCO1 Amb27592967 [1,0,0,1,0,0|2,0,0]=4 12607 B7R1.1 O=CN1CCCC1 Amb2720947 [1,0,0,1,0,0|1,0,0]=3 12608 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [1,0,0,1,0,0|1,0,0]=3 12609 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [1,0,0,1,0,0|1,0,0]=3 12610 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [1,0,0,1,0,0|1,0,0]=3 12611 B7R1.1 O=NC1CCCN1 Amb27488681 [1,0,0,1,0,0|2,0,0]=4 12612 B7R1.1 O=NN1CCCC1 Amb9787681 [1,0,0,1,0,0|2,0,0]=4 12613 B7R1.1 OCC1C=CCC1 Amb23455253 [1,0,0,1,0,0|1,0,1]=4 12614 B7R1.1 OCC1CC=CC1 Amb2695403 [1,0,0,1,0,0|1,0,1]=4 12615 B7R1.1 OCC1CCCC1 Amb2721271 [1,0,0,1,0,0|0,0,2]=4 12616 B7R1.1 OCC1CCNC1 Amb20240954 [1,0,0,1,0,0|2,0,0]=4 12617 B7R1.1 OCC1CCNC1 Amb21858960 [1,0,0,1,0,0|2,0,0]=4 12618 B7R1.1 OCC1CCNC1 Amb9782649 [1,0,0,1,0,0|2,0,0]=4 12619 B7R1.1 OCC1CCOC1 Amb9748290 [1,0,0,1,0,0|2,0,0]=4 12620 B7R1.1 OCC1CCSC1 Amb18203349 [1,0,0,1,0,0|2,0,0]=4 12621 B7R1.1 OC[C@@H]1CCNC1 Amb34916128 [1,0,0,1,0,0|2,0,0]=4 12622 B7R1.1 OC[C@@H]1CCNC1 Amb6893877 [1,0,0,1,0,0|2,0,0]=4 12623 B7R1.1 OC[C@@H]1CCNC1 Amb8630261 [1,0,0,1,0,0|2,0,0]=4 12624 B7R1.1 OC[C@@H]1CCOC1 Amb28189753 [1,0,0,1,0,0|2,0,0]=4 12625 B7R1.1 OC[C@H]1CCNC1 Amb10067155 [1,0,0,1,0,0|2,0,0]=4 12626 B7R1.1 OC[C@H]1CCNC1 Amb6893876 [1,0,0,1,0,0|2,0,0]=4 12627 B7R1.1 OC[C@H]1CCOC1 Amb22746669 [1,0,0,1,0,0|2,0,0]=4 12628 B7R1.1 ONC1CCCC1 Amb27467457 [1,0,0,1,0,0|1,0,1]=4 12629 B7R1.1 ONC1CCCC1 Amb30625652 [1,0,0,1,0,0|1,0,1]=4 12630 B7R1.1 SCC1CC=CC1 Amb30032288 [1,0,0,1,0,0|1,0,1]=4 12631 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,1]=4 12632 B7R1.1 SCC1CCOC1 Amb26919281 [1,0,0,1,0,0|2,0,0]=4 12633 B7R1.1 SCC1CCSC1 Amb32788496 [1,0,0,1,0,0|2,0,0]=4 12634 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [1,0,0,1,0,0|1,0,1]=4 12635 B7R1.4 C=C1CCCC1=O Amb17593061 [1,0,0,1,0,0|0,0,2]=4 12636 B7R1.4 C=C1CNCC1C Amb28197991 [1,0,0,1,0,0|1,0,1]=4 12637 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [1,0,0,1,0,0|1,0,1]=4 12638 B7R1.4 CC1=C(C)CCC1 Amb22227705 [1,0,0,1,0,0|0,0,1]=3 12639 B7R1.4 CC1=C(C)CNC1 Amb28326117 [1,0,0,1,0,0|1,0,1]=4 12640 B7R1.4 CC1=CCCC1=O Amb8514958 [1,0,0,1,0,0|0,0,2]=4 12641 B7R1.4 CC1=CCCC1C Amb24479857 [1,0,0,1,0,0|0,0,1]=3 12642 B7R1.4 CC1=CCCC1O Amb25220686 [1,0,0,1,0,0|1,0,1]=4 12643 B7R1.4 CC1=CCCN1C Amb17938859 [1,0,0,1,0,0|1,0,1]=4 12644 B7R1.4 CC1=CCNC1C Amb27975662 [1,0,0,1,0,0|1,0,1]=4 12645 B7R1.4 CC1=NCCN1C Amb28456778 [1,0,0,1,0,0|2,0,0]=4 12646 B7R1.4 CC1=[N+](C)CCS1 Amb24060954 [1,0,0,1,0,0|2,0,0]=4 12647 B7R1.4 CC1CCCC1=O Amb8514830 [1,0,0,1,0,0|0,0,0]=2 12648 B7R1.4 CC1CCCC1=S Amb27483022 [1,0,0,1,0,0|0,1,0]=3 12649 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,1]=4 12650 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,1,0,0|0,0,1]=3 12651 B7R1.4 CC1CCCC1Cl Amb27853965 [1,0,0,1,0,0|1,0,1]=4 12652 B7R1.4 CC1CCCC1N Amb33548666 [1,0,0,1,0,0|1,0,1]=4 12653 B7R1.4 CC1CCCC1N Amb9776219 [1,0,0,1,0,0|1,0,1]=4 12654 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,2]=4 12655 B7R1.4 CC1CCCC1S Amb26021537 [1,0,0,1,0,0|0,1,1]=4 12656 B7R1.4 CC1CCCN1N Amb25068361 [1,0,0,1,0,0|2,0,0]=4 12657 B7R1.4 CC1CCNC1=O Amb10603701 [1,0,0,1,0,0|1,0,0]=3 12658 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,1]=4 12659 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,1]=4 12660 B7R1.4 CC1CCOC1=O Amb16185414 [1,0,0,1,0,0|1,0,0]=3 12661 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|1,0,1]=4 12662 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|1,0,1]=4 12663 B7R1.4 CC1CNNC1=O Amb27228083 [1,0,0,1,0,0|2,0,0]=4 12664 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|1,0,0]=3 12665 B7R1.4 CC1CONC1=O Amb33714888 [1,0,0,1,0,0|2,0,0]=4 12666 B7R1.4 CC1CSCC1=O Amb21964769 [1,0,0,1,0,0|1,0,0]=3 12667 B7R1.4 CC1NCCC1=O Amb26950680 [1,0,0,1,0,0|1,0,0]=3 12668 B7R1.4 CC1NCCC1=O Amb32410228 [1,0,0,1,0,0|1,0,0]=3 12669 B7R1.4 CC1NCCN1C Amb27805583 [1,0,0,1,0,0|2,0,0]=4 12670 B7R1.4 CC1OCCC1=O Amb2725497 [1,0,0,1,0,0|1,0,0]=3 12671 B7R1.4 CC1OCNC1=O Amb28046854 [1,0,0,1,0,0|2,0,0]=4 12672 B7R1.4 CC1SCCC1=O Amb8392845 [1,0,0,1,0,0|1,0,0]=3 12673 B7R1.4 CC1SCCC1=S Amb27792245 [1,0,0,1,0,0|1,1,0]=4 12674 B7R1.4 CC1SCNC1=O Amb27211661 [1,0,0,1,0,0|2,0,0]=4 12675 B7R1.4 CN1CCCC1=N Amb20669437 [1,0,0,1,0,0|2,0,0]=4 12676 B7R1.4 CN1CCCC1=O Amb22493780 [1,0,0,1,0,0|1,0,0]=3 12677 B7R1.4 CN1CCCC1=O Amb6608842 [1,0,0,1,0,0|1,0,0]=3 12678 B7R1.4 CN1CCCC1=S Amb10562641 [1,0,0,1,0,0|1,1,0]=4 12679 B7R1.4 CN1CCCC1N Amb27631265 [1,0,0,1,0,0|2,0,0]=4 12680 B7R1.4 CN1CCNC1=O Amb5718647 [1,0,0,1,0,0|2,0,0]=4 12681 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 12682 B7R1.4 CN1CNCC1=O Amb26582942 [1,0,0,1,0,0|2,0,0]=4 12683 B7R1.4 CN1CNCC1=O Amb28827643 [1,0,0,1,0,0|2,0,0]=4 12684 B7R1.4 CN1NCCC1=O Amb18559311 [1,0,0,1,0,0|2,0,0]=4 12685 B7R1.4 C[C@@H]1CCCN1N Amb26843100 [1,0,0,1,0,0|2,0,0]=4 12686 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,1]=4 12687 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,1]=4 12688 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,2]=4 12689 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|0,0,1]=3 12690 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [1,0,0,1,0,0|1,0,1]=4 12691 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [1,0,0,1,0,0|0,0,2]=4 12692 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|1,0,0]=3 12693 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,1]=4 12694 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|1,0,1]=4 12695 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|1,0,1]=4 12696 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [1,0,0,1,0,0|1,0,0]=3 12697 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,1,0,0|1,0,1]=4 12698 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [1,0,0,1,0,0|0,0,0]=2 12699 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|0,0,1]=3 12700 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [1,0,0,1,0,0|0,0,2]=4 12701 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,1,0,0|0,0,1]=3 12702 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [1,0,0,1,0,0|1,0,1]=4 12703 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [1,0,0,1,0,0|0,0,2]=4 12704 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [1,0,0,1,0,0|1,0,0]=3 12705 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,1,0,0|1,0,1]=4 12706 B7R1.4 NC1CCCC1=O Amb17939050 [1,0,0,1,0,0|1,0,0]=3 12707 B7R1.4 NC1CCCC1=O Amb28994832 [1,0,0,1,0,0|1,0,0]=3 12708 B7R1.4 NC1CCNC1=O Amb21955321 [1,0,0,1,0,0|2,0,0]=4 12709 B7R1.4 NC1CCNC1=O Amb6739903 [1,0,0,1,0,0|2,0,0]=4 12710 B7R1.4 NC1CCOC1=O Amb17614991 [1,0,0,1,0,0|2,0,0]=4 12711 B7R1.4 NC1CCOC1=O Amb6609049 [1,0,0,1,0,0|2,0,0]=4 12712 B7R1.4 NC1CCOC1=O Amb9761351 [1,0,0,1,0,0|2,0,0]=4 12713 B7R1.4 NC1CCSC1=O Amb1151877 [1,0,0,1,0,0|2,0,0]=4 12714 B7R1.4 NC1CCSC1=O Amb2720274 [1,0,0,1,0,0|2,0,0]=4 12715 B7R1.4 NC1COCC1=O Amb18202885 [1,0,0,1,0,0|2,0,0]=4 12716 B7R1.4 NC1COCC1=O Amb33328736 [1,0,0,1,0,0|2,0,0]=4 12717 B7R1.4 NC1CSCC1=O Amb18202693 [1,0,0,1,0,0|2,0,0]=4 12718 B7R1.4 NN1CCCC1=O Amb8496496 [1,0,0,1,0,0|2,0,0]=4 12719 B7R1.4 NN1CCCC1=O Amb9174227 [1,0,0,1,0,0|2,0,0]=4 12720 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [1,0,0,1,0,0|2,0,0]=4 12721 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [1,0,0,1,0,0|2,0,0]=4 12722 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [1,0,0,1,0,0|2,0,0]=4 12723 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|2,0,0]=4 12724 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [1,0,0,1,0,0|2,0,0]=4 12725 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [1,0,0,1,0,0|2,0,0]=4 12726 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [1,0,0,1,0,0|2,0,0]=4 12727 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [1,0,0,1,0,0|2,0,0]=4 12728 B7R1.4 N[C@H]1CCOC1=O Amb541960 [1,0,0,1,0,0|2,0,0]=4 12729 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [1,0,0,1,0,0|2,0,0]=4 12730 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [1,0,0,1,0,0|2,0,0]=4 12731 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [1,0,0,1,0,0|2,0,0]=4 12732 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [1,0,0,1,0,0|2,0,0]=4 12733 B7R1.4 O=C1CCCC1=O Amb24053064 [1,0,0,1,0,0|1,0,1]=4 12734 B7R1.4 O=C1CCCC1Br Amb16234114 [1,0,0,1,0,0|1,0,0]=3 12735 B7R1.4 O=C1CCCC1Cl Amb3939970 [1,0,0,1,0,0|1,0,0]=3 12736 B7R1.4 O=C1CCCC1F Amb28050533 [1,0,0,1,0,0|1,0,0]=3 12737 B7R1.4 O=C1CCCC1I Amb25756212 [1,0,0,1,0,0|1,0,0]=3 12738 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,0]=3 12739 B7R1.4 O=C1CCCC1S Amb27838260 [1,0,0,1,0,0|1,0,0]=3 12740 B7R1.4 O=C1CCCN1O Amb33484242 [1,0,0,1,0,0|2,0,0]=4 12741 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [1,0,0,1,0,0|1,0,0]=3 12742 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [1,0,0,1,0,0|1,0,0]=3 12743 B7R1.4 O=C1NCCC1Br Amb20623055 [1,0,0,1,0,0|2,0,0]=4 12744 B7R1.4 O=C1NCCC1Cl Amb28050511 [1,0,0,1,0,0|2,0,0]=4 12745 B7R1.4 O=C1NCCC1F Amb25838145 [1,0,0,1,0,0|2,0,0]=4 12746 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 12747 B7R1.4 O=C1NCCC1S Amb18202686 [1,0,0,1,0,0|2,0,0]=4 12748 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 12749 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 12750 B7R1.4 O=C1OCCC1Br Amb3940058 [1,0,0,1,0,0|2,0,0]=4 12751 B7R1.4 O=C1OCCC1F Amb27642041 [1,0,0,1,0,0|2,0,0]=4 12752 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|2,0,0]=4 12753 B7R1.4 O=C1OCCC1O Amb5718058 [1,0,0,1,0,0|2,0,0]=4 12754 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|2,0,0]=4 12755 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [1,0,0,1,0,0|2,0,0]=4 12756 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [1,0,0,1,0,0|2,0,0]=4 12757 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [1,0,0,1,0,0|2,0,0]=4 12758 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [1,0,0,1,0,0|2,0,0]=4 12759 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [1,0,0,1,0,0|2,0,0]=4 12760 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [1,0,0,1,0,0|2,0,0]=4 12761 B7R1.4 O=S1CCCC1Br Amb28046103 [1,0,0,1,0,0|2,0,0]=4 12762 B7R1.4 O=S1CCCC1Cl Amb27796334 [1,0,0,1,0,0|2,0,0]=4 12763 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [1,0,0,1,0,0|2,0,0]=4 12764 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [1,0,0,1,0,0|2,0,0]=4 12765 B7R1.6 BrCCC1CCC1 Amb25930029 [1,0,0,1,0,0|1,0,1]=4 12766 B7R1.6 BrCCC1COC1 Amb26331124 [1,0,0,1,0,0|2,0,0]=4 12767 B7R1.6 Br[Mg]CC1CCC1 Amb32643968 [1,0,0,1,0,0|2,0,0]=4 12768 B7R1.6 Br\C=C\C1CCC1 Amb33135163 [1,0,0,1,0,0|1,0,1]=4 12769 B7R1.6 C#CCC1CCC1 Amb33314111 [1,0,0,1,0,0|0,0,2]=4 12770 B7R1.6 C=CCC1CCC1 Amb27198597 [1,0,0,1,0,0|0,0,1]=3 12771 B7R1.6 C=CCC1CCN1 Amb25888401 [1,0,0,1,0,0|1,0,1]=4 12772 B7R1.6 C=CCC1CCN1 Amb32992120 [1,0,0,1,0,0|1,0,1]=4 12773 B7R1.6 C=CCC1CNC1 Amb23439504 [1,0,0,1,0,0|1,0,1]=4 12774 B7R1.6 C=CCN1CCC1 Amb26956297 [1,0,0,1,0,0|1,0,1]=4 12775 B7R1.6 CCCC1CCN1 Amb33543494 [1,0,0,1,0,0|1,0,1]=4 12776 B7R1.6 CCCC1CCS1 Amb26614197 [1,0,0,1,0,0|0,1,1]=4 12777 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|1,0,0]=3 12778 B7R1.6 CCCC1CNC1 Amb33802188 [1,0,0,1,0,0|1,0,0]=3 12779 B7R1.6 CCCC1COC1 Amb27147877 [1,0,0,1,0,0|1,0,0]=3 12780 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,1]=4 12781 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,1]=4 12782 B7R1.6 CCNC1CNC1 Amb24619347 [1,0,0,1,0,0|2,0,0]=4 12783 B7R1.6 CCNC1CNC1 Amb33544003 [1,0,0,1,0,0|2,0,0]=4 12784 B7R1.6 CCNC1COC1 Amb22406248 [1,0,0,1,0,0|2,0,0]=4 12785 B7R1.6 CCNC1COC1 Amb22736884 [1,0,0,1,0,0|2,0,0]=4 12786 B7R1.6 CCNC1CSC1 Amb27457315 [1,0,0,1,0,0|2,0,0]=4 12787 B7R1.6 CCOC1CNC1 Amb18523751 [1,0,0,1,0,0|2,0,0]=4 12788 B7R1.6 CCOC1CNC1 Amb19889815 [1,0,0,1,0,0|2,0,0]=4 12789 B7R1.6 CCOC1CNC1 Amb32411735 [1,0,0,1,0,0|2,0,0]=4 12790 B7R1.6 CCSC1CNC1 Amb22395437 [1,0,0,1,0,0|2,0,0]=4 12791 B7R1.6 CCSC1CNC1 Amb26073964 [1,0,0,1,0,0|2,0,0]=4 12792 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|1,0,0]=3 12793 B7R1.6 CNCC1CCC1 Amb9214718 [1,0,0,1,0,0|1,0,0]=3 12794 B7R1.6 CNCC1CNC1 Amb22227648 [1,0,0,1,0,0|2,0,0]=4 12795 B7R1.6 CNCC1CNC1 Amb34913741 [1,0,0,1,0,0|2,0,0]=4 12796 B7R1.6 CNCC1COC1 Amb22405905 [1,0,0,1,0,0|2,0,0]=4 12797 B7R1.6 COCC1CCN1 Amb23439866 [1,0,0,1,0,0|2,0,0]=4 12798 B7R1.6 COCC1CCN1 Amb28827660 [1,0,0,1,0,0|2,0,0]=4 12799 B7R1.6 COCC1CNC1 Amb15691981 [1,0,0,1,0,0|2,0,0]=4 12800 B7R1.6 COCC1CNC1 Amb19958983 [1,0,0,1,0,0|2,0,0]=4 12801 B7R1.6 COCC1CNC1 Amb21960717 [1,0,0,1,0,0|2,0,0]=4 12802 B7R1.6 COC[C@@H]1CCN1 Amb22757160 [1,0,0,1,0,0|2,0,0]=4 12803 B7R1.6 COC[C@@H]1CCN1 Amb23440214 [1,0,0,1,0,0|2,0,0]=4 12804 B7R1.6 COC[C@H]1CCN1 Amb25808228 [1,0,0,1,0,0|2,0,0]=4 12805 B7R1.6 COC[C@H]1CCN1 Amb33805195 [1,0,0,1,0,0|2,0,0]=4 12806 B7R1.6 CONC1CCC1 Amb27425058 [1,0,0,1,0,0|2,0,0]=4 12807 B7R1.6 CONC1CCC1 Amb35789042 [1,0,0,1,0,0|2,0,0]=4 12808 B7R1.6 CSCC1CCN1 Amb33272485 [1,0,0,1,0,0|2,0,0]=4 12809 B7R1.6 CSCC1CNC1 Amb25313820 [1,0,0,1,0,0|2,0,0]=4 12810 B7R1.6 CSCC1CNC1 Amb33804316 [1,0,0,1,0,0|2,0,0]=4 12811 B7R1.6 ClCCC1CCC1 Amb27831996 [1,0,0,1,0,0|1,0,1]=4 12812 B7R1.6 ClCCC1CNC1 Amb27807375 [1,0,0,1,0,0|2,0,0]=4 12813 B7R1.6 FCCC1CNC1 Amb28050421 [1,0,0,1,0,0|2,0,0]=4 12814 B7R1.6 FCCC1CNC1 Amb33743843 [1,0,0,1,0,0|2,0,0]=4 12815 B7R1.6 FCCC1CNC1 Amb34153675 [1,0,0,1,0,0|2,0,0]=4 12816 B7R1.6 ICCC1COC1 Amb25207110 [1,0,0,1,0,0|2,0,0]=4 12817 B7R1.6 N#CCC1CCC1 Amb9870414 [1,0,0,1,0,0|1,0,1]=4 12818 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,1]=4 12819 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,1]=4 12820 B7R1.6 NCCC1CNC1 Amb25997240 [1,0,0,1,0,0|2,0,0]=4 12821 B7R1.6 NCCC1COC1 Amb21864698 [1,0,0,1,0,0|2,0,0]=4 12822 B7R1.6 NCCC1CSC1 Amb27971340 [1,0,0,1,0,0|2,0,0]=4 12823 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 12824 B7R1.6 NNCC1CCC1 Amb6248618 [1,0,0,1,0,0|2,0,0]=4 12825 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 12826 B7R1.6 NOCC1CCC1 Amb32667096 [1,0,0,1,0,0|2,0,0]=4 12827 B7R1.6 O=C=NC1CCC1 Amb6267587 [1,0,0,1,0,0|1,0,1]=4 12828 B7R1.6 O=CC=C1CCC1 Amb27827363 [1,0,0,1,0,0|0,0,2]=4 12829 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,0]=2 12830 B7R1.6 O=CCC1CCO1 Amb26626501 [1,0,0,1,0,0|1,0,0]=3 12831 B7R1.6 O=CCC1COC1 Amb23440119 [1,0,0,1,0,0|1,0,0]=3 12832 B7R1.6 O=CCN1CCC1 Amb25831216 [1,0,0,1,0,0|1,0,0]=3 12833 B7R1.6 O=CNC1CNC1 Amb27798890 [1,0,0,1,0,0|2,0,0]=4 12834 B7R1.6 O=CNC1COC1 Amb28192194 [1,0,0,1,0,0|2,0,0]=4 12835 B7R1.6 OCCC1CCC1 Amb33543947 [1,0,0,1,0,0|0,0,2]=4 12836 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|2,0,0]=4 12837 B7R1.6 OCCC1CNC1 Amb30869764 [1,0,0,1,0,0|2,0,0]=4 12838 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|2,0,0]=4 12839 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|2,0,0]=4 12840 B7R1.6 ONCC1CCC1 Amb25888398 [1,0,0,1,0,0|1,0,1]=4 12841 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,1]=4 12842 B7R1.6 SCCC1CNC1 Amb29854367 [1,0,0,1,0,0|2,0,0]=4 12843 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|1,0,1]=4 12844 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,1,0,0|1,0,1]=4 12845 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,1,0,0|1,0,1]=4 12846 B7R1.8 CC1CCC1CBr Amb28076923 [1,0,0,1,0,0|1,0,1]=4 12847 B7R1.8 CC1CCC1CCl Amb28436122 [1,0,0,1,0,0|1,0,1]=4 12848 B7R1.8 CC1CCC1CI Amb27792871 [1,0,0,1,0,0|1,0,1]=4 12849 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,1]=4 12850 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,2]=4 12851 B7R1.8 CC1CCC1NO Amb27425045 [1,0,0,1,0,0|1,0,1]=4 12852 B7R1.8 CCC1CCC1=O Amb28137082 [1,0,0,1,0,0|0,0,0]=2 12853 B7R1.8 CCC1CCC1N Amb28135225 [1,0,0,1,0,0|1,0,1]=4 12854 B7R1.8 CCC1CCC1O Amb27249737 [1,0,0,1,0,0|0,0,2]=4 12855 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|1,0,0]=3 12856 B7R1.8 CC[C@@H]1CC[C@@H]1O Amb27268529 [1,0,0,1,0,0|0,0,2]=4 12857 B7R1.8 CC[C@@H]1CC[C@H]1O Amb27798172 [1,0,0,1,0,0|0,0,2]=4 12858 B7R1.8 CN1CCC1C=O Amb27789055 [1,0,0,1,0,0|1,0,0]=3 12859 B7R1.8 CN1CCC1CI Amb27863746 [1,0,0,1,0,0|2,0,0]=4 12860 B7R1.8 CN1CCC1CN Amb25108789 [1,0,0,1,0,0|2,0,0]=4 12861 B7R1.8 CN1CCC1CN Amb30869354 [1,0,0,1,0,0|2,0,0]=4 12862 B7R1.8 CN1CCC1CO Amb27161390 [1,0,0,1,0,0|2,0,0]=4 12863 B7R1.8 CN1CC[C@@H]1CN Amb25701112 [1,0,0,1,0,0|2,0,0]=4 12864 B7R1.8 CN1CC[C@@H]1CN Amb30869360 [1,0,0,1,0,0|2,0,0]=4 12865 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|2,0,0]=4 12866 B7R1.8 CN1CC[C@H]1CN Amb25216747 [1,0,0,1,0,0|2,0,0]=4 12867 B7R1.8 CN1CC[C@H]1CN Amb33801125 [1,0,0,1,0,0|2,0,0]=4 12868 B7R1.8 CN1CC[C@H]1CO Amb28239653 [1,0,0,1,0,0|2,0,0]=4 12869 B7R1.8 CNC1CNC1C Amb27838267 [1,0,0,1,0,0|2,0,0]=4 12870 B7R1.8 COC1CCC1=O Amb22896543 [1,0,0,1,0,0|1,0,0]=3 12871 B7R1.8 COC1CCC1N Amb25880007 [1,0,0,1,0,0|2,0,0]=4 12872 B7R1.8 COC1CCC1N Amb32661633 [1,0,0,1,0,0|2,0,0]=4 12873 B7R1.8 COC1CCC1S Amb32788446 [1,0,0,1,0,0|2,0,0]=4 12874 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb33495619 [1,0,0,1,0,0|2,0,0]=4 12875 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb34154243 [1,0,0,1,0,0|2,0,0]=4 12876 B7R1.8 CO[C@@H]1CC[C@H]1Br Amb35752255 [1,0,0,1,0,0|2,0,0]=4 12877 B7R1.8 CO[C@@H]1CC[C@H]1N Amb25026007 [1,0,0,1,0,0|2,0,0]=4 12878 B7R1.8 CO[C@@H]1CC[C@H]1N Amb31245819 [1,0,0,1,0,0|2,0,0]=4 12879 B7R1.8 CO[C@@H]1CC[C@H]1O Amb33495612 [1,0,0,1,0,0|2,0,0]=4 12880 B7R1.8 CSC1CCC1=O Amb26054103 [1,0,0,1,0,0|1,0,0]=3 12881 B7R1.8 C[C@@H]1CC[C@@H]1CBr Amb27484113 [1,0,0,1,0,0|1,0,1]=4 12882 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,1,0,0|0,0,0]=2 12883 B7R1.8 C[C@@H]1CC[C@H]1CBr Amb27424101 [1,0,0,1,0,0|1,0,1]=4 12884 B7R1.8 C[C@H]1CC[C@H]1CBr Amb28429571 [1,0,0,1,0,0|1,0,1]=4 12885 B7R1.8 C[C@H]1CC[C@H]1CCl Amb28387678 [1,0,0,1,0,0|1,0,1]=4 12886 B7R1.8 C[C@H]1CC[C@H]1CO Amb27196739 [1,0,0,1,0,0|0,0,2]=4 12887 B7R1.8 C\C=C1\CCC1=O Amb24512730 [1,0,0,1,0,0|0,0,2]=4 12888 B7R1.8 C\C=C1\CCC1O Amb27595035 [1,0,0,1,0,0|1,0,1]=4 12889 B7R1.8 NCC1CNC1=O Amb25888547 [1,0,0,1,0,0|2,0,0]=4 12890 B7R1.8 O=C1CCC1CBr Amb24633095 [1,0,0,1,0,0|1,0,0]=3 12891 B7R1.8 O=C1CCC1CCl Amb28197139 [1,0,0,1,0,0|1,0,0]=3 12892 B7R1.8 O=C1CCC1CO Amb24722181 [1,0,0,1,0,0|1,0,0]=3 12893 B7R1.8 O=C1CCN1CBr Amb28137960 [1,0,0,1,0,0|2,0,0]=4 12894 B7R1.8 O=C1CCN1CO Amb28207292 [1,0,0,1,0,0|2,0,0]=4 12895 B7R1.8 O=C1NCC1CO Amb28196532 [1,0,0,1,0,0|2,0,0]=4 12896 B7R1.8 O=CC1CCC1F Amb32943810 [1,0,0,1,0,0|1,0,0]=3 12897 B7R1.9 C#C[C@@H]1C[C@H]1C=O Amb28131414 [1,0,0,1,0,0|0,0,2]=4 12898 B7R1.9 C=C[C@@H]1C[C@H]1CO Amb27481145 [1,0,0,1,0,0|1,0,1]=4 12899 B7R1.9 C=C[C@H]1C[C@H]1CBr Amb27424762 [1,0,0,1,0,0|1,0,1]=4 12900 B7R1.9 CCC1CC1C#N Amb28284190 [1,0,0,1,0,0|1,0,1]=4 12901 B7R1.9 CCC1CC1CBr Amb28050452 [1,0,0,1,0,0|1,0,1]=4 12902 B7R1.9 CCC1CC1CC Amb27445028 [1,0,0,1,0,0|0,0,1]=3 12903 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,1]=4 12904 B7R1.9 CCC1CC1CN Amb32662776 [1,0,0,1,0,0|1,0,1]=4 12905 B7R1.9 CCC1OC1CC Amb27407235 [1,0,0,1,0,0|1,0,1]=4 12906 B7R1.9 CC[C@@H]1C[C@@H]1C=O Amb28142393 [1,0,0,1,0,0|0,0,0]=2 12907 B7R1.9 CC[C@@H]1C[C@@H]1CN Amb34916256 [1,0,0,1,0,0|1,0,1]=4 12908 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,2]=4 12909 B7R1.9 CC[C@@H]1C[C@H]1C#N Amb28284782 [1,0,0,1,0,0|1,0,1]=4 12910 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,1]=4 12911 B7R1.9 CC[C@@H]1C[C@H]1CCl Amb28284868 [1,0,0,1,0,0|1,0,1]=4 12912 B7R1.9 CC[C@@H]1C[C@H]1CN Amb26431153 [1,0,0,1,0,0|1,0,1]=4 12913 B7R1.9 CC[C@@H]1C[C@H]1CN Amb28920814 [1,0,0,1,0,0|1,0,1]=4 12914 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,2]=4 12915 B7R1.9 CC[C@@H]1O[C@@H]1C=O Amb27640580 [1,0,0,1,0,0|1,0,0]=3 12916 B7R1.9 CC[C@H]1C[C@H]1CC Amb27391419 [1,0,0,1,0,0|0,0,1]=3 12917 B7R1.9 CNC1CC1CO Amb27838268 [1,0,0,1,0,0|2,0,0]=4 12918 B7R1.9 COC1CC1C=O Amb35720824 [1,0,0,1,0,0|1,0,0]=3 12919 B7R1.9 COC1CC1CBr Amb35732114 [1,0,0,1,0,0|2,0,0]=4 12920 B7R1.9 COC1CC1CCl Amb29849443 [1,0,0,1,0,0|2,0,0]=4 12921 B7R1.9 COC1CC1CN Amb35683740 [1,0,0,1,0,0|2,0,0]=4 12922 B7R1.9 COC1CC1CO Amb28137240 [1,0,0,1,0,0|2,0,0]=4 12923 B7R1.9 CO[C@H]1C[C@@H]1CO Amb27632061 [1,0,0,1,0,0|2,0,0]=4 12924 B7R1.9 N#CC1CC1C=O Amb24378434 [1,0,0,1,0,0|1,0,1]=4 12925 B7R1.9 O=CC1CC1C=O Amb27166180 [1,0,0,1,0,0|1,0,1]=4 12926 B7R1.9 O=C[C@H]1C[C@@H]1C=O Amb28057483 [1,0,0,1,0,0|1,0,1]=4 12927 B7R1.24 C1=CCCCCC1 Amb8515344 [1,0,0,1,0,0|0,0,1]=3 12928 B7R1.24 C1=CCCNCC1 Amb22169408 [1,0,0,1,0,0|1,0,1]=4 12929 B7R1.24 C1=CCCNCC1 Amb24530335 [1,0,0,1,0,0|1,0,1]=4 12930 B7R1.24 C1=CCNCCC1 Amb25104535 [1,0,0,1,0,0|1,0,1]=4 12931 B7R1.24 C1=CCNCCC1 Amb33330391 [1,0,0,1,0,0|1,0,1]=4 12932 B7R1.24 C1=COCCCC1 Amb28254269 [1,0,0,1,0,0|0,0,2]=4 12933 B7R1.24 C1=NCCCCC1 Amb27445210 [1,0,0,1,0,0|1,0,0]=3 12934 B7R1.24 C1CCCNCC1 Amb2792842 [1,0,0,1,0,0|1,0,0]=3 12935 B7R1.24 C1CCCOCC1 Amb22045221 [1,0,0,1,0,0|1,0,0]=3 12936 B7R1.24 C1CCNNCC1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 12937 B7R1.24 C1CCNOCC1 Amb28769693 [1,0,0,1,0,0|1,0,1]=4 12938 B7R1.24 C1CCSCSC1 Amb22227736 [1,0,0,1,0,0|2,0,0]=4 12939 B7R1.24 C1CNCCNC1 Amb2688726 [1,0,0,1,0,0|2,0,0]=4 12940 B7R1.24 C1CNCCNC1 Amb29844598 [1,0,0,1,0,0|2,0,0]=4 12941 B7R1.24 C1CNCCOC1 Amb19889085 [1,0,0,1,0,0|2,0,0]=4 12942 B7R1.24 C1CNCCOC1 Amb7094907 [1,0,0,1,0,0|2,0,0]=4 12943 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|2,0,0]=4 12944 B7R1.24 C1CNCCSC1 Amb9176341 [1,0,0,1,0,0|2,0,0]=4 12945 B9R1.7 C#CCC1CCC(=O)N1 Amb25742847 [0,1,0,1,0,0|1,0,1]=4 12946 B9R1.7 C=C1CCN(CCN)C1 Amb35591500 [0,1,0,1,0,0|2,0,0]=4 12947 B9R1.7 C=CCC1CCC(=O)C1 Amb26610303 [0,1,0,1,0,0|0,0,1]=3 12948 B9R1.7 C=CCN1CCC(=O)C1 Amb9480140 [0,1,0,1,0,0|0,0,2]=4 12949 B9R1.7 CC#CC1CCC(=O)N1 Amb27656036 [0,1,0,1,0,0|1,0,1]=4 12950 B9R1.7 CC1=CC(CC=O)CC1 Amb27644034 [0,1,0,1,0,0|1,0,1]=4 12951 B9R1.7 CC1=NCC(CCN)N1 Amb28245831 [0,1,0,1,0,0|2,0,0]=4 12952 B9R1.7 CC1CCC(CCBr)O1 Amb26943466 [0,1,0,1,0,0|0,0,2]=4 12953 B9R1.7 CC1CCC(CCN)C1 Amb25865066 [0,1,0,1,0,0|1,0,1]=4 12954 B9R1.7 CC1CCC(CCN)C1 Amb33482569 [0,1,0,1,0,0|1,0,1]=4 12955 B9R1.7 CC1CCC(CCN)N1 Amb23560219 [0,1,0,1,0,0|1,0,1]=4 12956 B9R1.7 CC1CCC(CCN)O1 Amb25107033 [0,1,0,1,0,0|0,0,2]=4 12957 B9R1.7 CC1CCC(CCO)C1 Amb28206116 [0,1,0,1,0,0|1,0,1]=4 12958 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|0,0,2]=4 12959 B9R1.7 CCCC1=CC(=O)CC1 Amb25337676 [0,1,0,1,0,0|0,0,1]=3 12960 B9R1.7 CCCC1=CC(=O)CO1 Amb27797456 [0,1,0,1,0,0|0,0,2]=4 12961 B9R1.7 CCCC1=NNC(=O)C1 Amb6346853 [0,1,0,1,0,0|1,0,1]=4 12962 B9R1.7 CCCC1=NOC(=O)C1 Amb24581199 [0,1,0,1,0,0|1,0,1]=4 12963 B9R1.7 CCCC1C=CC(=O)N1 Amb27752029 [0,1,0,1,0,0|1,0,1]=4 12964 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [0,1,0,1,0,0|1,0,1]=4 12965 B9R1.7 CCCC1CC(=O)CO1 Amb35722218 [0,1,0,1,0,0|0,0,0]=2 12966 B9R1.7 CCCC1CC(=O)CS1 Amb28132012 [0,1,0,1,0,0|0,0,0]=2 12967 B9R1.7 CCCC1CC(=O)NN1 Amb29862242 [0,1,0,1,0,0|1,0,0]=3 12968 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [0,1,0,1,0,0|1,0,1]=4 12969 B9R1.7 CCCC1CC(O)CO1 Amb35584946 [0,1,0,1,0,0|0,0,2]=4 12970 B9R1.7 CCCC1CCC(=O)C1 Amb24087435 [0,1,0,1,0,0|0,0,0]=2 12971 B9R1.7 CCCC1CCC(=O)O1 Amb8517544 [0,1,0,1,0,0|1,0,0]=3 12972 B9R1.7 CCCC1CCC(Cl)C1 Amb28201166 [0,1,0,1,0,0|1,0,1]=4 12973 B9R1.7 CCCC1CCC(N)C1 Amb26963448 [0,1,0,1,0,0|1,0,1]=4 12974 B9R1.7 CCCC1CCN(N)C1 Amb25189011 [0,1,0,1,0,0|2,0,0]=4 12975 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [0,1,0,1,0,0|0,0,0]=2 12976 B9R1.7 CCCC1CNC(=O)O1 Amb26947821 [0,1,0,1,0,0|1,0,0]=3 12977 B9R1.7 CCCC1CNC(=S)O1 Amb28347971 [0,1,0,1,0,0|1,0,1]=4 12978 B9R1.7 CCCC1CNC(C)=N1 Amb30021231 [0,1,0,1,0,0|1,0,0]=3 12979 B9R1.7 CCCC1CNC(O)=N1 Amb26898870 [0,1,0,1,0,0|1,0,1]=4 12980 B9R1.7 CCCC1CNC(S)=N1 Amb26499131 [0,1,0,1,0,0|1,1,0]=4 12981 B9R1.7 CCCC1COC(=O)C1 Amb26560581 [0,1,0,1,0,0|0,0,0]=2 12982 B9R1.7 CCCC1COC(=O)N1 Amb26628895 [0,1,0,1,0,0|1,0,0]=3 12983 B9R1.7 CCCC1COC(O)C1 Amb28315446 [0,1,0,1,0,0|0,0,2]=4 12984 B9R1.7 CCCC1OCC(C)O1 Amb4017566 [0,1,0,1,0,0|0,0,2]=4 12985 B9R1.7 CCCN1CCC(N)C1 Amb32412600 [0,1,0,1,0,0|1,0,1]=4 12986 B9R1.7 CCCN1CCC(N)C1 Amb8948567 [0,1,0,1,0,0|1,0,1]=4 12987 B9R1.7 CCCN1CCC(S)C1 Amb27251142 [0,1,0,1,0,0|0,1,1]=4 12988 B9R1.7 CCCN1CC[C@@H](N)C1 Amb27838584 [0,1,0,1,0,0|1,0,1]=4 12989 B9R1.7 CCCN1CC[C@H](N)C1 Amb27596602 [0,1,0,1,0,0|1,0,1]=4 12990 B9R1.7 CCC[C@@H]1C=CC(=O)N1 Amb27876443 [0,1,0,1,0,0|1,0,1]=4 12991 B9R1.7 CCC[C@@H]1CC[C@H](C)N1 Amb27473308 [0,1,0,1,0,0|1,0,1]=4 12992 B9R1.7 CCC[C@@H]1COC(=O)N1 Amb28133695 [0,1,0,1,0,0|1,0,0]=3 12993 B9R1.7 CCC[C@H]1CCC(=O)O1 Amb28397464 [0,1,0,1,0,0|1,0,0]=3 12994 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [0,1,0,1,0,0|0,0,0]=2 12995 B9R1.7 CCC[C@H]1COC(=O)C1 Amb33725639 [0,1,0,1,0,0|0,0,0]=2 12996 B9R1.7 CCC[C@H]1COC(=O)N1 Amb27484954 [0,1,0,1,0,0|1,0,0]=3 12997 B9R1.7 CCC[C@H]1COC(O)C1 Amb28315422 [0,1,0,1,0,0|0,0,2]=4 12998 B9R1.7 CCNC1CCC(=O)C1 Amb27972271 [0,1,0,1,0,0|0,0,0]=2 12999 B9R1.7 CCNC1CCN(C)C1 Amb8948078 [0,1,0,1,0,0|2,0,0]=4 13000 B9R1.7 CCNC1CNC(=O)C1 Amb28049213 [0,1,0,1,0,0|1,0,0]=3 13001 B9R1.7 CCN[C@@H]1CCN(C)C1 Amb22230643 [0,1,0,1,0,0|2,0,0]=4 13002 B9R1.7 CCN[C@H]1CCN(C)C1 Amb22230700 [0,1,0,1,0,0|2,0,0]=4 13003 B9R1.7 CCOC1=CC(=O)CC1 Amb21984008 [0,1,0,1,0,0|0,0,2]=4 13004 B9R1.7 CCOC1=NC(=O)CC1 Amb28385432 [0,1,0,1,0,0|1,0,1]=4 13005 B9R1.7 CCOC1CCC(=O)C1 Amb27953350 [0,1,0,1,0,0|0,0,0]=2 13006 B9R1.7 CCOC1CCC(=O)N1 Amb2612716 [0,1,0,1,0,0|1,0,0]=3 13007 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,1,0,1,0,0|1,0,0]=3 13008 B9R1.7 CCOC1COC(=O)N1 Amb27799203 [0,1,0,1,0,0|2,0,0]=4 13009 B9R1.7 CCOC1OC(=O)CS1 Amb24373299 [0,1,0,1,0,0|2,0,0]=4 13010 B9R1.7 CCO[C@H]1CC[C@@H](N)C1 Amb27445592 [0,1,0,1,0,0|1,0,1]=4 13011 B9R1.7 CCSC1CCC(=O)C1 Amb27248280 [0,1,0,1,0,0|0,0,0]=2 13012 B9R1.7 CCSC1CCC(=O)N1 Amb28131675 [0,1,0,1,0,0|1,0,0]=3 13013 B9R1.7 CCSC1CCC(N)C1 Amb19148312 [0,1,0,1,0,0|1,0,1]=4 13014 B9R1.7 CCSC1CNC(=O)O1 Amb27174206 [0,1,0,1,0,0|2,0,0]=4 13015 B9R1.7 CN1CCC(CCN)C1 Amb32668983 [0,1,0,1,0,0|2,0,0]=4 13016 B9R1.7 CN1CCC(CCN)C1 Amb9782410 [0,1,0,1,0,0|2,0,0]=4 13017 B9R1.7 CN1CCC(CCO)C1 Amb22585688 [0,1,0,1,0,0|2,0,0]=4 13018 B9R1.7 CN1CCC(CCO)C1 Amb32665383 [0,1,0,1,0,0|2,0,0]=4 13019 B9R1.7 CNCC1CC(C)=NO1 Amb10249072 [0,1,0,1,0,0|1,0,1]=4 13020 B9R1.7 CNCC1CCC(=O)N1 Amb2372617 [0,1,0,1,0,0|1,0,0]=3 13021 B9R1.7 CNCC1CCC(=O)O1 Amb28326084 [0,1,0,1,0,0|1,0,0]=3 13022 B9R1.7 CNCC1CCC(C)C1 Amb27405406 [0,1,0,1,0,0|1,0,1]=4 13023 B9R1.7 CNCC1CCC(C)O1 Amb18642726 [0,1,0,1,0,0|0,0,2]=4 13024 B9R1.7 CNCC1CCC(Cl)C1 Amb28061718 [0,1,0,1,0,0|1,0,1]=4 13025 B9R1.7 CNCC1CCC(N)C1 Amb27231577 [0,1,0,1,0,0|1,0,1]=4 13026 B9R1.7 CNCC1CCC(O)C1 Amb28049206 [0,1,0,1,0,0|0,0,2]=4 13027 B9R1.7 CNCC1CCN(C)C1 Amb5400494 [0,1,0,1,0,0|2,0,0]=4 13028 B9R1.7 CNCC1CC[C@@H](C)O1 Amb33423401 [0,1,0,1,0,0|0,0,2]=4 13029 B9R1.7 CNCC1CNC(=O)C1 Amb8009793 [0,1,0,1,0,0|1,0,0]=3 13030 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [0,1,0,1,0,0|2,0,0]=4 13031 B9R1.7 CNCC1COC(=O)O1 Amb27619965 [0,1,0,1,0,0|2,0,0]=4 13032 B9R1.7 CNC[C@@H]1CCC(=O)N1 Amb32664378 [0,1,0,1,0,0|1,0,0]=3 13033 B9R1.7 CNC[C@@H]1CCC(=O)N1 Amb33032826 [0,1,0,1,0,0|1,0,0]=3 13034 B9R1.7 CNC[C@@H]1CCC(=O)O1 Amb27848226 [0,1,0,1,0,0|1,0,0]=3 13035 B9R1.7 CNC[C@@H]1CC[C@H](N)C1 Amb33071905 [0,1,0,1,0,0|1,0,1]=4 13036 B9R1.7 CNC[C@@H]1CNC(=O)O1 Amb27631362 [0,1,0,1,0,0|2,0,0]=4 13037 B9R1.7 COCC1=CC(=O)CC1 Amb27754476 [0,1,0,1,0,0|0,0,2]=4 13038 B9R1.7 COCC1CC(=O)CO1 Amb35726675 [0,1,0,1,0,0|1,0,0]=3 13039 B9R1.7 COCC1CC(=O)NN1 Amb35694031 [0,1,0,1,0,0|2,0,0]=4 13040 B9R1.7 COCC1CCC(=O)C1 Amb27842051 [0,1,0,1,0,0|0,0,0]=2 13041 B9R1.7 COCC1CCC(=O)O1 Amb26558471 [0,1,0,1,0,0|1,0,0]=3 13042 B9R1.7 COCC1CCC(Cl)C1 Amb27441623 [0,1,0,1,0,0|1,0,1]=4 13043 B9R1.7 COCC1CCC(N)C1 Amb25683802 [0,1,0,1,0,0|1,0,1]=4 13044 B9R1.7 COCC1CNC(=O)C1 Amb25693762 [0,1,0,1,0,0|1,0,0]=3 13045 B9R1.7 COCC1CNC(=O)O1 Amb27794676 [0,1,0,1,0,0|2,0,0]=4 13046 B9R1.7 COCC1CNC(C)=N1 Amb35737151 [0,1,0,1,0,0|2,0,0]=4 13047 B9R1.7 COCC1COC(=O)N1 Amb26969707 [0,1,0,1,0,0|2,0,0]=4 13048 B9R1.7 COCC1COC(=O)O1 Amb26318830 [0,1,0,1,0,0|2,0,0]=4 13049 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [0,1,0,1,0,0|2,0,0]=4 13050 B9R1.7 COC[C@H]1CCC(N)=N1 Amb27954012 [0,1,0,1,0,0|2,0,0]=4 13051 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [0,1,0,1,0,0|2,0,0]=4 13052 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [0,1,0,1,0,0|2,0,0]=4 13053 B9R1.7 CSCC1CCC(C)N1 Amb28397280 [0,1,0,1,0,0|1,0,1]=4 13054 B9R1.7 CSCC1CCC(N)C1 Amb27786081 [0,1,0,1,0,0|1,0,1]=4 13055 B9R1.7 CSCC1CNC(=O)C1 Amb25888802 [0,1,0,1,0,0|1,0,0]=3 13056 B9R1.7 CSCC1CNC(=O)O1 Amb28193245 [0,1,0,1,0,0|2,0,0]=4 13057 B9R1.7 CSCC1COC(=O)N1 Amb25304404 [0,1,0,1,0,0|2,0,0]=4 13058 B9R1.7 CSC[C@H]1COC(=O)N1 Amb27945522 [0,1,0,1,0,0|2,0,0]=4 13059 B9R1.7 C[C@@H]1CCC(CCBr)O1 Amb33331134 [0,1,0,1,0,0|0,0,2]=4 13060 B9R1.7 C[C@@H]1CCC(CCN)O1 Amb33423877 [0,1,0,1,0,0|0,0,2]=4 13061 B9R1.7 C[C@@H]1CCC(CCO)O1 Amb33423278 [0,1,0,1,0,0|0,0,2]=4 13062 B9R1.7 C[C@@H]1CCC(CCS)O1 Amb32730400 [0,1,0,1,0,0|0,0,2]=4 13063 B9R1.7 C[C@@H]1CC[C@@H](CCO)N1 Amb27438106 [0,1,0,1,0,0|1,0,1]=4 13064 B9R1.7 C[C@@H]1CC[C@H](CCO)N1 Amb32946591 [0,1,0,1,0,0|1,0,1]=4 13065 B9R1.7 C[C@H]1CC[C@@H](CCO)N1 Amb27439132 [0,1,0,1,0,0|1,0,1]=4 13066 B9R1.7 C[NH2+]C[C@@H]1CCC(=O)O1 Amb28464027 [0,1,0,1,0,0|1,0,0]=3 13067 B9R1.7 C\C=C\C1CCC(=O)C1 Amb28065825 [0,1,0,1,0,0|0,0,1]=3 13068 B9R1.7 C\C=C\[C@H]1CCC(=O)C1 Amb27490903 [0,1,0,1,0,0|0,0,1]=3 13069 B9R1.7 N#CCC1CCC(=O)N1 Amb2372618 [0,1,0,1,0,0|1,0,1]=4 13070 B9R1.7 N#CCN1CCC(=O)C1 Amb28137751 [0,1,0,1,0,0|1,0,1]=4 13071 B9R1.7 N#CC[C@@H]1CCC(=O)N1 Amb23385242 [0,1,0,1,0,0|1,0,1]=4 13072 B9R1.7 N#CC[C@H]1CCC(=O)N1 Amb23385279 [0,1,0,1,0,0|1,0,1]=4 13073 B9R1.7 NC1CCC(CCO)C1 Amb26889980 [0,1,0,1,0,0|1,0,1]=4 13074 B9R1.7 NCCC1CCC(=O)N1 Amb18832609 [0,1,0,1,0,0|1,0,0]=3 13075 B9R1.7 NCCC1CCC(=O)N1 Amb32652430 [0,1,0,1,0,0|1,0,0]=3 13076 B9R1.7 NCCC1CCC(F)C1 Amb28060508 [0,1,0,1,0,0|1,0,1]=4 13077 B9R1.7 NCCC1CCC(O)C1 Amb27790532 [0,1,0,1,0,0|0,0,2]=4 13078 B9R1.7 NCCC1CNC(=O)C1 Amb18832612 [0,1,0,1,0,0|1,0,0]=3 13079 B9R1.7 NCCC1CNC(=O)C1 Amb32666581 [0,1,0,1,0,0|1,0,0]=3 13080 B9R1.7 NCCC1CNC(=O)O1 Amb27628589 [0,1,0,1,0,0|2,0,0]=4 13081 B9R1.7 NCCC1COC(=O)N1 Amb24732121 [0,1,0,1,0,0|2,0,0]=4 13082 B9R1.7 NCCN1CCC(=O)C1 Amb27460887 [0,1,0,1,0,0|1,0,0]=3 13083 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb26588427 [0,1,0,1,0,0|1,0,0]=3 13084 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb32664350 [0,1,0,1,0,0|1,0,0]=3 13085 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|0,0,2]=4 13086 B9R1.7 NOCC1CNC(=O)C1 Amb27879907 [0,1,0,1,0,0|2,0,0]=4 13087 B9R1.7 N[C@@H]1CC[C@H](CCO)C1 Amb33803500 [0,1,0,1,0,0|1,0,1]=4 13088 B9R1.7 O=C1C=CC(CCO)C1 Amb27256296 [0,1,0,1,0,0|0,0,2]=4 13089 B9R1.7 O=C1CC(CCF)CN1 Amb33196064 [0,1,0,1,0,0|1,0,0]=3 13090 B9R1.7 O=C1CC(CCO)CN1 Amb23598230 [0,1,0,1,0,0|1,0,0]=3 13091 B9R1.7 O=C1CCC(CCBr)C1 Amb27592180 [0,1,0,1,0,0|0,0,0]=2 13092 B9R1.7 O=C1CCC(CCBr)O1 Amb27657784 [0,1,0,1,0,0|1,0,0]=3 13093 B9R1.7 O=C1CCC(CCO)N1 Amb8392541 [0,1,0,1,0,0|1,0,0]=3 13094 B9R1.7 O=C1CCC(CCS)O1 Amb28285189 [0,1,0,1,0,0|1,0,0]=3 13095 B9R1.7 O=C1CC[C@@H](CCO)N1 Amb24761403 [0,1,0,1,0,0|1,0,0]=3 13096 B9R1.7 O=C1CC[C@H](CCBr)O1 Amb27791548 [0,1,0,1,0,0|1,0,0]=3 13097 B9R1.7 O=C1CC[C@H](CCO)N1 Amb26403176 [0,1,0,1,0,0|1,0,0]=3 13098 B9R1.7 O=C1NC(CCF)CO1 Amb33195803 [0,1,0,1,0,0|2,0,0]=4 13099 B9R1.7 O=C1NCC(CCF)O1 Amb33195802 [0,1,0,1,0,0|2,0,0]=4 13100 B9R1.7 O=C1NCC(CCO)N1 Amb26597295 [0,1,0,1,0,0|2,0,0]=4 13101 B9R1.7 O=CCC1CCC(=O)C1 Amb18642410 [0,1,0,1,0,0|0,0,1]=3 13102 B9R1.7 O=CCC1CCC(=O)O1 Amb27873383 [0,1,0,1,0,0|1,0,1]=4 13103 B9R1.7 O=CC[C@H]1CCC(=O)C1 Amb27961372 [0,1,0,1,0,0|0,0,1]=3 13104 B9R1.7 OC1CCC(CCS)C1 Amb27835966 [0,1,0,1,0,0|0,0,2]=4 13105 B9R1.7 OCC[C@@H]1CC[C@H](O)C1 Amb28070933 [0,1,0,1,0,0|0,0,2]=4 13106 B9R1.13 BrC(Br)=CC1CCCC1 Amb27162089 [0,1,0,1,0,0|2,0,0]=4 13107 B9R1.13 C=C(Br)CN1CCCC1 Amb4161094 [0,1,0,1,0,0|1,0,1]=4 13108 B9R1.13 C=C(C)CC1CC=CC1 Amb30031954 [0,1,0,1,0,0|1,0,1]=4 13109 B9R1.13 C=C(C)CC1CCCC1 Amb22052678 [0,1,0,1,0,0|1,0,0]=3 13110 B9R1.13 C=C(C)CC1CCCN1 Amb25162820 [0,1,0,1,0,0|1,0,0]=3 13111 B9R1.13 C=C(C)CC1CCCO1 Amb29857297 [0,1,0,1,0,0|1,0,0]=3 13112 B9R1.13 C=C(C)CC1CCNC1 Amb27866319 [0,1,0,1,0,0|1,0,0]=3 13113 B9R1.13 C=C(C)CC1CCOC1 Amb29857298 [0,1,0,1,0,0|1,0,0]=3 13114 B9R1.13 C=C(C)CN1CCCN1 Amb28068127 [0,1,0,1,0,0|2,0,0]=4 13115 B9R1.13 C=C(C)CN1CCCO1 Amb27956554 [0,1,0,1,0,0|2,0,0]=4 13116 B9R1.13 CC(=O)C=C1CCCC1 Amb2699510 [0,1,0,1,0,0|0,0,1]=3 13117 B9R1.13 CC(=O)CC1C=CCC1 Amb2721318 [0,1,0,1,0,0|0,0,1]=3 13118 B9R1.13 CC(=O)CC1C=CCO1 Amb28251003 [0,1,0,1,0,0|0,0,2]=4 13119 B9R1.13 CC(=O)CC1CCCC1 Amb2721149 [0,1,0,1,0,0|0,0,0]=2 13120 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [0,1,0,1,0,0|0,0,0]=2 13121 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|0,0,0]=2 13122 B9R1.13 CC(=O)CC1CCCS1 Amb33416251 [0,1,0,1,0,0|0,0,0]=2 13123 B9R1.13 CC(=O)CC1CCNC1 Amb26624949 [0,1,0,1,0,0|0,0,0]=2 13124 B9R1.13 CC(=O)CC1CCOC1 Amb20622791 [0,1,0,1,0,0|0,0,0]=2 13125 B9R1.13 CC(=O)CC1CCSC1 Amb33141833 [0,1,0,1,0,0|0,0,0]=2 13126 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|1,0,0]=3 13127 B9R1.13 CC(=O)C[C@@H]1C=CCO1 Amb28193210 [0,1,0,1,0,0|0,0,2]=4 13128 B9R1.13 CC(=O)C[C@H]1CCCN1 Amb25887375 [0,1,0,1,0,0|0,0,0]=2 13129 B9R1.13 CC(=O)NC1=CCCC1 Amb28130431 [0,1,0,1,0,0|0,0,2]=4 13130 B9R1.13 CC(=O)NC1CC=CC1 Amb27983434 [0,1,0,1,0,0|0,0,2]=4 13131 B9R1.13 CC(=O)NC1CCCC1 Amb3367351 [0,1,0,1,0,0|0,0,0]=2 13132 B9R1.13 CC(=O)NC1CCCN1 Amb28400896 [0,1,0,1,0,0|1,0,0]=3 13133 B9R1.13 CC(=O)NC1CCNC1 Amb32412611 [0,1,0,1,0,0|1,0,0]=3 13134 B9R1.13 CC(=O)NC1CCNC1 Amb33531966 [0,1,0,1,0,0|1,0,0]=3 13135 B9R1.13 CC(=O)N[C@@H]1CCNC1 Amb10067002 [0,1,0,1,0,0|1,0,0]=3 13136 B9R1.13 CC(=O)N[C@H]1CCNC1 Amb22744974 [0,1,0,1,0,0|1,0,0]=3 13137 B9R1.13 CC(=O)N[C@H]1CCNC1 Amb8631248 [0,1,0,1,0,0|1,0,0]=3 13138 B9R1.13 CC(=O)N[C@H]1CNOC1 Amb33098987 [0,1,0,1,0,0|2,0,0]=4 13139 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,1,0,1,0,0|1,0,0]=3 13140 B9R1.13 CC(=O)OC1CCNC1 Amb22011811 [0,1,0,1,0,0|1,0,0]=3 13141 B9R1.13 CC(=O)O[C@H]1CCNC1 Amb27592400 [0,1,0,1,0,0|1,0,0]=3 13142 B9R1.13 CC(=O)O[C@H]1CCOC1 Amb27254860 [0,1,0,1,0,0|1,0,0]=3 13143 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [0,1,0,1,0,0|0,0,0]=2 13144 B9R1.13 CC(=O)SC1CCOC1 Amb13892074 [0,1,0,1,0,0|1,0,0]=3 13145 B9R1.13 CC(=O)\C=C1\CCCN1 Amb17593301 [0,1,0,1,0,0|0,0,2]=4 13146 B9R1.13 CC(=O)\C=C1\CCCO1 Amb25241353 [0,1,0,1,0,0|0,0,2]=4 13147 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|1,0,1]=4 13148 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,1,0,1,0,0|1,0,1]=4 13149 B9R1.13 CC(Br)CC1CCCS1 Amb33433064 [0,1,0,1,0,0|1,0,1]=4 13150 B9R1.13 CC(Br)CC1CCOC1 Amb29857307 [0,1,0,1,0,0|1,0,1]=4 13151 B9R1.13 CC(Br)CC1CCSC1 Amb33333801 [0,1,0,1,0,0|1,0,1]=4 13152 B9R1.13 CC(C)=CC1CCCN1 Amb28437317 [0,1,0,1,0,0|1,0,1]=4 13153 B9R1.13 CC(C)=CC1CCNC1 Amb28130925 [0,1,0,1,0,0|1,0,1]=4 13154 B9R1.13 CC(C)=CN1CCCC1 Amb15693470 [0,1,0,1,0,0|1,0,1]=4 13155 B9R1.13 CC(C)=C[C@H]1CCCN1 Amb28436823 [0,1,0,1,0,0|1,0,1]=4 13156 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|1,0,1]=4 13157 B9R1.13 CC(C)CC1CCCN1 Amb10068751 [0,1,0,1,0,0|1,0,1]=4 13158 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|1,0,1]=4 13159 B9R1.13 CC(C)CC1CCNC1 Amb10607826 [0,1,0,1,0,0|1,0,1]=4 13160 B9R1.13 CC(C)CC1CCNC1 Amb32411737 [0,1,0,1,0,0|1,0,1]=4 13161 B9R1.13 CC(C)CN1CCCC1 Amb17231850 [0,1,0,1,0,0|1,0,1]=4 13162 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|1,0,1]=4 13163 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|1,0,1]=4 13164 B9R1.13 CC(C)NC1CCCC1 Amb6247725 [0,1,0,1,0,0|1,0,1]=4 13165 B9R1.13 CC(C)NC1CCCC1 Amb6892354 [0,1,0,1,0,0|1,0,1]=4 13166 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,1,0,1,0,0|1,0,1]=4 13167 B9R1.13 CC(Cl)CC1CCOC1 Amb29857271 [0,1,0,1,0,0|1,0,1]=4 13168 B9R1.13 CC(Cl)CC1CCSC1 Amb35688984 [0,1,0,1,0,0|1,0,1]=4 13169 B9R1.13 CC(Cl)CN1CCCC1 Amb27165761 [0,1,0,1,0,0|1,0,1]=4 13170 B9R1.13 CC(F)CC1CCNC1 Amb27967975 [0,1,0,1,0,0|1,0,1]=4 13171 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|1,0,1]=4 13172 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,1,0,1,0,0|1,0,1]=4 13173 B9R1.13 CC(N)CC1CCOC1 Amb18959070 [0,1,0,1,0,0|1,0,1]=4 13174 B9R1.13 CC(N)CC1CCSC1 Amb29857282 [0,1,0,1,0,0|1,0,1]=4 13175 B9R1.13 CC(N)CN1CCCC1 Amb33801437 [0,1,0,1,0,0|1,0,1]=4 13176 B9R1.13 CC(N)CN1CCCC1 Amb9710549 [0,1,0,1,0,0|1,0,1]=4 13177 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,1,0,1,0,0|0,0,2]=4 13178 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|0,0,2]=4 13179 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,1,0,1,0,0|0,0,2]=4 13180 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|0,0,2]=4 13181 B9R1.13 CC(O)CC1CCNC1 Amb27258166 [0,1,0,1,0,0|0,0,2]=4 13182 B9R1.13 CC(O)CC1CCOC1 Amb25888927 [0,1,0,1,0,0|0,0,2]=4 13183 B9R1.13 CC(O)CC1CCSC1 Amb33345807 [0,1,0,1,0,0|0,0,2]=4 13184 B9R1.13 CC(O)CN1CCCC1 Amb32665261 [0,1,0,1,0,0|0,0,2]=4 13185 B9R1.13 CC(O)CN1CCCC1 Amb4017595 [0,1,0,1,0,0|0,0,2]=4 13186 B9R1.13 CC(S)CC1CCCC1 Amb29857286 [0,1,0,1,0,0|0,1,1]=4 13187 B9R1.13 CC(S)CC1CCCN1 Amb32788357 [0,1,0,1,0,0|0,1,1]=4 13188 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,1,0,1,0,0|0,1,1]=4 13189 B9R1.13 CC(S)CC1CCOC1 Amb29857288 [0,1,0,1,0,0|0,1,1]=4 13190 B9R1.13 CN(C)CC1CCCC1 Amb17231852 [0,1,0,1,0,0|2,0,0]=4 13191 B9R1.13 CN(C)CC1CCCN1 Amb19372997 [0,1,0,1,0,0|2,0,0]=4 13192 B9R1.13 CN(C)CC1CCCN1 Amb2235830 [0,1,0,1,0,0|2,0,0]=4 13193 B9R1.13 CN(C)CC1CCCN1 Amb2237185 [0,1,0,1,0,0|2,0,0]=4 13194 B9R1.13 CN(C)CC1CCCO1 Amb25075157 [0,1,0,1,0,0|2,0,0]=4 13195 B9R1.13 CN(C)CC1CCNC1 Amb20671402 [0,1,0,1,0,0|2,0,0]=4 13196 B9R1.13 CN(C)CC1CCNC1 Amb22728251 [0,1,0,1,0,0|2,0,0]=4 13197 B9R1.13 CN(C)CC1CCNC1 Amb9777152 [0,1,0,1,0,0|2,0,0]=4 13198 B9R1.13 CN(C)C[C@@H]1CCCN1 Amb20671401 [0,1,0,1,0,0|2,0,0]=4 13199 B9R1.13 CN(C)C[C@@H]1CCCN1 Amb22230578 [0,1,0,1,0,0|2,0,0]=4 13200 B9R1.13 CN(C)C[C@@H]1CCCN1 Amb33622260 [0,1,0,1,0,0|2,0,0]=4 13201 B9R1.13 CN(C)C[C@@H]1CCNC1 Amb27949860 [0,1,0,1,0,0|2,0,0]=4 13202 B9R1.13 CN(C)C[C@@H]1CCNC1 Amb33806133 [0,1,0,1,0,0|2,0,0]=4 13203 B9R1.13 CN(C)C[C@H]1CCCN1 Amb26954563 [0,1,0,1,0,0|2,0,0]=4 13204 B9R1.13 CN(C)C[C@H]1CCNC1 Amb25146018 [0,1,0,1,0,0|2,0,0]=4 13205 B9R1.13 CN(C)C[C@H]1CCNC1 Amb31308555 [0,1,0,1,0,0|2,0,0]=4 13206 B9R1.13 CN(O)CC1CCCC1 Amb33378902 [0,1,0,1,0,0|1,0,1]=4 13207 B9R1.13 CN(O)CC1CCCO1 Amb33318754 [0,1,0,1,0,0|1,0,1]=4 13208 B9R1.13 CN(O)CC1CCCS1 Amb33416201 [0,1,0,1,0,0|1,0,1]=4 13209 B9R1.13 CN(O)CC1CCOC1 Amb33420778 [0,1,0,1,0,0|1,0,1]=4 13210 B9R1.13 CN(O)CC1CCSC1 Amb33141649 [0,1,0,1,0,0|1,0,1]=4 13211 B9R1.13 CS(=O)N=C1CCCC1 Amb35681682 [0,1,0,1,0,0|1,0,1]=4 13212 B9R1.13 CS(=O)NC1CCCC1 Amb27191965 [0,1,0,1,0,0|1,0,0]=3 13213 B9R1.13 CS(=O)N[C@H]1CCNC1 Amb28319345 [0,1,0,1,0,0|2,0,0]=4 13214 B9R1.13 C[C@@H](N)CC1CCCC1 Amb28423841 [0,1,0,1,0,0|1,0,1]=4 13215 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|1,0,1]=4 13216 B9R1.13 C[C@@H](N)CC1CCCS1 Amb33416796 [0,1,0,1,0,0|1,0,1]=4 13217 B9R1.13 C[C@@H](N)CC1CCOC1 Amb25720103 [0,1,0,1,0,0|1,0,1]=4 13218 B9R1.13 C[C@@H](N)CC1CCSC1 Amb33141507 [0,1,0,1,0,0|1,0,1]=4 13219 B9R1.13 C[C@@H](N)CN1CCCC1 Amb25921110 [0,1,0,1,0,0|1,0,1]=4 13220 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,1,0,1,0,0|0,0,2]=4 13221 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,1,0,1,0,0|0,0,2]=4 13222 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,1,0,1,0,0|0,0,2]=4 13223 B9R1.13 C[C@@H](O)CC1CCOC1 Amb33420739 [0,1,0,1,0,0|0,0,2]=4 13224 B9R1.13 C[C@@H](O)CC1CCSC1 Amb33141518 [0,1,0,1,0,0|0,0,2]=4 13225 B9R1.13 C[C@@H](O)CN1CCCC1 Amb26069529 [0,1,0,1,0,0|0,0,2]=4 13226 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,1,0,1,0,0|0,0,2]=4 13227 B9R1.13 C[C@H](N)CC1CCCC1 Amb27949784 [0,1,0,1,0,0|1,0,1]=4 13228 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,1,0,1,0,0|1,0,1]=4 13229 B9R1.13 C[C@H](N)CC1CCCS1 Amb33416790 [0,1,0,1,0,0|1,0,1]=4 13230 B9R1.13 C[C@H](N)CC1CCOC1 Amb26933577 [0,1,0,1,0,0|1,0,1]=4 13231 B9R1.13 C[C@H](N)CC1CCSC1 Amb33141501 [0,1,0,1,0,0|1,0,1]=4 13232 B9R1.13 C[C@H](N)CN1CCCC1 Amb27867537 [0,1,0,1,0,0|1,0,1]=4 13233 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,1,0,1,0,0|0,0,2]=4 13234 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|0,0,2]=4 13235 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,1,0,1,0,0|0,0,2]=4 13236 B9R1.13 C[C@H](O)CC1CCOC1 Amb33420740 [0,1,0,1,0,0|0,0,2]=4 13237 B9R1.13 C[C@H](O)CC1CCSC1 Amb33141519 [0,1,0,1,0,0|0,0,2]=4 13238 B9R1.13 C[C@H](O)CN1CCCC1 Amb26477879 [0,1,0,1,0,0|0,0,2]=4 13239 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,1,0,1,0,0|0,0,2]=4 13240 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,1,0,1,0,0|0,0,2]=4 13241 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,1,0,1,0,0|0,0,2]=4 13242 B9R1.13 N=C(N)CC1CCCC1 Amb28381044 [0,1,0,1,0,0|2,0,0]=4 13243 B9R1.13 N=C(N)CC1CCCC1 Amb28934951 [0,1,0,1,0,0|2,0,0]=4 13244 B9R1.13 N=C(N)CC1CCCS1 Amb33416788 [0,1,0,1,0,0|2,0,0]=4 13245 B9R1.13 N=C(N)CC1CCOC1 Amb25132816 [0,1,0,1,0,0|2,0,0]=4 13246 B9R1.13 N=C(N)CC1CCSC1 Amb32672202 [0,1,0,1,0,0|2,0,0]=4 13247 B9R1.13 N=C(N)CN1CCCC1 Amb33548937 [0,1,0,1,0,0|2,0,0]=4 13248 B9R1.13 N=C(N)CN1CCCC1 Amb6258627 [0,1,0,1,0,0|2,0,0]=4 13249 B9R1.13 N=C(N)NC1CCCC1 Amb17773433 [0,1,0,1,0,0|2,0,0]=4 13250 B9R1.13 N=C(N)NC1CCCC1 Amb22828136 [0,1,0,1,0,0|2,0,0]=4 13251 B9R1.13 N=C(N)NC1CCCC1 Amb6419484 [0,1,0,1,0,0|2,0,0]=4 13252 B9R1.13 N=C(N)SC1CCCC1 Amb27461692 [0,1,0,1,0,0|2,0,0]=4 13253 B9R1.13 NC(=O)C=C1CCCC1 Amb20622621 [0,1,0,1,0,0|1,0,1]=4 13254 B9R1.13 NC(=O)CC1C=CCC1 Amb16233726 [0,1,0,1,0,0|1,0,1]=4 13255 B9R1.13 NC(=O)CC1CC=CC1 Amb27837715 [0,1,0,1,0,0|1,0,1]=4 13256 B9R1.13 NC(=O)CC1CCCC1 Amb6892422 [0,1,0,1,0,0|1,0,0]=3 13257 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [0,1,0,1,0,0|1,0,0]=3 13258 B9R1.13 NC(=O)CC1CCCN1 Amb28934952 [0,1,0,1,0,0|1,0,0]=3 13259 B9R1.13 NC(=O)CC1CCNC1 Amb27169655 [0,1,0,1,0,0|1,0,0]=3 13260 B9R1.13 NC(=O)CC1CCNC1 Amb32653198 [0,1,0,1,0,0|1,0,0]=3 13261 B9R1.13 NC(=O)CC1CCNC1 Amb32667283 [0,1,0,1,0,0|1,0,0]=3 13262 B9R1.13 NC(=O)CC1CCSC1 Amb32672204 [0,1,0,1,0,0|1,0,0]=3 13263 B9R1.13 NC(=O)CC1CCSS1 Amb27814178 [0,1,0,1,0,0|2,0,0]=4 13264 B9R1.13 NC(=O)CC1OCCO1 Amb27837657 [0,1,0,1,0,0|2,0,0]=4 13265 B9R1.13 NC(=O)CN1CCCO1 Amb27170000 [0,1,0,1,0,0|2,0,0]=4 13266 B9R1.13 NC(=O)CN1CCSC1 Amb27759902 [0,1,0,1,0,0|2,0,0]=4 13267 B9R1.13 NC(=O)C[C@@H]1CCNC1 Amb35688629 [0,1,0,1,0,0|1,0,0]=3 13268 B9R1.13 NC(=O)C[C@H]1CCNC1 Amb35674876 [0,1,0,1,0,0|1,0,0]=3 13269 B9R1.13 NC(=O)C[C@H]1CCOC1 Amb27837647 [0,1,0,1,0,0|1,0,0]=3 13270 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [0,1,0,1,0,0|1,0,0]=3 13271 B9R1.13 NC(=O)NC1CCNC1 Amb28934939 [0,1,0,1,0,0|2,0,0]=4 13272 B9R1.13 NC(=O)NC1CCNC1 Amb9467923 [0,1,0,1,0,0|2,0,0]=4 13273 B9R1.13 NC(=O)NC1CCOC1 Amb28046693 [0,1,0,1,0,0|2,0,0]=4 13274 B9R1.13 NC(=O)N[C@H]1CCNC1 Amb27838506 [0,1,0,1,0,0|2,0,0]=4 13275 B9R1.13 NC(=O)OC1CCCC1 Amb2617542 [0,1,0,1,0,0|1,0,0]=3 13276 B9R1.13 NC(=S)CC1CCCC1 Amb26475206 [0,1,0,1,0,0|1,1,0]=4 13277 B9R1.13 NC(=S)CC1CCCO1 Amb6242594 [0,1,0,1,0,0|1,1,0]=4 13278 B9R1.13 NC(=S)CC1CCCS1 Amb33416787 [0,1,0,1,0,0|1,1,0]=4 13279 B9R1.13 NC(=S)CC1CCOC1 Amb27971678 [0,1,0,1,0,0|1,1,0]=4 13280 B9R1.13 NC(=S)CC1CCSC1 Amb32672203 [0,1,0,1,0,0|1,1,0]=4 13281 B9R1.13 NC(=S)CN1CCCC1 Amb6268794 [0,1,0,1,0,0|1,1,0]=4 13282 B9R1.13 NC(=S)NC1CCCC1 Amb1105651 [0,1,0,1,0,0|1,1,0]=4 13283 B9R1.13 NC(N)=NC1CCCC1 Amb19338139 [0,1,0,1,0,0|2,0,0]=4 13284 B9R1.13 NC(N)=NC1CCCC1 Amb33527554 [0,1,0,1,0,0|2,0,0]=4 13285 B9R1.13 NS(=O)CC1CCCC1 Amb32720316 [0,1,0,1,0,0|2,0,0]=4 13286 B9R1.13 NS(=O)CC1CCCO1 Amb32720353 [0,1,0,1,0,0|2,0,0]=4 13287 B9R1.13 NS(=O)CC1CCOC1 Amb32720367 [0,1,0,1,0,0|2,0,0]=4 13288 B9R1.13 O=C(Cl)CC1CCCC1 Amb3939570 [0,1,0,1,0,0|1,0,0]=3 13289 B9R1.13 O=C(Cl)CC1CCCN1 Amb27792098 [0,1,0,1,0,0|1,0,0]=3 13290 B9R1.13 O=C(Cl)CC1CCCO1 Amb25921099 [0,1,0,1,0,0|1,0,0]=3 13291 B9R1.13 O=C(Cl)CC1CCOC1 Amb22642272 [0,1,0,1,0,0|1,0,0]=3 13292 B9R1.13 O=C(Cl)CN1CCCC1 Amb17142871 [0,1,0,1,0,0|1,0,0]=3 13293 B9R1.13 O=C(Cl)NC1CCCC1 Amb35637068 [0,1,0,1,0,0|1,0,0]=3 13294 B9R1.13 O=C(Cl)NC1CCOC1 Amb35625931 [0,1,0,1,0,0|2,0,0]=4 13295 B9R1.13 O=C(Cl)NC1CCSC1 Amb35633199 [0,1,0,1,0,0|2,0,0]=4 13296 B9R1.13 O=C(Cl)OC1CCCC1 Amb10070029 [0,1,0,1,0,0|1,0,0]=3 13297 B9R1.13 O=C(Cl)OC1CCOC1 Amb33533648 [0,1,0,1,0,0|2,0,0]=4 13298 B9R1.13 O=C(Cl)OC1CCSC1 Amb28051650 [0,1,0,1,0,0|2,0,0]=4 13299 B9R1.13 O=C(Cl)O[C@@H]1CCOC1 Amb33297310 [0,1,0,1,0,0|2,0,0]=4 13300 B9R1.13 O=C(Cl)O[C@H]1CCOC1 Amb33297142 [0,1,0,1,0,0|2,0,0]=4 13301 B9R1.13 O=C(O)C=C1CCCC1 Amb4036043 [0,1,0,1,0,0|1,0,1]=4 13302 B9R1.13 O=C(O)CC1=CCCC1 Amb18642404 [0,1,0,1,0,0|1,0,1]=4 13303 B9R1.13 O=C(O)CC1C=CCC1 Amb9703199 [0,1,0,1,0,0|1,0,1]=4 13304 B9R1.13 O=C(O)CC1CC=CC1 Amb25673915 [0,1,0,1,0,0|1,0,1]=4 13305 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|1,0,0]=3 13306 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [0,1,0,1,0,0|1,0,0]=3 13307 B9R1.13 O=C(O)CC1CCCN1 Amb20668514 [0,1,0,1,0,0|1,0,0]=3 13308 B9R1.13 O=C(O)CC1CCCN1 Amb8387921 [0,1,0,1,0,0|1,0,0]=3 13309 B9R1.13 O=C(O)CC1CCCO1 Amb9713389 [0,1,0,1,0,0|1,0,0]=3 13310 B9R1.13 O=C(O)CC1CCNC1 Amb2695002 [0,1,0,1,0,0|1,0,0]=3 13311 B9R1.13 O=C(O)CC1CCNC1 Amb33549788 [0,1,0,1,0,0|1,0,0]=3 13312 B9R1.13 O=C(O)CC1CCOC1 Amb2696440 [0,1,0,1,0,0|1,0,0]=3 13313 B9R1.13 O=C(O)CC1CCSC1 Amb18202318 [0,1,0,1,0,0|1,0,0]=3 13314 B9R1.13 O=C(O)CC1CCSS1 Amb8388096 [0,1,0,1,0,0|2,0,0]=4 13315 B9R1.13 O=C(O)CC1CSCN1 Amb32990250 [0,1,0,1,0,0|2,0,0]=4 13316 B9R1.13 O=C(O)CC1NCCS1 Amb18644340 [0,1,0,1,0,0|2,0,0]=4 13317 B9R1.13 O=C(O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|2,0,0]=4 13318 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [0,1,0,1,0,0|1,0,0]=3 13319 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [0,1,0,1,0,0|1,0,0]=3 13320 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb13891876 [0,1,0,1,0,0|1,0,0]=3 13321 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb8630792 [0,1,0,1,0,0|1,0,0]=3 13322 B9R1.13 O=C(O)C[C@@H]1CCCO1 Amb24271115 [0,1,0,1,0,0|1,0,0]=3 13323 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb10067024 [0,1,0,1,0,0|1,0,0]=3 13324 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb26948232 [0,1,0,1,0,0|1,0,0]=3 13325 B9R1.13 O=C(O)C[C@@H]1CCOC1 Amb25887272 [0,1,0,1,0,0|1,0,0]=3 13326 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb16184011 [0,1,0,1,0,0|1,0,0]=3 13327 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb33295230 [0,1,0,1,0,0|1,0,0]=3 13328 B9R1.13 O=C(O)C[C@H]1CCCO1 Amb24271109 [0,1,0,1,0,0|1,0,0]=3 13329 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb2696648 [0,1,0,1,0,0|1,0,0]=3 13330 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb8384306 [0,1,0,1,0,0|1,0,0]=3 13331 B9R1.13 O=C(O)C[C@H]1CCOC1 Amb23401495 [0,1,0,1,0,0|1,0,0]=3 13332 B9R1.13 O=S(Cl)CC1CCCC1 Amb32720315 [0,1,0,1,0,0|2,0,0]=4 13333 B9R1.13 O=S(Cl)CC1CCCO1 Amb26405116 [0,1,0,1,0,0|2,0,0]=4 13334 B9R1.13 O=S(Cl)CC1CCOC1 Amb32720366 [0,1,0,1,0,0|2,0,0]=4 13335 B9R1.13 O=S([O-])CC1CCCC1 Amb27635722 [0,1,0,1,0,0|2,0,0]=4 13336 B9R1.13 O=S([O-])CC1CCCO1 Amb27665315 [0,1,0,1,0,0|2,0,0]=4 13337 B9R1.13 O=S([O-])CC1CCNC1 Amb32755771 [0,1,0,1,0,0|2,0,0]=4 13338 B9R1.13 O=S([O-])CC1CCOC1 Amb32754269 [0,1,0,1,0,0|2,0,0]=4 13339 B9R1.13 O=[N+]([O-])CC1CCCC1 Amb33315744 [0,1,0,1,0,0|2,0,0]=4 13340 B9R1.13 O=[N+]([O-])CC1CCCO1 Amb33318663 [0,1,0,1,0,0|2,0,0]=4 13341 B9R1.13 O=[N+]([O-])CC1CCCS1 Amb33414420 [0,1,0,1,0,0|2,0,0]=4 13342 B9R1.13 O=[N+]([O-])CC1CCNC1 Amb18203199 [0,1,0,1,0,0|2,0,0]=4 13343 B9R1.13 O=[N+]([O-])CC1CCOC1 Amb32675285 [0,1,0,1,0,0|2,0,0]=4 13344 B9R1.13 O=[N+]([O-])CC1CCSC1 Amb33141506 [0,1,0,1,0,0|2,0,0]=4 13345 B9R1.13 S=C(S)NC1CCCC1 Amb28185894 [0,1,0,1,0,0|1,1,0]=4 13346 B9R1.22 CC1CC(=O)OC1CO Amb28049216 [0,1,0,1,0,0|2,0,0]=4 13347 B9R1.22 CC1CC(=O)O[C@@H]1CO Amb27956619 [0,1,0,1,0,0|2,0,0]=4 13348 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,1,0,1,0,0|1,0,1]=4 13349 B9R1.22 CCC1CC(=O)NC1C Amb27391224 [0,1,0,1,0,0|1,0,0]=3 13350 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [0,1,0,1,0,0|1,0,1]=4 13351 B9R1.22 CCC1CC(=O)OC1O Amb27956540 [0,1,0,1,0,0|1,0,0]=3 13352 B9R1.22 CCC1CN(C)CC1Br Amb27867755 [0,1,0,1,0,0|2,0,0]=4 13353 B9R1.22 CCC1CN(C)CC1Cl Amb27852145 [0,1,0,1,0,0|2,0,0]=4 13354 B9R1.22 CCC1CN(C)CC1N Amb18203238 [0,1,0,1,0,0|2,0,0]=4 13355 B9R1.22 CCC1CN(C)CC1N Amb32941898 [0,1,0,1,0,0|2,0,0]=4 13356 B9R1.22 CCC1CN(N)CC1O Amb27783511 [0,1,0,1,0,0|2,0,0]=4 13357 B9R1.22 CCC1NC(=N)CC1C Amb27221739 [0,1,0,1,0,0|2,0,0]=4 13358 B9R1.22 CCC1NC(=O)CC1=O Amb18203277 [0,1,0,1,0,0|1,0,1]=4 13359 B9R1.22 CCC1NC(=O)CC1C Amb24578188 [0,1,0,1,0,0|1,0,0]=3 13360 B9R1.22 CCC1NC(=O)CC1N Amb28059613 [0,1,0,1,0,0|1,0,0]=3 13361 B9R1.22 CCC1NC(=O)CC1O Amb28367696 [0,1,0,1,0,0|1,0,0]=3 13362 B9R1.22 CCC1NC(=O)NC1C Amb26851881 [0,1,0,1,0,0|2,0,0]=4 13363 B9R1.22 CCC1NC(=O)OC1C Amb27860236 [0,1,0,1,0,0|2,0,0]=4 13364 B9R1.22 CCC1OC(=O)CC1=O Amb27249611 [0,1,0,1,0,0|1,0,1]=4 13365 B9R1.22 CCC1SC(C)=NC1C Amb24716975 [0,1,0,1,0,0|1,1,0]=4 13366 B9R1.22 CC[C@@H]1CN(C)C[C@@H]1N Amb27963762 [0,1,0,1,0,0|2,0,0]=4 13367 B9R1.22 CC[C@@H]1CN(C)C[C@H]1N Amb28134020 [0,1,0,1,0,0|2,0,0]=4 13368 B9R1.22 CC[C@@H]1NC(=O)O[C@@H]1C Amb28324056 [0,1,0,1,0,0|2,0,0]=4 13369 B9R1.22 CC[C@@H]1OC(=O)C[C@@H]1O Amb28207149 [0,1,0,1,0,0|1,0,0]=3 13370 B9R1.22 CC[C@@H]1OC(=O)N[C@H]1C Amb27881540 [0,1,0,1,0,0|2,0,0]=4 13371 B9R1.22 CC[C@H]1NC(=O)O[C@H]1C Amb27194202 [0,1,0,1,0,0|2,0,0]=4 13372 B9R1.22 CC[C@H]1OC(=O)C[C@H]1O Amb28292165 [0,1,0,1,0,0|1,0,0]=3 13373 B9R1.22 CC[C@H]1OC(=O)N[C@H]1C Amb28252714 [0,1,0,1,0,0|2,0,0]=4 13374 B9R1.22 CN[C@@H]1CC(=O)O[C@@H]1C Amb27789975 [0,1,0,1,0,0|2,0,0]=4 13375 B9R1.22 C[C@@H]1CC(=O)C[C@@H]1CO Amb27260485 [0,1,0,1,0,0|1,0,0]=3 13376 B9R1.22 C[C@@H]1CC(=O)O[C@H]1CCl Amb27976633 [0,1,0,1,0,0|2,0,0]=4 13377 B9R1.22 C[C@@H]1CC(=O)O[C@H]1CO Amb28053667 [0,1,0,1,0,0|2,0,0]=4 13378 B9R1.22 C[C@@H]1OC(=O)C[C@@H]1CO Amb27662143 [0,1,0,1,0,0|2,0,0]=4 13379 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CO Amb27450606 [0,1,0,1,0,0|2,0,0]=4 13380 B9R1.22 NC1CC(=O)NC1CO Amb27646439 [0,1,0,1,0,0|2,0,0]=4 13381 B9R1.22 N[C@H]1CC(=O)N[C@@H]1CO Amb25912151 [0,1,0,1,0,0|2,0,0]=4 13382 B9R1.22 O=C1CC(O)C(CBr)O1 Amb27165399 [0,1,0,1,0,0|2,0,0]=4 13383 B9R1.22 O=C1CC(O)C(CCl)O1 Amb27403088 [0,1,0,1,0,0|2,0,0]=4 13384 B9R1.22 O=C1C[C@@H](O)[C@@H](CCl)O1 Amb27975823 [0,1,0,1,0,0|2,0,0]=4 13385 B9R1.22 O=C1C[C@@H](O)[C@@H](CO)O1 Amb24515317 [0,1,0,1,0,0|2,0,0]=4 13386 B9R1.22 O=C1C[C@@H](O)[C@H](CO)N1 Amb28346278 [0,1,0,1,0,0|2,0,0]=4 13387 B9R1.22 O=C1C[C@@H](O)[C@H](CO)O1 Amb22748461 [0,1,0,1,0,0|2,0,0]=4 13388 B9R1.22 O=C1C[C@H](O)[C@@H](CBr)O1 Amb25176060 [0,1,0,1,0,0|2,0,0]=4 13389 B9R1.22 O=C1C[C@H](O)[C@@H](CO)O1 Amb20242107 [0,1,0,1,0,0|2,0,0]=4 13390 B9R1.22 O=C1C[C@H](O)[C@H](CO)O1 Amb26419790 [0,1,0,1,0,0|2,0,0]=4 13391 B9R1.25 C=C1C(CC)C1C(=O)O Amb27635776 [0,1,0,1,0,0|1,0,1]=4 13392 B9R1.25 CCC1C(Cl)C1C(=O)O Amb32656378 [0,1,0,1,0,0|1,0,0]=3 13393 B9R1.25 C[C@H]1[C@H](CO)[C@@H]1C(=O)O Amb28428452 [0,1,0,1,0,0|2,0,0]=4 13394 B9R1.34 C=C1C[C@H](O)C[C@H](O)C1 Amb28138621 [0,1,0,1,0,0|2,0,0]=4 13395 B9R1.34 CC1=CC(=O)CC(C)C1 Amb4605909 [0,1,0,1,0,0|0,0,2]=4 13396 B9R1.34 CC1=CC(C)CC(=O)C1 Amb26515881 [0,1,0,1,0,0|0,0,2]=4 13397 B9R1.34 CC1=CC(C)CC(C)C1 Amb27448286 [0,1,0,1,0,0|1,0,0]=3 13398 B9R1.34 CC1=CC(C)CN(C)C1 Amb27766754 [0,1,0,1,0,0|2,0,0]=4 13399 B9R1.34 CC1=CC(O)CC(C)C1 Amb27255196 [0,1,0,1,0,0|1,0,1]=4 13400 B9R1.34 CC1=C[C@@H](O)C[C@@H](C)C1 Amb27184430 [0,1,0,1,0,0|1,0,1]=4 13401 B9R1.34 CC1=C[C@@H](O)C[C@H](C)C1 Amb28131011 [0,1,0,1,0,0|1,0,1]=4 13402 B9R1.34 CC1=C[C@H](Cl)C[C@H](C)C1 Amb27233565 [0,1,0,1,0,0|1,0,1]=4 13403 B9R1.34 CC1CC(=O)C=C(Cl)C1 Amb7094066 [0,1,0,1,0,0|0,0,2]=4 13404 B9R1.34 CC1CC(=O)C=C(N)C1 Amb7094072 [0,1,0,1,0,0|0,0,2]=4 13405 B9R1.34 CC1CC(=O)CC(=O)C1 Amb772649 [0,1,0,1,0,0|0,0,1]=3 13406 B9R1.34 CC1CC(=O)CC(=O)N1 Amb22750293 [0,1,0,1,0,0|1,0,1]=4 13407 B9R1.34 CC1CC(=O)CC(=O)O1 Amb24422515 [0,1,0,1,0,0|1,0,1]=4 13408 B9R1.34 CC1CC(=O)CC(C)C1 Amb4035859 [0,1,0,1,0,0|0,0,0]=2 13409 B9R1.34 CC1CC(=O)CC(C)N1 Amb18642530 [0,1,0,1,0,0|1,0,0]=3 13410 B9R1.34 CC1CC(=O)CC(C)N1 Amb33548980 [0,1,0,1,0,0|1,0,0]=3 13411 B9R1.34 CC1CC(=O)CC(C)O1 Amb10072038 [0,1,0,1,0,0|1,0,0]=3 13412 B9R1.34 CC1CC(=O)CC(C)S1 Amb25859985 [0,1,0,1,0,0|1,0,0]=3 13413 B9R1.34 CC1CC(=O)CN(C)C1 Amb2369958 [0,1,0,1,0,0|1,0,0]=3 13414 B9R1.34 CC1CC(=O)C[C@@H](C)C1 Amb28201262 [0,1,0,1,0,0|0,0,0]=2 13415 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,1,0,1,0,0|1,0,1]=4 13416 B9R1.34 CC1CC(=O)NC(C)C1 Amb27760003 [0,1,0,1,0,0|1,0,0]=3 13417 B9R1.34 CC1CC(=O)OC(=O)C1 Amb534202 [0,1,0,1,0,0|1,0,1]=4 13418 B9R1.34 CC1CC(Br)CC(C)O1 Amb27657066 [0,1,0,1,0,0|0,0,2]=4 13419 B9R1.34 CC1CC(C)CC(Br)C1 Amb25147183 [0,1,0,1,0,0|1,0,1]=4 13420 B9R1.34 CC1CC(C)CC(C)C1 Amb9787600 [0,1,0,1,0,0|1,0,1]=4 13421 B9R1.34 CC1CC(C)CC(I)C1 Amb25147177 [0,1,0,1,0,0|1,0,1]=4 13422 B9R1.34 CC1CC(C)CC(N)C1 Amb19514974 [0,1,0,1,0,0|1,0,1]=4 13423 B9R1.34 CC1CC(C)CC(O)C1 Amb19514923 [0,1,0,1,0,0|0,0,2]=4 13424 B9R1.34 CC1CC(C)CC(S)C1 Amb24539821 [0,1,0,1,0,0|0,1,1]=4 13425 B9R1.34 CC1CC(C)NC(=O)N1 Amb27974674 [0,1,0,1,0,0|2,0,0]=4 13426 B9R1.34 CC1CC(C)NC(C)C1 Amb6369922 [0,1,0,1,0,0|1,0,1]=4 13427 B9R1.34 CC1CC(Cl)CC(C)O1 Amb24479940 [0,1,0,1,0,0|0,0,2]=4 13428 B9R1.34 CC1CC(Cl)CN(C)C1 Amb28060719 [0,1,0,1,0,0|2,0,0]=4 13429 B9R1.34 CC1CC(N)=NC(C)C1 Amb25766396 [0,1,0,1,0,0|2,0,0]=4 13430 B9R1.34 CC1CC(N)CC(C)N1 Amb23535949 [0,1,0,1,0,0|1,0,1]=4 13431 B9R1.34 CC1CC(N)CC(C)O1 Amb22059487 [0,1,0,1,0,0|0,0,2]=4 13432 B9R1.34 CC1CC(N)CC(N)C1 Amb27768661 [0,1,0,1,0,0|1,0,1]=4 13433 B9R1.34 CC1CC(N)CN(C)C1 Amb18832586 [0,1,0,1,0,0|2,0,0]=4 13434 B9R1.34 CC1CC(O)CC(=O)N1 Amb27257554 [0,1,0,1,0,0|1,0,0]=3 13435 B9R1.34 CC1CC(O)CC(=O)O1 Amb23455145 [0,1,0,1,0,0|1,0,0]=3 13436 B9R1.34 CC1CC(O)CC(C)N1 Amb2697842 [0,1,0,1,0,0|1,0,1]=4 13437 B9R1.34 CC1CC(O)CC(C)O1 Amb19892414 [0,1,0,1,0,0|0,0,2]=4 13438 B9R1.34 CC1CC(O)CN(C)C1 Amb1017305 [0,1,0,1,0,0|2,0,0]=4 13439 B9R1.34 CC1CC(O)NC(=O)N1 Amb27768639 [0,1,0,1,0,0|2,0,0]=4 13440 B9R1.34 CC1CC(S)CC(C)O1 Amb25276017 [0,1,0,1,0,0|0,0,2]=4 13441 B9R1.34 CC1CS(=O)CC(C)N1 Amb27445342 [0,1,0,1,0,0|2,0,0]=4 13442 B9R1.34 CC1C[C@@H](O)C[C@H](O)C1 Amb28063780 [0,1,0,1,0,0|0,0,2]=4 13443 B9R1.34 CC1NC(=O)CC(O)N1 Amb28205706 [0,1,0,1,0,0|2,0,0]=4 13444 B9R1.34 CN1CC(=O)CC(=O)C1 Amb22802168 [0,1,0,1,0,0|1,0,1]=4 13445 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)C1 Amb27855014 [0,1,0,1,0,0|0,0,0]=2 13446 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Amb24056554 [0,1,0,1,0,0|1,0,0]=3 13447 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)C1 Amb24568269 [0,1,0,1,0,0|0,0,0]=2 13448 B9R1.34 C[C@@H]1CC(N)C[C@@H](C)N1 Amb27630062 [0,1,0,1,0,0|1,0,1]=4 13449 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)C1 Amb27211586 [0,1,0,1,0,0|0,0,2]=4 13450 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)N1 Amb24580385 [0,1,0,1,0,0|1,0,1]=4 13451 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)O1 Amb28435705 [0,1,0,1,0,0|0,0,2]=4 13452 B9R1.34 C[C@@H]1CC(O)C[C@H](C)C1 Amb27451589 [0,1,0,1,0,0|0,0,2]=4 13453 B9R1.34 C[C@@H]1C[C@@H](C)CN(N)C1 Amb25707932 [0,1,0,1,0,0|2,0,0]=4 13454 B9R1.34 C[C@@H]1C[C@H](Cl)C[C@H](C)C1 Amb27483334 [0,1,0,1,0,0|1,0,1]=4 13455 B9R1.34 C[C@@H]1C[C@H](N)CC(=O)N1 Amb28134031 [0,1,0,1,0,0|1,0,0]=3 13456 B9R1.34 C[C@H]1CC(=O)CC(=O)N1 Amb27168280 [0,1,0,1,0,0|1,0,1]=4 13457 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 Amb22751257 [0,1,0,1,0,0|1,0,0]=3 13458 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 Amb27629476 [0,1,0,1,0,0|1,0,0]=3 13459 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 Amb24620055 [0,1,0,1,0,0|1,0,0]=3 13460 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)S1 Amb28141405 [0,1,0,1,0,0|1,0,0]=3 13461 B9R1.34 C[C@H]1CC(Br)C[C@@H](C)O1 Amb27772090 [0,1,0,1,0,0|0,0,2]=4 13462 B9R1.34 C[C@H]1CC(N)C[C@@H](C)O1 Amb27481342 [0,1,0,1,0,0|0,0,2]=4 13463 B9R1.34 C[C@H]1CC(S)C[C@@H](C)O1 Amb32788730 [0,1,0,1,0,0|0,0,2]=4 13464 B9R1.34 C[C@H]1C[C@@H](C)CC(=O)N1 Amb33484017 [0,1,0,1,0,0|1,0,0]=3 13465 B9R1.34 C[C@H]1C[C@@H](C)CC(N)=N1 Amb26578866 [0,1,0,1,0,0|2,0,0]=4 13466 B9R1.34 C[C@H]1C[C@@H](C)C[C@@H](C)N1 Amb25145967 [0,1,0,1,0,0|1,0,1]=4 13467 B9R1.34 C[C@H]1C[C@@H](C)C[C@@H](C)N1 Amb31188261 [0,1,0,1,0,0|1,0,1]=4 13468 B9R1.34 C[C@H]1C[C@@H](C)C[C@H](Cl)C1 Amb28436905 [0,1,0,1,0,0|1,0,1]=4 13469 B9R1.34 C[C@H]1C[C@@H](C)C[C@H](N)C1 Amb28410627 [0,1,0,1,0,0|1,0,1]=4 13470 B9R1.34 C[C@H]1C[C@@H](Cl)C[C@@H](C)O1 Amb27984969 [0,1,0,1,0,0|0,0,2]=4 13471 B9R1.34 C[C@H]1C[C@@H](N)C[C@@H](C)O1 Amb27838552 [0,1,0,1,0,0|0,0,2]=4 13472 B9R1.34 C[C@H]1C[C@@H](O)C[C@@H](C)N1 Amb27205445 [0,1,0,1,0,0|1,0,1]=4 13473 B9R1.34 C[C@H]1C[C@H](Br)C[C@@H](C)O1 Amb33338914 [0,1,0,1,0,0|0,0,2]=4 13474 B9R1.34 C[C@H]1C[C@H](O)CN(C)C1 Amb27218923 [0,1,0,1,0,0|2,0,0]=4 13475 B9R1.34 C[C@H]1C[C@H](O)C[C@H](O)C1 Amb27405103 [0,1,0,1,0,0|0,0,2]=4 13476 B9R1.34 N[C@@H]1CC(=O)C[C@H](N)C1 Amb28326235 [0,1,0,1,0,0|1,0,0]=3 13477 B9R1.34 O=C1CC(=O)CC(O)C1 Amb27838801 [0,1,0,1,0,0|1,0,1]=4 13478 B9R1.34 O=C1CC(I)CC(O)N1 Amb27451041 [0,1,0,1,0,0|2,0,0]=4 13479 B9R1.34 O=C1C[C@@H](O)C[C@@H](O)C1 Amb27838772 [0,1,0,1,0,0|1,0,0]=3 13480 B9R1.34 O=C1C[C@H](O)C[C@@H](O)C1 Amb28074737 [0,1,0,1,0,0|1,0,0]=3 13481 B9R1.34 O=S1C[C@@H](O)C[C@@H](O)C1 Amb28206010 [0,1,0,1,0,0|2,0,0]=4 13482 B9R1.38 CC1CC(C)C(C)(C)C1 Amb26008978 [0,1,0,1,0,0|1,0,1]=4 13483 B9R1.38 CC1CC(C)C(C)(O)C1 Amb27488714 [0,1,0,1,0,0|0,0,2]=4 13484 B9R1.38 CC1CC(C)S(=O)(=O)C1 Amb2227622 [0,1,0,1,0,0|2,0,0]=4 13485 B9R1.38 CC1CC(N)CS1(=O)=O Amb27225119 [0,1,0,1,0,0|2,0,0]=4 13486 B9R1.38 CC1CC(O)CS1(=O)=O Amb27410506 [0,1,0,1,0,0|2,0,0]=4 13487 B9R1.41 C=C(C)C1CCCC1O Amb26956818 [0,1,0,1,0,0|1,0,0]=3 13488 B9R1.41 C=C(C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|2,0,0]=4 13489 B9R1.41 C=C(C)C1COCC1O Amb33213980 [0,1,0,1,0,0|2,0,0]=4 13490 B9R1.41 C=C(C)[C@@H]1CCC[C@H]1O Amb33212935 [0,1,0,1,0,0|1,0,0]=3 13491 B9R1.41 C=C(C)[C@@H]1CNC[C@H]1O Amb32944875 [0,1,0,1,0,0|2,0,0]=4 13492 B9R1.41 C=C(C)[C@@H]1COC[C@H]1O Amb32945151 [0,1,0,1,0,0|2,0,0]=4 13493 B9R1.41 C=C(C)[C@H]1CCC[C@@H]1O Amb27618794 [0,1,0,1,0,0|1,0,0]=3 13494 B9R1.41 C=C(C)[C@H]1CNC[C@H]1C Amb28423409 [0,1,0,1,0,0|1,0,0]=3 13495 B9R1.41 C=C1CCCC1C(C)=O Amb27164651 [0,1,0,1,0,0|0,0,1]=3 13496 B9R1.41 C=C1COCC1C(C)=O Amb26910046 [0,1,0,1,0,0|0,0,2]=4 13497 B9R1.41 CC(=O)C1=C(C)CCC1 Amb27602304 [0,1,0,1,0,0|0,0,1]=3 13498 B9R1.41 CC(=O)C1=C(C)OCC1 Amb27226753 [0,1,0,1,0,0|0,0,2]=4 13499 B9R1.41 CC(=O)C1=C(N)CCC1 Amb27252978 [0,1,0,1,0,0|0,0,2]=4 13500 B9R1.41 CC(=O)C1=CCCC1O Amb27634181 [0,1,0,1,0,0|0,0,2]=4 13501 B9R1.41 CC(=O)C1=CCC[C@@H]1C Amb27668819 [0,1,0,1,0,0|0,0,1]=3 13502 B9R1.41 CC(=O)C1CCC=C1C Amb26053403 [0,1,0,1,0,0|0,0,1]=3 13503 B9R1.41 CC(=O)C1CCCC1=O Amb6600481 [0,1,0,1,0,0|0,0,1]=3 13504 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [0,1,0,1,0,0|0,0,0]=2 13505 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|0,0,0]=2 13506 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [0,1,0,1,0,0|0,0,0]=2 13507 B9R1.41 CC(=O)C1CCNC1=O Amb9782651 [0,1,0,1,0,0|1,0,1]=4 13508 B9R1.41 CC(=O)C1CCNC1C Amb24393053 [0,1,0,1,0,0|0,0,0]=2 13509 B9R1.41 CC(=O)C1CCOC1=O Amb2404781 [0,1,0,1,0,0|1,0,1]=4 13510 B9R1.41 CC(=O)C1CCOC1C Amb25882003 [0,1,0,1,0,0|0,0,0]=2 13511 B9R1.41 CC(=O)C1CNCC1C Amb28346154 [0,1,0,1,0,0|0,0,0]=2 13512 B9R1.41 CC(=O)C1CNCC1O Amb33213407 [0,1,0,1,0,0|1,0,0]=3 13513 B9R1.41 CC(=O)C1COCC1N Amb25918760 [0,1,0,1,0,0|1,0,0]=3 13514 B9R1.41 CC(=O)C1COCC1O Amb32951053 [0,1,0,1,0,0|1,0,0]=3 13515 B9R1.41 CC(=O)C1CON=C1C Amb27771382 [0,1,0,1,0,0|1,0,1]=4 13516 B9R1.41 CC(=O)C1CSCC1=O Amb27838737 [0,1,0,1,0,0|1,0,1]=4 13517 B9R1.41 CC(=O)C1CSCC1C Amb32988245 [0,1,0,1,0,0|0,0,0]=2 13518 B9R1.41 CC(=O)C1OCCC1N Amb33307372 [0,1,0,1,0,0|1,0,0]=3 13519 B9R1.41 CC(=O)N1CCCC1=O Amb2720885 [0,1,0,1,0,0|1,0,1]=4 13520 B9R1.41 CC(=O)N1CCCC1C Amb26494370 [0,1,0,1,0,0|0,0,0]=2 13521 B9R1.41 CC(=O)[C@@H]1CCCN1N Amb26968682 [0,1,0,1,0,0|1,0,0]=3 13522 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [0,1,0,1,0,0|0,0,0]=2 13523 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [0,1,0,1,0,0|0,0,0]=2 13524 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [0,1,0,1,0,0|0,0,0]=2 13525 B9R1.41 CC(=O)[C@@H]1CNC[C@H]1O Amb32945575 [0,1,0,1,0,0|1,0,0]=3 13526 B9R1.41 CC(=O)[C@@H]1COC[C@H]1O Amb32951076 [0,1,0,1,0,0|1,0,0]=3 13527 B9R1.41 CC(=O)[C@@H]1OCC[C@@H]1N Amb33307350 [0,1,0,1,0,0|1,0,0]=3 13528 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [0,1,0,1,0,0|0,0,0]=2 13529 B9R1.41 CC(=O)[C@H]1CCOC1=O Amb27453388 [0,1,0,1,0,0|1,0,1]=4 13530 B9R1.41 CC(=S)C1CCCC1=O Amb27947166 [0,1,0,1,0,0|0,1,1]=4 13531 B9R1.41 CC(Br)C1CCOC1C Amb27175166 [0,1,0,1,0,0|1,0,1]=4 13532 B9R1.41 CC(Br)C1COCC1C Amb35632052 [0,1,0,1,0,0|1,0,1]=4 13533 B9R1.41 CC(C)C1CCCC1N Amb18947760 [0,1,0,1,0,0|1,0,1]=4 13534 B9R1.41 CC(C)C1CCCC1N Amb33339176 [0,1,0,1,0,0|1,0,1]=4 13535 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|1,0,1]=4 13536 B9R1.41 CC(C)[C@@H]1CCC[C@H]1O Amb25998901 [0,1,0,1,0,0|1,0,1]=4 13537 B9R1.41 CC(C)[C@@H]1NCC[C@H]1C Amb18832663 [0,1,0,1,0,0|1,0,1]=4 13538 B9R1.41 CC(C)[C@H]1CCC[C@@H]1O Amb27238582 [0,1,0,1,0,0|1,0,1]=4 13539 B9R1.41 CC(C)[C@H]1CCC[C@H]1N Amb27259812 [0,1,0,1,0,0|1,0,1]=4 13540 B9R1.41 CC(C)[C@H]1CCC[C@H]1O Amb28053553 [0,1,0,1,0,0|1,0,1]=4 13541 B9R1.41 CC(Cl)C1COCC1C Amb35632051 [0,1,0,1,0,0|1,0,1]=4 13542 B9R1.41 CC(N)C1CCCC1C Amb28287560 [0,1,0,1,0,0|1,0,1]=4 13543 B9R1.41 CC(N)C1CCCN1C Amb26457555 [0,1,0,1,0,0|1,0,1]=4 13544 B9R1.41 CC(N)C1CCOC1C Amb28321677 [0,1,0,1,0,0|1,0,1]=4 13545 B9R1.41 CC(N)C1COCC1C Amb35635621 [0,1,0,1,0,0|1,0,1]=4 13546 B9R1.41 CC(N)[C@@H]1CCC[C@@H]1O Amb27654093 [0,1,0,1,0,0|1,0,1]=4 13547 B9R1.41 CC(O)C1CCCC1N Amb18203228 [0,1,0,1,0,0|0,0,2]=4 13548 B9R1.41 CC(O)C1CCCN1C Amb27491503 [0,1,0,1,0,0|0,0,2]=4 13549 B9R1.41 CC(O)C1CCNC1C Amb35584409 [0,1,0,1,0,0|0,0,2]=4 13550 B9R1.41 CC(O)C1CNCC1C Amb29849500 [0,1,0,1,0,0|0,0,2]=4 13551 B9R1.41 CC(O)C1COCC1C Amb35651587 [0,1,0,1,0,0|0,0,2]=4 13552 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [0,1,0,1,0,0|0,0,2]=4 13553 B9R1.41 CC(O)[C@@H]1CCC[C@@H]1N Amb30039509 [0,1,0,1,0,0|0,0,2]=4 13554 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [0,1,0,1,0,0|1,0,1]=4 13555 B9R1.41 CC1CCCC1C(=N)N Amb28286052 [0,1,0,1,0,0|2,0,0]=4 13556 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [0,1,0,1,0,0|1,0,0]=3 13557 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [0,1,0,1,0,0|1,0,0]=3 13558 B9R1.41 CC1CCCC1N(C)N Amb35718433 [0,1,0,1,0,0|2,0,0]=4 13559 B9R1.41 CC1CCCC1[C@@H](C)N Amb26925525 [0,1,0,1,0,0|1,0,1]=4 13560 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,1,0,1,0,0|0,0,2]=4 13561 B9R1.41 CC1CCCC1[C@H](C)N Amb27777943 [0,1,0,1,0,0|1,0,1]=4 13562 B9R1.41 CC1CCCN1C(=N)N Amb27837409 [0,1,0,1,0,0|2,0,0]=4 13563 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [0,1,0,1,0,0|1,0,0]=3 13564 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [0,1,0,1,0,0|1,0,0]=3 13565 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [0,1,0,1,0,0|1,0,0]=3 13566 B9R1.41 CC1CCNC1C(N)=O Amb26893292 [0,1,0,1,0,0|1,0,0]=3 13567 B9R1.41 CC1CCNC1C(N)=O Amb33307145 [0,1,0,1,0,0|1,0,0]=3 13568 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [0,1,0,1,0,0|1,0,0]=3 13569 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [0,1,0,1,0,0|1,0,0]=3 13570 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [0,1,0,1,0,0|1,0,0]=3 13571 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [0,1,0,1,0,0|1,0,0]=3 13572 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [0,1,0,1,0,0|1,0,0]=3 13573 B9R1.41 CC1CNCC1C(N)=O Amb26454427 [0,1,0,1,0,0|1,0,0]=3 13574 B9R1.41 CC1CNCC1C(N)=O Amb32663022 [0,1,0,1,0,0|1,0,0]=3 13575 B9R1.41 CC1CNCC1N(C)C Amb20623248 [0,1,0,1,0,0|2,0,0]=4 13576 B9R1.41 CC1COCC1N(C)N Amb35652375 [0,1,0,1,0,0|2,0,0]=4 13577 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [0,1,0,1,0,0|1,0,0]=3 13578 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [0,1,0,1,0,0|1,0,0]=3 13579 B9R1.41 CC1NCCC1N(C)C Amb24518040 [0,1,0,1,0,0|2,0,0]=4 13580 B9R1.41 CC1NCCC1N(C)C Amb28895956 [0,1,0,1,0,0|2,0,0]=4 13581 B9R1.41 CC1OCCC1C(=N)N Amb33373407 [0,1,0,1,0,0|2,0,0]=4 13582 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [0,1,0,1,0,0|1,0,0]=3 13583 B9R1.41 CC1OCCC1C(N)=S Amb33426764 [0,1,0,1,0,0|1,1,0]=4 13584 B9R1.41 CC1OCCC1S(=O)Cl Amb32720567 [0,1,0,1,0,0|2,0,0]=4 13585 B9R1.41 CC1OCCC1S(=O)[O-] Amb32754408 [0,1,0,1,0,0|2,0,0]=4 13586 B9R1.41 CC1OCCC1S(C)=O Amb27608130 [0,1,0,1,0,0|1,0,0]=3 13587 B9R1.41 CC1OCCC1S(N)=O Amb32720592 [0,1,0,1,0,0|2,0,0]=4 13588 B9R1.41 CC1OCCC1[C@@H](C)N Amb33427658 [0,1,0,1,0,0|1,0,1]=4 13589 B9R1.41 CC1OCCC1[C@@H](C)O Amb33427681 [0,1,0,1,0,0|0,0,2]=4 13590 B9R1.41 CC1OCCC1[C@H](C)N Amb33427682 [0,1,0,1,0,0|1,0,1]=4 13591 B9R1.41 CC1OCCC1[C@H](C)O Amb33225339 [0,1,0,1,0,0|0,0,2]=4 13592 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [0,1,0,1,0,0|2,0,0]=4 13593 B9R1.41 CC1SCCC1[N+](=O)[O-] Amb33298248 [0,1,0,1,0,0|2,0,0]=4 13594 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [0,1,0,1,0,0|2,0,0]=4 13595 B9R1.41 CN(C)C1CCCC1Cl Amb27863676 [0,1,0,1,0,0|2,0,0]=4 13596 B9R1.41 CN(C)C1CCCC1N Amb32666070 [0,1,0,1,0,0|2,0,0]=4 13597 B9R1.41 CN(C)C1CCCC1N Amb33543020 [0,1,0,1,0,0|2,0,0]=4 13598 B9R1.41 CN(C)C1CCCC1O Amb19650708 [0,1,0,1,0,0|2,0,0]=4 13599 B9R1.41 CN(C)[C@@H]1CCCN1C Amb34913966 [0,1,0,1,0,0|2,0,0]=4 13600 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1N Amb34915421 [0,1,0,1,0,0|2,0,0]=4 13601 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1O Amb22899696 [0,1,0,1,0,0|2,0,0]=4 13602 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N Amb22757950 [0,1,0,1,0,0|2,0,0]=4 13603 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N Amb31156415 [0,1,0,1,0,0|2,0,0]=4 13604 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O Amb16230278 [0,1,0,1,0,0|2,0,0]=4 13605 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N Amb28871613 [0,1,0,1,0,0|2,0,0]=4 13606 B9R1.41 CN(C)[C@H]1CCC[C@H]1N Amb34915420 [0,1,0,1,0,0|2,0,0]=4 13607 B9R1.41 CN(C)[C@H]1CCC[C@H]1O Amb27185740 [0,1,0,1,0,0|2,0,0]=4 13608 B9R1.41 CN(N)[C@H]1CCC[C@@H]1O Amb27420294 [0,1,0,1,0,0|2,0,0]=4 13609 B9R1.41 CN(N)[C@H]1CCC[C@H]1O Amb28064055 [0,1,0,1,0,0|2,0,0]=4 13610 B9R1.41 CN1CCCC1C(=N)N Amb26563327 [0,1,0,1,0,0|2,0,0]=4 13611 B9R1.41 CN1CCCC1C(=N)N Amb33457486 [0,1,0,1,0,0|2,0,0]=4 13612 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [0,1,0,1,0,0|1,0,0]=3 13613 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [0,1,0,1,0,0|1,0,0]=3 13614 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [0,1,0,1,0,0|1,0,0]=3 13615 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [0,1,0,1,0,0|1,0,0]=3 13616 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [0,1,0,1,0,0|1,0,0]=3 13617 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [0,1,0,1,0,0|1,0,0]=3 13618 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [0,1,0,1,0,0|1,0,0]=3 13619 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [0,1,0,1,0,0|1,0,0]=3 13620 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [0,1,0,1,0,0|1,0,0]=3 13621 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [0,1,0,1,0,0|1,0,0]=3 13622 B9R1.41 CN1CCC[C@H]1C(N)=O Amb28059484 [0,1,0,1,0,0|1,0,0]=3 13623 B9R1.41 CN1CSCC1C(=O)O Amb19650934 [0,1,0,1,0,0|2,0,0]=4 13624 B9R1.41 CN1CSCC1C(=O)O Amb21959971 [0,1,0,1,0,0|2,0,0]=4 13625 B9R1.41 CN1CSC[C@@H]1C(=O)O Amb27157377 [0,1,0,1,0,0|2,0,0]=4 13626 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [0,1,0,1,0,0|2,0,0]=4 13627 B9R1.41 CN1CSC[C@H]1C(=O)O Amb22587250 [0,1,0,1,0,0|2,0,0]=4 13628 B9R1.41 CS(=O)C1CCCC1N Amb27862371 [0,1,0,1,0,0|1,0,0]=3 13629 B9R1.41 C[C@@H](N)C1CCCN1C Amb35598163 [0,1,0,1,0,0|1,0,1]=4 13630 B9R1.41 C[C@@H](N)[C@@H]1CCC[C@@H]1O Amb35752723 [0,1,0,1,0,0|1,0,1]=4 13631 B9R1.41 C[C@@H](N)[C@H]1CCC[C@H]1O Amb28072273 [0,1,0,1,0,0|1,0,1]=4 13632 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [0,1,0,1,0,0|1,0,0]=3 13633 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|1,0,0]=3 13634 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|1,0,0]=3 13635 B9R1.41 C[C@@H]1CCN[C@@H]1C(N)=O Amb27446302 [0,1,0,1,0,0|1,0,0]=3 13636 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [0,1,0,1,0,0|1,0,0]=3 13637 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [0,1,0,1,0,0|1,0,0]=3 13638 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [0,1,0,1,0,0|1,0,0]=3 13639 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [0,1,0,1,0,0|1,0,0]=3 13640 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [0,1,0,1,0,0|1,0,0]=3 13641 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [0,1,0,1,0,0|1,0,0]=3 13642 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|1,0,0]=3 13643 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb26066427 [0,1,0,1,0,0|1,0,0]=3 13644 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [0,1,0,1,0,0|1,0,0]=3 13645 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [0,1,0,1,0,0|1,0,0]=3 13646 B9R1.41 C[C@@H]1NCC[C@@H]1C(N)=O Amb27851822 [0,1,0,1,0,0|1,0,0]=3 13647 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [0,1,0,1,0,0|1,0,0]=3 13648 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [0,1,0,1,0,0|1,0,0]=3 13649 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [0,1,0,1,0,0|1,0,0]=3 13650 B9R1.41 C[C@H](N)C1CCCN1C Amb35598167 [0,1,0,1,0,0|1,0,1]=4 13651 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|1,0,0]=3 13652 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|1,0,0]=3 13653 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [0,1,0,1,0,0|1,0,0]=3 13654 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [0,1,0,1,0,0|1,0,0]=3 13655 B9R1.41 C[C@H]1CNC[C@H]1N(C)C Amb28134642 [0,1,0,1,0,0|2,0,0]=4 13656 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [0,1,0,1,0,0|1,0,0]=3 13657 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [0,1,0,1,0,0|1,0,0]=3 13658 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [0,1,0,1,0,0|2,0,0]=4 13659 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [0,1,0,1,0,0|2,0,0]=4 13660 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [0,1,0,1,0,0|2,0,0]=4 13661 B9R1.41 N=C(N)C1CCCC1N Amb28124603 [0,1,0,1,0,0|2,0,0]=4 13662 B9R1.41 N=C(N)C1CCCC1N Amb33038277 [0,1,0,1,0,0|2,0,0]=4 13663 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,1,0,1,0,0|1,0,1]=4 13664 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [0,1,0,1,0,0|1,0,0]=3 13665 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [0,1,0,1,0,0|1,0,0]=3 13666 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [0,1,0,1,0,0|1,0,0]=3 13667 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|1,0,0]=3 13668 B9R1.41 NC(=O)C1CCCN1O Amb27607865 [0,1,0,1,0,0|2,0,0]=4 13669 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|2,0,0]=4 13670 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [0,1,0,1,0,0|1,0,0]=3 13671 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [0,1,0,1,0,0|1,0,0]=3 13672 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [0,1,0,1,0,0|2,0,0]=4 13673 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|2,0,0]=4 13674 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [0,1,0,1,0,0|1,0,0]=3 13675 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [0,1,0,1,0,0|1,0,0]=3 13676 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [0,1,0,1,0,0|1,0,0]=3 13677 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [0,1,0,1,0,0|1,0,0]=3 13678 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|2,0,0]=4 13679 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [0,1,0,1,0,0|2,0,0]=4 13680 B9R1.41 NC(=S)C1CCCC1O Amb27668651 [0,1,0,1,0,0|1,1,0]=4 13681 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [0,1,0,1,0,0|1,0,0]=3 13682 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [0,1,0,1,0,0|1,0,0]=3 13683 B9R1.41 NC1CCCC1C(O)=[ClH] Amb27883058 [0,1,0,1,0,0|1,0,1]=4 13684 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [0,1,0,1,0,0|2,0,0]=4 13685 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [0,1,0,1,0,0|2,0,0]=4 13686 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [0,1,0,1,0,0|2,0,0]=4 13687 B9R1.41 NC1COCC1C(=O)O Amb24709230 [0,1,0,1,0,0|2,0,0]=4 13688 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [0,1,0,1,0,0|2,0,0]=4 13689 B9R1.41 NN1CCCC1C(=O)O Amb18642792 [0,1,0,1,0,0|2,0,0]=4 13690 B9R1.41 NN1CCC[C@H]1C(=O)O Amb25887284 [0,1,0,1,0,0|2,0,0]=4 13691 B9R1.41 NS(=O)C1CCCC1F Amb32720764 [0,1,0,1,0,0|2,0,0]=4 13692 B9R1.41 NS(=O)[C@@H]1CCC[C@H]1O Amb32720921 [0,1,0,1,0,0|2,0,0]=4 13693 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [0,1,0,1,0,0|1,0,0]=3 13694 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [0,1,0,1,0,0|1,0,0]=3 13695 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [0,1,0,1,0,0|1,0,0]=3 13696 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [0,1,0,1,0,0|1,0,0]=3 13697 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [0,1,0,1,0,0|2,0,0]=4 13698 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [0,1,0,1,0,0|2,0,0]=4 13699 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [0,1,0,1,0,0|2,0,0]=4 13700 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [0,1,0,1,0,0|2,0,0]=4 13701 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [0,1,0,1,0,0|2,0,0]=4 13702 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [0,1,0,1,0,0|2,0,0]=4 13703 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [0,1,0,1,0,0|2,0,0]=4 13704 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [0,1,0,1,0,0|1,0,0]=3 13705 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [0,1,0,1,0,0|1,0,0]=3 13706 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|1,0,0]=3 13707 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|1,0,0]=3 13708 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [0,1,0,1,0,0|2,0,0]=4 13709 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [0,1,0,1,0,0|2,0,0]=4 13710 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [0,1,0,1,0,0|2,0,0]=4 13711 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [0,1,0,1,0,0|2,0,0]=4 13712 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [0,1,0,1,0,0|2,0,0]=4 13713 B9R1.41 O=C(Cl)C1CCCC1=O Amb21961757 [0,1,0,1,0,0|1,0,1]=4 13714 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [0,1,0,1,0,0|1,0,0]=3 13715 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [0,1,0,1,0,0|1,0,0]=3 13716 B9R1.41 O=C(O)C1CCCC1=O Amb18642571 [0,1,0,1,0,0|1,0,1]=4 13717 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 13718 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,0,0]=3 13719 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [0,1,0,1,0,0|2,0,0]=4 13720 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [0,1,0,1,0,0|2,0,0]=4 13721 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [0,1,0,1,0,0|2,0,0]=4 13722 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [0,1,0,1,0,0|2,0,0]=4 13723 B9R1.41 O=C(O)C1COCC1O Amb27270738 [0,1,0,1,0,0|2,0,0]=4 13724 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [0,1,0,1,0,0|2,0,0]=4 13725 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|2,0,0]=4 13726 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [0,1,0,1,0,0|2,0,0]=4 13727 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [0,1,0,1,0,0|2,0,0]=4 13728 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [0,1,0,1,0,0|2,0,0]=4 13729 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [0,1,0,1,0,0|2,0,0]=4 13730 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [0,1,0,1,0,0|2,0,0]=4 13731 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [0,1,0,1,0,0|2,0,0]=4 13732 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [0,1,0,1,0,0|2,0,0]=4 13733 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [0,1,0,1,0,0|2,0,0]=4 13734 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [0,1,0,1,0,0|2,0,0]=4 13735 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [0,1,0,1,0,0|2,0,0]=4 13736 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [0,1,0,1,0,0|2,0,0]=4 13737 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [0,1,0,1,0,0|2,0,0]=4 13738 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [0,1,0,1,0,0|2,0,0]=4 13739 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [0,1,0,1,0,0|2,0,0]=4 13740 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [0,1,0,1,0,0|1,0,0]=3 13741 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 13742 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [0,1,0,1,0,0|2,0,0]=4 13743 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [0,1,0,1,0,0|2,0,0]=4 13744 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [0,1,0,1,0,0|2,0,0]=4 13745 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [0,1,0,1,0,0|2,0,0]=4 13746 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [0,1,0,1,0,0|2,0,0]=4 13747 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [0,1,0,1,0,0|2,0,0]=4 13748 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [0,1,0,1,0,0|2,0,0]=4 13749 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [0,1,0,1,0,0|2,0,0]=4 13750 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [0,1,0,1,0,0|2,0,0]=4 13751 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [0,1,0,1,0,0|2,0,0]=4 13752 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [0,1,0,1,0,0|2,0,0]=4 13753 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [0,1,0,1,0,0|2,0,0]=4 13754 B9R1.41 O=S(Cl)C1CCCC1F Amb32720763 [0,1,0,1,0,0|2,0,0]=4 13755 B9R1.41 O=S(Cl)[C@@H]1CCC[C@H]1O Amb32720922 [0,1,0,1,0,0|2,0,0]=4 13756 B9R1.41 O=S([O-])C1CCCC1F Amb32755063 [0,1,0,1,0,0|2,0,0]=4 13757 B9R1.41 O=S([O-])[C@@H]1CCC[C@H]1O Amb32755416 [0,1,0,1,0,0|2,0,0]=4 13758 B9R1.41 O=[N+]([O-])C1CCCC1O Amb18203186 [0,1,0,1,0,0|2,0,0]=4 13759 B9R1.44 CC(=O)CC1(C)OC1C Amb28054341 [0,1,0,1,0,0|1,0,0]=3 13760 B9R1.44 CC(=O)OC1(C)CC1C Amb27837613 [0,1,0,1,0,0|1,0,0]=3 13761 B9R1.44 CC(C)CC1(N)CC1C Amb27960839 [0,1,0,1,0,0|1,0,1]=4 13762 B9R1.44 CC1(CC(=O)O)CC1F Amb32664391 [0,1,0,1,0,0|2,0,0]=4 13763 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,1,0,1,0,0|1,0,0]=3 13764 B9R1.44 CC1CC1(N)CC(N)=O Amb27631646 [0,1,0,1,0,0|1,0,0]=3 13765 B9R1.48 C=C1CCOC[C@H](O)C1 Amb27406726 [0,1,0,1,0,0|2,0,0]=4 13766 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,1,0,1,0,0|0,0,1]=3 13767 B9R1.48 CC1=CC(Cl)CCCC1 Amb27469441 [0,1,0,1,0,0|1,0,0]=3 13768 B9R1.48 CC1=CC(N)CCCC1 Amb28040829 [0,1,0,1,0,0|1,0,0]=3 13769 B9R1.48 CC1=CCCCC(C)=C1 Amb22365190 [0,1,0,1,0,0|1,0,1]=4 13770 B9R1.48 CC1=NCCNC(=O)C1 Amb28187399 [0,1,0,1,0,0|1,0,1]=4 13771 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,1,0,1,0,0|1,0,0]=3 13772 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,1,0,1,0,0|1,0,0]=3 13773 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,1,0,1,0,0|1,0,0]=3 13774 B9R1.48 CC1CCC=CC(=O)C1 Amb28460736 [0,1,0,1,0,0|0,0,1]=3 13775 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|0,0,0]=2 13776 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,1,0,0|1,0,0]=3 13777 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [0,1,0,1,0,0|1,0,0]=3 13778 B9R1.48 CC1CCCCC(Br)C1 Amb27640824 [0,1,0,1,0,0|1,0,1]=4 13779 B9R1.48 CC1CCCCC(C)N1 Amb27859477 [0,1,0,1,0,0|1,0,1]=4 13780 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,1,0,1,0,0|0,0,2]=4 13781 B9R1.48 CC1CCCCN(C)C1 Amb27211471 [0,1,0,1,0,0|1,0,1]=4 13782 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [0,1,0,1,0,0|0,0,0]=2 13783 B9R1.48 CC1CCCSC(N)=N1 Amb27950002 [0,1,0,1,0,0|2,0,0]=4 13784 B9R1.48 CC1CCNCC(C)C1 Amb20622727 [0,1,0,1,0,0|1,0,1]=4 13785 B9R1.48 CC1CCNCC(C)O1 Amb32666605 [0,1,0,1,0,0|0,0,2]=4 13786 B9R1.48 CC1CCOCC(C)N1 Amb27812547 [0,1,0,1,0,0|1,0,1]=4 13787 B9R1.48 CC1CCSCC(C)N1 Amb28124099 [0,1,0,1,0,0|1,0,1]=4 13788 B9R1.48 CC1CN(C)CCCN1 Amb10607815 [0,1,0,1,0,0|2,0,0]=4 13789 B9R1.48 CC1CN(C)CCCN1 Amb22587015 [0,1,0,1,0,0|2,0,0]=4 13790 B9R1.48 CC1CNCCC(=O)N1 Amb27838526 [0,1,0,1,0,0|1,0,0]=3 13791 B9R1.48 CC1CNCCN(C)C1 Amb18943771 [0,1,0,1,0,0|2,0,0]=4 13792 B9R1.48 CC1CNCCS(=O)C1 Amb26610537 [0,1,0,1,0,0|1,0,0]=3 13793 B9R1.48 CC1CNCCS(=O)C1 Amb28555360 [0,1,0,1,0,0|1,0,0]=3 13794 B9R1.48 CC1COCCC(=O)N1 Amb28123242 [0,1,0,1,0,0|1,0,0]=3 13795 B9R1.48 CC1COCCN(N)C1 Amb27435797 [0,1,0,1,0,0|2,0,0]=4 13796 B9R1.48 CC1CSCCC(=O)N1 Amb27253792 [0,1,0,1,0,0|1,0,0]=3 13797 B9R1.48 CC1NCCCN(C)N1 Amb27393459 [0,1,0,1,0,0|2,0,0]=4 13798 B9R1.48 CN1CCCCC(N)C1 Amb19516791 [0,1,0,1,0,0|1,0,1]=4 13799 B9R1.48 CN1CCCCN(C)C1 Amb26012589 [0,1,0,1,0,0|2,0,0]=4 13800 B9R1.48 CN1CCCNC(=O)C1 Amb28282218 [0,1,0,1,0,0|1,0,0]=3 13801 B9R1.48 C[C@@H]1CC(=O)NCCN1 Amb26457829 [0,1,0,1,0,0|1,0,0]=3 13802 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,1,0,0|0,0,0]=2 13803 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [0,1,0,1,0,0|0,0,0]=2 13804 B9R1.48 C[C@@H]1CCNC[C@H](C)C1 Amb35746843 [0,1,0,1,0,0|1,0,1]=4 13805 B9R1.48 C[C@@H]1CN(C)CCCN1 Amb18832596 [0,1,0,1,0,0|2,0,0]=4 13806 B9R1.48 C[C@@H]1CN(C)CCCN1 Amb23385288 [0,1,0,1,0,0|2,0,0]=4 13807 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [0,1,0,1,0,0|0,0,0]=2 13808 B9R1.48 C[C@H]1CCNC[C@@H](C)O1 Amb32667163 [0,1,0,1,0,0|0,0,2]=4 13809 B9R1.48 C[C@H]1CN(C)CCCN1 Amb23385303 [0,1,0,1,0,0|2,0,0]=4 13810 B9R1.48 NC1CCCCC(F)C1 Amb24454709 [0,1,0,1,0,0|1,0,1]=4 13811 B9R1.48 N[C@@H]1CCCC[C@H](O)C1 Amb27188377 [0,1,0,1,0,0|0,0,2]=4 13812 B9R1.48 O=C1C=CCC[C@H](O)C1 Amb27838758 [0,1,0,1,0,0|0,0,2]=4 13813 B9R1.48 O=C1CCCCC(=O)C1 Amb10603368 [0,1,0,1,0,0|0,0,1]=3 13814 B9R1.48 O=C1CCCCC(=O)N1 Amb8439258 [0,1,0,1,0,0|1,0,1]=4 13815 B9R1.48 O=C1CCCCC(=O)O1 Amb8487366 [0,1,0,1,0,0|1,0,1]=4 13816 B9R1.48 O=C1CCCCC(=S)N1 Amb24374795 [0,1,0,1,0,0|1,0,1]=4 13817 B9R1.48 O=C1CCCCC(O)C1 Amb27838745 [0,1,0,1,0,0|0,0,0]=2 13818 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [0,1,0,1,0,0|1,0,0]=3 13819 B9R1.48 O=C1CCCC[C@H](O)C1 Amb27618242 [0,1,0,1,0,0|0,0,0]=2 13820 B9R1.48 O=C1CCCNC(=O)C1 Amb18832700 [0,1,0,1,0,0|1,0,1]=4 13821 B9R1.48 OC1C=C(Br)CCCC1 Amb28455049 [0,1,0,1,0,0|1,0,1]=4 13822 B9R1.52 CC(=O)C1=C(C)CC1C Amb25879399 [0,1,0,1,0,0|0,0,2]=4 13823 B9R1.52 CC(=O)N1C(C)CC1C Amb27180757 [0,1,0,1,0,0|1,0,0]=3 13824 B9R1.52 CC1CC(O)C1C(=O)O Amb28076807 [0,1,0,1,0,0|1,0,0]=3 13825 B9R1.52 CC1CN(C)[C@@H]1C(=O)O Amb30869400 [0,1,0,1,0,0|2,0,0]=4 13826 B9R1.52 CC1CN(C)[C@H]1C(=O)O Amb34915559 [0,1,0,1,0,0|2,0,0]=4 13827 B9R1.52 C[C@H]1C[C@@H](O)[C@H]1C(=O)O Amb28057126 [0,1,0,1,0,0|1,0,0]=3 13828 B9R1.53 C=C1CC(CC(=O)O)C1 Amb35788335 [0,1,0,1,0,0|1,0,1]=4 13829 B9R1.53 C=C1CC(OC(C)=O)C1 Amb34165437 [0,1,0,1,0,0|1,0,1]=4 13830 B9R1.53 C=C1CN(CC(C)N)C1 Amb35605394 [0,1,0,1,0,0|2,0,0]=4 13831 B9R1.53 C=C1CN(C[C@@H](C)N)C1 Amb30025362 [0,1,0,1,0,0|2,0,0]=4 13832 B9R1.53 C=C1CN(C[C@H](C)N)C1 Amb30025293 [0,1,0,1,0,0|2,0,0]=4 13833 B9R1.53 CC(=O)CC1CC(=O)N1 Amb26593659 [0,1,0,1,0,0|1,0,1]=4 13834 B9R1.53 CC(=O)CC1CC(C)C1 Amb28141809 [0,1,0,1,0,0|0,0,0]=2 13835 B9R1.53 CC(=O)CC1CC(N)C1 Amb33132563 [0,1,0,1,0,0|0,0,0]=2 13836 B9R1.53 CC(=O)C[C@H]1C[C@H](C)C1 Amb28193019 [0,1,0,1,0,0|0,0,0]=2 13837 B9R1.53 CC(=O)NC1CC(C)C1 Amb27465175 [0,1,0,1,0,0|1,0,0]=3 13838 B9R1.53 CC(=O)NC1CC(N)C1 Amb30594183 [0,1,0,1,0,0|1,0,0]=3 13839 B9R1.53 CC(=O)NC1CC(N)C1 Amb9458539 [0,1,0,1,0,0|1,0,0]=3 13840 B9R1.53 CC(=O)NC1CN(C)C1 Amb28383021 [0,1,0,1,0,0|2,0,0]=4 13841 B9R1.53 CC(=O)N[C@H]1C[C@H](N)C1 Amb27881328 [0,1,0,1,0,0|1,0,0]=3 13842 B9R1.53 CC(=O)OC1CC(=O)C1 Amb21961279 [0,1,0,1,0,0|1,0,1]=4 13843 B9R1.53 CC(=O)O[C@H]1C[C@@H](O)C1 Amb34156629 [0,1,0,1,0,0|1,0,0]=3 13844 B9R1.53 CC(=O)O[C@H]1C[C@H](O)C1 Amb25777769 [0,1,0,1,0,0|1,0,0]=3 13845 B9R1.53 CC(=O)SC1CC(F)C1 Amb34136222 [0,1,0,1,0,0|1,0,0]=3 13846 B9R1.53 CC(C)CC1CC(=O)C1 Amb28246719 [0,1,0,1,0,0|0,0,0]=2 13847 B9R1.53 CC(C)CC1CC(=O)N1 Amb26853129 [0,1,0,1,0,0|1,0,0]=3 13848 B9R1.53 CC(C)OC1CC(=O)C1 Amb26031896 [0,1,0,1,0,0|1,0,0]=3 13849 B9R1.53 CC(N)CC1CC(=O)N1 Amb32676997 [0,1,0,1,0,0|1,0,0]=3 13850 B9R1.53 CC(O)CC1CC(=O)N1 Amb26596056 [0,1,0,1,0,0|1,0,0]=3 13851 B9R1.53 CC1CC(CC(=O)O)C1 Amb27461451 [0,1,0,1,0,0|1,0,0]=3 13852 B9R1.53 CC1CC(CN(C)C)C1 Amb30666522 [0,1,0,1,0,0|2,0,0]=4 13853 B9R1.53 CC1CC(CN(C)N)C1 Amb30031831 [0,1,0,1,0,0|2,0,0]=4 13854 B9R1.53 CC1CC(CS(=O)Cl)C1 Amb32720979 [0,1,0,1,0,0|2,0,0]=4 13855 B9R1.53 CC1CC(CS(N)=O)C1 Amb32720992 [0,1,0,1,0,0|2,0,0]=4 13856 B9R1.53 CC1CC(NC(=O)Cl)C1 Amb35631524 [0,1,0,1,0,0|2,0,0]=4 13857 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,1,0,1,0,0|2,0,0]=4 13858 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,1,0,1,0,0|2,0,0]=4 13859 B9R1.53 CC1CN(CC(N)=O)C1 Amb35587579 [0,1,0,1,0,0|2,0,0]=4 13860 B9R1.53 CN(C)CC1CC(N)C1 Amb25135633 [0,1,0,1,0,0|2,0,0]=4 13861 B9R1.53 CN(C)CC1CC(O)C1 Amb27485277 [0,1,0,1,0,0|2,0,0]=4 13862 B9R1.53 CN(C)C[C@H]1C[C@@H](N)C1 Amb35788570 [0,1,0,1,0,0|2,0,0]=4 13863 B9R1.53 CN(C)C[C@H]1C[C@H](N)C1 Amb25209521 [0,1,0,1,0,0|2,0,0]=4 13864 B9R1.53 CN(C)C[C@H]1C[C@H](N)C1 Amb35788146 [0,1,0,1,0,0|2,0,0]=4 13865 B9R1.53 CN1CC(CC(=O)O)C1 Amb26596162 [0,1,0,1,0,0|2,0,0]=4 13866 B9R1.53 CN1CC(CC(=O)O)C1 Amb28895941 [0,1,0,1,0,0|2,0,0]=4 13867 B9R1.53 CS(=O)CC1CC(N)C1 Amb30040100 [0,1,0,1,0,0|1,0,0]=3 13868 B9R1.53 C[C@H]1C[C@H](CC(=O)O)C1 Amb27859343 [0,1,0,1,0,0|1,0,0]=3 13869 B9R1.53 NC(=O)CC1CC(N)C1 Amb32682490 [0,1,0,1,0,0|1,0,0]=3 13870 B9R1.53 NC(=O)CC1CC(N)C1 Amb32682492 [0,1,0,1,0,0|1,0,0]=3 13871 B9R1.53 NC(=O)CN1CC(N)C1 Amb28287183 [0,1,0,1,0,0|2,0,0]=4 13872 B9R1.53 NC(=O)NC1CC(N)C1 Amb33527601 [0,1,0,1,0,0|2,0,0]=4 13873 B9R1.53 NC(=O)NC1CC(N)C1 Amb9460200 [0,1,0,1,0,0|2,0,0]=4 13874 B9R1.53 NC(=S)CC1CC(F)C1 Amb33330076 [0,1,0,1,0,0|1,1,0]=4 13875 B9R1.53 NC1CC(CC(=O)O)C1 Amb23440231 [0,1,0,1,0,0|1,0,0]=3 13876 B9R1.53 NC1CC(CC(=O)O)C1 Amb30585228 [0,1,0,1,0,0|1,0,0]=3 13877 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb23440232 [0,1,0,1,0,0|1,0,0]=3 13878 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb24056536 [0,1,0,1,0,0|1,0,0]=3 13879 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb23440233 [0,1,0,1,0,0|1,0,0]=3 13880 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb31291707 [0,1,0,1,0,0|1,0,0]=3 13881 B9R1.53 O=C(Cl)O[C@H]1C[C@H](Br)C1 Amb33297200 [0,1,0,1,0,0|2,0,0]=4 13882 B9R1.53 O=C(Cl)O[C@H]1C[C@H](Cl)C1 Amb33297198 [0,1,0,1,0,0|2,0,0]=4 13883 B9R1.53 O=C(O)CC1CC(=O)C1 Amb27493654 [0,1,0,1,0,0|1,0,1]=4 13884 B9R1.53 O=C(O)CC1CC(F)C1 Amb27186311 [0,1,0,1,0,0|1,0,0]=3 13885 B9R1.53 O=C(O)CN1CC(O)C1 Amb25339150 [0,1,0,1,0,0|2,0,0]=4 13886 B9R1.53 O=C(O)C[C@H]1C[C@@H](O)C1 Amb26043308 [0,1,0,1,0,0|1,0,0]=3 13887 B9R1.53 O=C(O)C[C@H]1C[C@H](O)C1 Amb25204858 [0,1,0,1,0,0|1,0,0]=3 13888 B9R1.53 O=C([O-])CN1CC(O)C1 Amb35751645 [0,1,0,1,0,0|2,0,0]=4 13889 B9R1.59 C=C(C)C1CC1CCO Amb28400433 [0,1,0,1,0,0|1,0,0]=3 13890 B9R1.59 CC#CC1CC1C(=O)O Amb27406350 [0,1,0,1,0,0|1,0,1]=4 13891 B9R1.59 CC#C[C@@H]1C[C@H]1C(=O)O Amb27789635 [0,1,0,1,0,0|1,0,1]=4 13892 B9R1.59 CC(=O)C1CC1CC=O Amb28058511 [0,1,0,1,0,0|0,0,1]=3 13893 B9R1.59 CC(=O)[C@@H]1C[C@@H]1CC=O Amb27229169 [0,1,0,1,0,0|0,0,1]=3 13894 B9R1.59 CC(C)C1CC1CCN Amb27849221 [0,1,0,1,0,0|1,0,1]=4 13895 B9R1.59 CC(C)[C@H]1C[C@H]1CCO Amb27429554 [0,1,0,1,0,0|1,0,1]=4 13896 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [0,1,0,1,0,0|1,0,0]=3 13897 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [0,1,0,1,0,0|1,0,0]=3 13898 B9R1.59 CCCC1OC1C(C)=O Amb25888683 [0,1,0,1,0,0|0,0,0]=2 13899 B9R1.59 CCCC1OC1C(C)O Amb26924649 [0,1,0,1,0,0|0,0,2]=4 13900 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [0,1,0,1,0,0|1,0,0]=3 13901 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [0,1,0,1,0,0|1,0,0]=3 13902 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [0,1,0,1,0,0|1,0,0]=3 13903 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [0,1,0,1,0,0|1,0,0]=3 13904 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|0,0,0]=2 13905 B9R1.59 CCC[C@@H]1O[C@H]1[C@@H](C)O Amb27255265 [0,1,0,1,0,0|0,0,2]=4 13906 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [0,1,0,1,0,0|1,0,0]=3 13907 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [0,1,0,1,0,0|1,0,0]=3 13908 B9R1.59 CCC[C@H]1O[C@@H]1C(C)=O Amb28325243 [0,1,0,1,0,0|0,0,0]=2 13909 B9R1.59 CCOC1CC1C(=O)Cl Amb35717348 [0,1,0,1,0,0|1,0,0]=3 13910 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [0,1,0,1,0,0|1,0,0]=3 13911 B9R1.59 CCOC1CC1C(C)=O Amb27838755 [0,1,0,1,0,0|0,0,0]=2 13912 B9R1.59 CCOC1CC1C(C)N Amb35732341 [0,1,0,1,0,0|1,0,1]=4 13913 B9R1.59 CCOC1CC1C(C)O Amb28049260 [0,1,0,1,0,0|0,0,2]=4 13914 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [0,1,0,1,0,0|1,0,0]=3 13915 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [0,1,0,1,0,0|1,0,0]=3 13916 B9R1.59 CNCC1CC1C(C)C Amb18995730 [0,1,0,1,0,0|1,0,1]=4 13917 B9R1.59 COCC1CC1C(=O)O Amb27404704 [0,1,0,1,0,0|1,0,0]=3 13918 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [0,1,0,1,0,0|1,0,0]=3 13919 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [0,1,0,1,0,0|1,0,0]=3 13920 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [0,1,0,1,0,0|1,0,0]=3 13921 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [0,1,0,1,0,0|1,0,0]=3 13922 B9R1.59 C\C=C\C1CC1C(=O)O Amb27169581 [0,1,0,1,0,0|1,0,1]=4 13923 B9R1.59 C\C=C\[C@@H]1C[C@H]1C(=O)O Amb27771439 [0,1,0,1,0,0|1,0,1]=4 13924 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [0,1,0,1,0,0|1,0,0]=3 13925 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [0,1,0,1,0,0|1,0,0]=3 13926 B9R1.66 C=C1CCCC(C)(C)C1 Amb27171015 [0,1,0,1,0,0|1,0,0]=3 13927 B9R1.66 C=C1CCNC(C)(C)C1 Amb29861445 [0,1,0,1,0,0|2,0,0]=4 13928 B9R1.66 CC1(C)CC(=O)CCN1 Amb18832677 [0,1,0,1,0,0|1,0,0]=3 13929 B9R1.66 CC1(C)CC(=O)CCN1 Amb22756378 [0,1,0,1,0,0|1,0,0]=3 13930 B9R1.66 CC1(C)CC(=O)CCO1 Amb533122 [0,1,0,1,0,0|1,0,0]=3 13931 B9R1.66 CC1(C)CC(=O)CCS1 Amb17593636 [0,1,0,1,0,0|1,0,0]=3 13932 B9R1.66 CC1(C)CC=CC(=O)C1 Amb9782605 [0,1,0,1,0,0|0,0,2]=4 13933 B9R1.66 CC1(C)CCCC(=O)C1 Amb13883565 [0,1,0,1,0,0|0,0,0]=2 13934 B9R1.66 CC1(C)CCCC(=O)N1 Amb26079134 [0,1,0,1,0,0|1,0,0]=3 13935 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,1,0,1,0,0|1,0,0]=3 13936 B9R1.66 CC1(C)CCCC(Br)C1 Amb27251530 [0,1,0,1,0,0|1,0,1]=4 13937 B9R1.66 CC1(C)CCCC(N)C1 Amb25054220 [0,1,0,1,0,0|1,0,1]=4 13938 B9R1.66 CC1(C)CCCC(O)C1 Amb4034655 [0,1,0,1,0,0|0,0,2]=4 13939 B9R1.66 CC1(C)CCCC(S)C1 Amb25147171 [0,1,0,1,0,0|0,1,1]=4 13940 B9R1.66 CC1(C)CCCN(N)C1 Amb25724356 [0,1,0,1,0,0|2,0,0]=4 13941 B9R1.66 CC1(C)CCC[C@@H](Cl)C1 Amb27974140 [0,1,0,1,0,0|1,0,1]=4 13942 B9R1.66 CC1(C)CCC[C@@H](N)C1 Amb27489174 [0,1,0,1,0,0|1,0,1]=4 13943 B9R1.66 CC1(C)CCC[C@@H](N)C1 Amb34913477 [0,1,0,1,0,0|1,0,1]=4 13944 B9R1.66 CC1(C)CCC[C@H](N)C1 Amb33716151 [0,1,0,1,0,0|1,0,1]=4 13945 B9R1.66 CC1(C)CCNC(=O)C1 Amb24451332 [0,1,0,1,0,0|1,0,0]=3 13946 B9R1.66 CC1(C)CCOC(=O)C1 Amb27826965 [0,1,0,1,0,0|1,0,0]=3 13947 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,1,0,1,0,0|2,0,0]=4 13948 B9R1.66 CC1(C)CNCC(=O)N1 Amb32412168 [0,1,0,1,0,0|2,0,0]=4 13949 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,1,0,1,0,0|2,0,0]=4 13950 B9R1.66 CC1(C)COCC(=O)C1 Amb26515851 [0,1,0,1,0,0|1,0,0]=3 13951 B9R1.66 CC1(C)COCC(=O)N1 Amb5787087 [0,1,0,1,0,0|2,0,0]=4 13952 B9R1.66 CC1(C)CS(=O)CCN1 Amb24271114 [0,1,0,1,0,0|2,0,0]=4 13953 B9R1.66 CC1(C)CS(=O)CCN1 Amb33249695 [0,1,0,1,0,0|2,0,0]=4 13954 B9R1.66 CC1(C)CSCC(=O)N1 Amb27169504 [0,1,0,1,0,0|2,0,0]=4 13955 B9R1.66 CC1(F)CCCC(N)C1 Amb27639970 [0,1,0,1,0,0|1,0,1]=4 13956 B9R1.66 CC1(F)CCCC(N)C1 Amb32663456 [0,1,0,1,0,0|1,0,1]=4 13957 B9R1.66 CC1(N)CCCC(O)C1 Amb27186457 [0,1,0,1,0,0|0,0,2]=4 13958 B9R1.66 CC1(O)CCCC(=O)C1 Amb28202235 [0,1,0,1,0,0|0,0,0]=2 13959 B9R1.66 CC1(O)CCOC(=O)C1 Amb2695275 [0,1,0,1,0,0|1,0,0]=3 13960 B9R1.66 CC1(S)CCCC(O)C1 Amb27203793 [0,1,0,1,0,0|0,0,2]=4 13961 B9R1.66 CC1=NC(C)(C)CCC1 Amb24101420 [0,1,0,1,0,0|1,0,0]=3 13962 B9R1.66 CC1=NC(C)(C)CCN1 Amb30021268 [0,1,0,1,0,0|2,0,0]=4 13963 B9R1.66 CC1=NC(C)(C)CCS1 Amb28068173 [0,1,0,1,0,0|2,0,0]=4 13964 B9R1.66 CC1CCCC(C)(C)C1 Amb22232328 [0,1,0,1,0,0|1,0,1]=4 13965 B9R1.66 CC1CCCC(C)(C)N1 Amb18642555 [0,1,0,1,0,0|1,0,1]=4 13966 B9R1.66 CC1CCCC(C)(C)N1 Amb30585190 [0,1,0,1,0,0|1,0,1]=4 13967 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [0,1,0,1,0,0|0,0,2]=4 13968 B9R1.66 CC1CCCC(C)(N)C1 Amb9676043 [0,1,0,1,0,0|1,0,1]=4 13969 B9R1.66 CC1CCCC(C)(O)C1 Amb9675873 [0,1,0,1,0,0|0,0,2]=4 13970 B9R1.66 CC1CCCC(F)(F)C1 Amb19892744 [0,1,0,1,0,0|1,0,1]=4 13971 B9R1.66 CC1CS(=O)(=O)CCN1 Amb19515399 [0,1,0,1,0,0|2,0,0]=4 13972 B9R1.66 CC1CS(=O)(=O)CCN1 Amb32758712 [0,1,0,1,0,0|2,0,0]=4 13973 B9R1.66 CC1CS(=O)(=O)CCO1 Amb2736270 [0,1,0,1,0,0|2,0,0]=4 13974 B9R1.66 CN1CCCC(C)(N)C1 Amb18203240 [0,1,0,1,0,0|2,0,0]=4 13975 B9R1.66 C[C@@H]1CCC[C@](C)(N)C1 Amb27619046 [0,1,0,1,0,0|1,0,1]=4 13976 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb24652818 [0,1,0,1,0,0|2,0,0]=4 13977 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb33621085 [0,1,0,1,0,0|2,0,0]=4 13978 B9R1.66 C[C@@]1(F)CCC[C@@H](O)C1 Amb27857867 [0,1,0,1,0,0|0,0,2]=4 13979 B9R1.66 C[C@@]1(O)CCC[C@H](Cl)C1 Amb28246817 [0,1,0,1,0,0|0,0,2]=4 13980 B9R1.66 C[C@@]1(O)CCOC(=O)C1 Amb22388612 [0,1,0,1,0,0|1,0,0]=3 13981 B9R1.66 C[C@@]1(S)CCC[C@@H](O)C1 Amb28079180 [0,1,0,1,0,0|0,0,2]=4 13982 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb25246713 [0,1,0,1,0,0|2,0,0]=4 13983 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb33621086 [0,1,0,1,0,0|2,0,0]=4 13984 B9R1.66 C[Si]1(C)CCCC(=O)O1 Amb27845166 [0,1,0,1,0,0|1,1,0]=4 13985 B9R1.66 NC1CCCS(=O)(=O)C1 Amb13953229 [0,1,0,1,0,0|2,0,0]=4 13986 B9R1.66 NC1CCCS(=O)(=O)C1 Amb19319042 [0,1,0,1,0,0|2,0,0]=4 13987 B9R1.66 O=C1CC(F)(F)CCN1 Amb24567328 [0,1,0,1,0,0|2,0,0]=4 13988 B9R1.66 O=C1CCCC(F)(F)C1 Amb24543971 [0,1,0,1,0,0|1,0,0]=3 13989 B9R1.66 O=C1CCCS(=O)(=O)C1 Amb13953230 [0,1,0,1,0,0|2,0,0]=4 13990 B9R1.66 O=C1CNCC(F)(F)C1 Amb27656873 [0,1,0,1,0,0|2,0,0]=4 13991 B9R1.66 O=S1(=O)CCCC(Br)C1 Amb24449193 [0,1,0,1,0,0|2,0,0]=4 13992 B9R1.66 O=S1(=O)CCCC(O)C1 Amb20622668 [0,1,0,1,0,0|2,0,0]=4 13993 B9R1.66 O=S1(=O)CCCC(S)C1 Amb27783739 [0,1,0,1,0,0|2,0,0]=4 13994 B9R1.75 CCCC(C)CC1CO1 Amb25769573 [0,1,0,1,0,0|0,0,2]=4 13995 B9R1.75 CCC[C@@H](N)CC1CC1 Amb27657336 [0,1,0,1,0,0|1,0,1]=4 13996 B9R1.86 C=C(C)C[C@@H]1O[C@@H]1CCl Amb27422052 [0,1,0,1,0,0|2,0,0]=4 13997 B9R1.86 C=C(C)C[C@@H]1O[C@@H]1CO Amb28345314 [0,1,0,1,0,0|2,0,0]=4 13998 B9R1.86 C=C(C)C[C@H]1O[C@@H]1CO Amb27257205 [0,1,0,1,0,0|2,0,0]=4 13999 B9R1.86 CC(C)CC1CC1CCl Amb27838523 [0,1,0,1,0,0|1,0,1]=4 14000 B9R1.86 CC(C)C[C@@H]1C[C@H]1CBr Amb27213690 [0,1,0,1,0,0|1,0,1]=4 14001 B9R1.86 CC(C)C[C@@H]1C[C@H]1CN Amb26895733 [0,1,0,1,0,0|1,0,1]=4 14002 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|1,0,0]=3 14003 B9R1.86 CCC1CC1NC(=O)Cl Amb35633240 [0,1,0,1,0,0|1,0,0]=3 14004 B9R1.86 CCC1OC1CC(C)O Amb28285301 [0,1,0,1,0,0|0,0,2]=4 14005 B9R1.86 CC[C@@H]1C[C@H]1NC(C)=O Amb28190147 [0,1,0,1,0,0|0,0,0]=2 14006 B9R1.86 CC[C@@H]1C[C@H]1NC(N)=O Amb28455899 [0,1,0,1,0,0|1,0,0]=3 14007 B9R1.86 CC[C@@H]1C[C@H]1\N=C(/C)N Amb27483213 [0,1,0,1,0,0|1,0,0]=3 14008 B9R1.86 CC[C@H]1O[C@H]1C[C@@H](C)O Amb27196630 [0,1,0,1,0,0|0,0,2]=4 14009 B9R1.86 CC[C@H]1O[C@H]1C[C@H](C)O Amb28430621 [0,1,0,1,0,0|0,0,2]=4 14010 B9R1.86 CNC1CC1CC(C)C Amb27965447 [0,1,0,1,0,0|1,0,1]=4 14011 B9R1.86 NC(=O)NC1CC1CO Amb27424914 [0,1,0,1,0,0|2,0,0]=4 14012 B9R1.86 NC(=O)N[C@@H]1C[C@H]1CO Amb27231937 [0,1,0,1,0,0|2,0,0]=4 14013 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,1,0,1,0,0|1,0,0]=3 14014 B9R1.136 CCNC1CS(=O)(=O)C1 Amb26530509 [0,1,0,1,0,0|2,0,0]=4 14015 B9R1.136 CNCC1CS(=O)(=O)C1 Amb27476607 [0,1,0,1,0,0|2,0,0]=4 14016 B9R1.136 NCCC1CS(=O)(=O)C1 Amb32758740 [0,1,0,1,0,0|2,0,0]=4 14017 B9R1.136 O=S1(=O)CC(CCBr)C1 Amb24645610 [0,1,0,1,0,0|2,0,0]=4 14018 B9R1.137 C=C(C)CC(=O)C1CC1 Amb27977021 [0,1,0,1,0,0|1,0,1]=4 14019 B9R1.137 CC(=N)NC(C)C1CC1 Amb28388144 [0,1,0,1,0,0|2,0,0]=4 14020 B9R1.137 CC(=O)CC(=O)C1CC1 Amb9206108 [0,1,0,1,0,0|0,0,1]=3 14021 B9R1.137 CC(=O)CC(C)C1CC1 Amb25877260 [0,1,0,1,0,0|0,0,0]=2 14022 B9R1.137 CC(=O)CC(N)C1CC1 Amb27228240 [0,1,0,1,0,0|0,0,0]=2 14023 B9R1.137 CC(=O)OC(C)C1CC1 Amb4418355 [0,1,0,1,0,0|1,0,0]=3 14024 B9R1.137 CC(=O)O[C@H](C)C1CC1 Amb28049288 [0,1,0,1,0,0|1,0,0]=3 14025 B9R1.137 CC(=O)\C=C(/C)C1CC1 Amb28351677 [0,1,0,1,0,0|0,0,2]=4 14026 B9R1.137 CC(=O)\C=C(\C)C1CC1 Amb25889814 [0,1,0,1,0,0|0,0,2]=4 14027 B9R1.137 CC(C)=CC(N)C1CC1 Amb28191877 [0,1,0,1,0,0|1,0,1]=4 14028 B9R1.137 CC(C)CC(Cl)C1CC1 Amb27842038 [0,1,0,1,0,0|1,0,1]=4 14029 B9R1.137 CC(C)CC(N)C1CC1 Amb18993302 [0,1,0,1,0,0|1,0,1]=4 14030 B9R1.137 CC(C)CC(O)C1CC1 Amb28125248 [0,1,0,1,0,0|1,0,1]=4 14031 B9R1.137 CC(CC(=N)N)C1CC1 Amb32729505 [0,1,0,1,0,0|2,0,0]=4 14032 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,1,0,1,0,0|1,0,0]=3 14033 B9R1.137 CC(CC(N)=S)C1CC1 Amb32729514 [0,1,0,1,0,0|1,1,0]=4 14034 B9R1.137 CC(CS(=O)Cl)C1CC1 Amb32720647 [0,1,0,1,0,0|2,0,0]=4 14035 B9R1.137 CC(CS(N)=O)C1CC1 Amb32720637 [0,1,0,1,0,0|2,0,0]=4 14036 B9R1.137 CC(C[C@@H](C)N)C1CC1 Amb32728775 [0,1,0,1,0,0|1,0,1]=4 14037 B9R1.137 CC(C[C@@H](C)O)C1CC1 Amb32728774 [0,1,0,1,0,0|0,0,2]=4 14038 B9R1.137 CC(C[C@H](C)N)C1CC1 Amb33224732 [0,1,0,1,0,0|1,0,1]=4 14039 B9R1.137 CC(C[C@H](C)O)C1CC1 Amb32728773 [0,1,0,1,0,0|0,0,2]=4 14040 B9R1.137 CC(N)CC(C)C1CC1 Amb25791148 [0,1,0,1,0,0|1,0,1]=4 14041 B9R1.137 CC(N)CC(O)C1CC1 Amb35583446 [0,1,0,1,0,0|1,0,1]=4 14042 B9R1.137 CC(NC(=O)Cl)C1CC1 Amb35625512 [0,1,0,1,0,0|2,0,0]=4 14043 B9R1.137 CC(NC(N)=O)C1CC1 Amb341486 [0,1,0,1,0,0|2,0,0]=4 14044 B9R1.137 CC(O)CC(N)C1CC1 Amb35582307 [0,1,0,1,0,0|0,0,2]=4 14045 B9R1.137 CN(C)CC(O)C1CC1 Amb28049067 [0,1,0,1,0,0|2,0,0]=4 14046 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,1,0,1,0,0|2,0,0]=4 14047 B9R1.137 CS(=O)CC(=O)C1CC1 Amb27984475 [0,1,0,1,0,0|1,0,1]=4 14048 B9R1.137 NC(=O)CC(N)C1CC1 Amb18988331 [0,1,0,1,0,0|1,0,0]=3 14049 B9R1.137 NC(=O)CC(N)C1CC1 Amb33549860 [0,1,0,1,0,0|1,0,0]=3 14050 B9R1.137 NC(=O)C[C@@H](N)C1CC1 Amb25259754 [0,1,0,1,0,0|1,0,0]=3 14051 B9R1.137 NC(=O)C[C@H](N)C1CC1 Amb28347712 [0,1,0,1,0,0|1,0,0]=3 14052 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,1,0,1,0,0|1,0,0]=3 14053 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,1,0,1,0,0|1,0,0]=3 14054 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,1,0,1,0,0|1,0,0]=3 14055 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,1,0,1,0,0|1,0,0]=3 14056 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,1,0,1,0,0|1,0,0]=3 14057 B9R1.137 O=C(O)CC(=O)C1CC1 Amb10576272 [0,1,0,1,0,0|1,0,1]=4 14058 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,1,0,1,0,0|1,0,0]=3 14059 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,1,0,1,0,0|1,0,0]=3 14060 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,1,0,1,0,0|1,0,0]=3 14061 B9R1.137 O=C([O-])CC(O)C1CC1 Amb31188275 [0,1,0,1,0,0|1,0,0]=3 14062 B9R1.137 O=[N+]([O-])CC(O)C1CC1 Amb22262975 [0,1,0,1,0,0|2,0,0]=4 14063 B9R1.171 C=C(C)CC1(N)CCC1 Amb35634487 [0,1,0,1,0,0|1,0,0]=3 14064 B9R1.171 C=C(C)CC1(O)CNC1 Amb33199516 [0,1,0,1,0,0|2,0,0]=4 14065 B9R1.171 CC(=O)CC1(C)CCC1 Amb27956527 [0,1,0,1,0,0|0,0,0]=2 14066 B9R1.171 CC(=O)CC1(C)COC1 Amb26542294 [0,1,0,1,0,0|1,0,0]=3 14067 B9R1.171 CC(=O)CC1(N)CCC1 Amb25889699 [0,1,0,1,0,0|0,0,0]=2 14068 B9R1.171 CC(=O)CC1(O)CCC1 Amb33295370 [0,1,0,1,0,0|0,0,0]=2 14069 B9R1.171 CC(=O)CC1(O)CNC1 Amb32943781 [0,1,0,1,0,0|1,0,0]=3 14070 B9R1.171 CC(=O)CC1(O)COC1 Amb32943788 [0,1,0,1,0,0|1,0,0]=3 14071 B9R1.171 CC(=O)NC1(C)CCC1 Amb16229572 [0,1,0,1,0,0|1,0,0]=3 14072 B9R1.171 CC(C)CC1(N)CCC1 Amb25705758 [0,1,0,1,0,0|1,0,1]=4 14073 B9R1.171 CC(Cl)CC1(C)CCC1 Amb27225243 [0,1,0,1,0,0|1,0,1]=4 14074 B9R1.171 CC(N)CC1(O)CCC1 Amb31261953 [0,1,0,1,0,0|1,0,1]=4 14075 B9R1.171 CC(N)CC1(O)CCC1 Amb33328684 [0,1,0,1,0,0|1,0,1]=4 14076 B9R1.171 CC(O)CC1(C)CCC1 Amb27866005 [0,1,0,1,0,0|0,0,2]=4 14077 B9R1.171 CC(O)CC1(N)CCC1 Amb26080254 [0,1,0,1,0,0|0,0,2]=4 14078 B9R1.171 CC(O)CC1(O)CCC1 Amb34148164 [0,1,0,1,0,0|0,0,2]=4 14079 B9R1.171 CC1(CC(=O)O)CCC1 Amb22735897 [0,1,0,1,0,0|1,0,0]=3 14080 B9R1.171 CC1(CC(=O)O)COC1 Amb20671333 [0,1,0,1,0,0|2,0,0]=4 14081 B9R1.171 CC1(CC(=O)[O-])COC1 Amb30647393 [0,1,0,1,0,0|2,0,0]=4 14082 B9R1.171 CC1(CS(=O)Cl)CCC1 Amb32720691 [0,1,0,1,0,0|2,0,0]=4 14083 B9R1.171 CC1(CS(=O)[O-])CCC1 Amb32754856 [0,1,0,1,0,0|2,0,0]=4 14084 B9R1.171 CC1(CS(N)=O)CCC1 Amb32720681 [0,1,0,1,0,0|2,0,0]=4 14085 B9R1.171 CC1(NC(=O)Cl)CCC1 Amb35633260 [0,1,0,1,0,0|2,0,0]=4 14086 B9R1.171 CC1(NC(N)=O)CCC1 Amb27233165 [0,1,0,1,0,0|2,0,0]=4 14087 B9R1.171 CN(C)CC1(N)CCC1 Amb26948367 [0,1,0,1,0,0|2,0,0]=4 14088 B9R1.171 CN(C)CC1(O)CCC1 Amb27448548 [0,1,0,1,0,0|2,0,0]=4 14089 B9R1.171 NC(=O)CC1(N)CCC1 Amb20622461 [0,1,0,1,0,0|1,0,0]=3 14090 B9R1.171 NC(=O)CC1(N)CCC1 Amb22059756 [0,1,0,1,0,0|1,0,0]=3 14091 B9R1.171 NC(=O)CC1(N)COC1 Amb22039447 [0,1,0,1,0,0|2,0,0]=4 14092 B9R1.171 NC(=O)CC1(N)CSC1 Amb26530400 [0,1,0,1,0,0|2,0,0]=4 14093 B9R1.171 NC1(CC(=O)O)CCC1 Amb20623514 [0,1,0,1,0,0|1,0,0]=3 14094 B9R1.171 NC1(CC(=O)O)CCC1 Amb22059493 [0,1,0,1,0,0|1,0,0]=3 14095 B9R1.171 NC1(CC(=O)O)CNC1 Amb28049161 [0,1,0,1,0,0|2,0,0]=4 14096 B9R1.171 NC1(CC(=O)O)COC1 Amb20671385 [0,1,0,1,0,0|2,0,0]=4 14097 B9R1.171 NC1(CC(=O)O)COC1 Amb33067975 [0,1,0,1,0,0|2,0,0]=4 14098 B9R1.171 NC1(CC(=O)O)CSC1 Amb33253735 [0,1,0,1,0,0|2,0,0]=4 14099 B9R1.171 NS(=O)CC1(F)CCC1 Amb32720727 [0,1,0,1,0,0|2,0,0]=4 14100 B9R1.171 O=C(Br)CC1(Br)CCC1 Amb27808544 [0,1,0,1,0,0|1,0,0]=3 14101 B9R1.171 O=C(O)CC1(F)CCC1 Amb28428638 [0,1,0,1,0,0|1,0,0]=3 14102 B9R1.171 O=C(O)CC1(F)COC1 Amb24564061 [0,1,0,1,0,0|2,0,0]=4 14103 B9R1.171 O=C(O)CC1(O)CCC1 Amb18961452 [0,1,0,1,0,0|1,0,0]=3 14104 B9R1.171 O=C(O)CC1(O)CNC1 Amb25041173 [0,1,0,1,0,0|2,0,0]=4 14105 B9R1.171 O=C(O)CC1(O)COC1 Amb32696745 [0,1,0,1,0,0|2,0,0]=4 14106 B9R1.171 O=C(O)CC1(O)CSC1 Amb27781373 [0,1,0,1,0,0|2,0,0]=4 14107 B9R1.171 O=C(O)CC1(S)CNC1 Amb27451139 [0,1,0,1,0,0|2,0,0]=4 14108 B9R1.171 O=S(Cl)CC1(F)CCC1 Amb32720726 [0,1,0,1,0,0|2,0,0]=4 14109 B9R1.171 O=S([O-])CC1(F)CCC1 Amb32754875 [0,1,0,1,0,0|2,0,0]=4 14110 B9R1.171 O=[N+]([O-])CC1(O)CCC1 Amb19958573 [0,1,0,1,0,0|2,0,0]=4 14111 B9R1.177 CC1(CC#N)CC(=O)C1 Amb33715814 [0,1,0,1,0,0|1,0,1]=4 14112 B9R1.177 CC1(CCO)CC(=O)N1 Amb27798375 [0,1,0,1,0,0|2,0,0]=4 14113 B9R1.177 CCCC1(N)CC(C)C1 Amb23449243 [0,1,0,1,0,0|1,0,1]=4 14114 B9R1.177 CCCC1(N)CC(O)C1 Amb33374802 [0,1,0,1,0,0|0,0,2]=4 14115 B9R1.177 CCCC1(O)CN(C)C1 Amb28388369 [0,1,0,1,0,0|2,0,0]=4 14116 B9R1.177 CCCC1(O)CN(N)C1 Amb27420684 [0,1,0,1,0,0|2,0,0]=4 14117 B9R1.177 COCC1(C)CC(=O)N1 Amb27265734 [0,1,0,1,0,0|2,0,0]=4 14118 B9R1.181 CCCC1(N)CC1(C)C Amb28139552 [0,1,0,1,0,0|1,0,1]=4 14119 B9R1.183 C=C1C[C@H]1[C@H](O)CCC Amb27213137 [0,1,0,1,0,0|1,0,0]=3 14120 B9R1.183 CCCC(C)C1CC1N Amb25983395 [0,1,0,1,0,0|1,0,1]=4 14121 B9R1.183 CCCC(C)C1OC1C Amb24596468 [0,1,0,1,0,0|0,0,2]=4 14122 B9R1.183 CCCC(C)[C@@H]1C[C@H]1N Amb33322342 [0,1,0,1,0,0|1,0,1]=4 14123 B9R1.183 CCCC(O)C1CC1C Amb27494272 [0,1,0,1,0,0|1,0,1]=4 14124 B9R1.183 CCCC(O)C1OC1C Amb27662392 [0,1,0,1,0,0|0,0,2]=4 14125 B9R1.183 CCCC(O)[C@@H]1C[C@H]1C Amb27423183 [0,1,0,1,0,0|1,0,1]=4 14126 B9R1.183 CCC[C@@H](O)C1CC1C Amb27658419 [0,1,0,1,0,0|1,0,1]=4 14127 B9R1.1 C#CC1CCC(=O)CC1 Amb27807116 [0,1,0,1,0,0|0,0,2]=4 14128 B9R1.1 C=C1CCC(CBr)CC1 Amb15695263 [0,1,0,1,0,0|2,0,0]=4 14129 B9R1.1 C=C1CCC(CN)CC1 Amb13882965 [0,1,0,1,0,0|2,0,0]=4 14130 B9R1.1 C=C1CCC(CN)CC1 Amb30585185 [0,1,0,1,0,0|2,0,0]=4 14131 B9R1.1 C=C1CCC(CO)CC1 Amb10975464 [0,1,0,1,0,0|2,0,0]=4 14132 B9R1.1 CC1=CCC(CO)CC1 Amb2699906 [0,1,0,1,0,0|2,0,0]=4 14133 B9R1.1 CC1=NOC(CO)CC1 Amb27192019 [0,1,0,1,0,0|1,0,1]=4 14134 B9R1.1 CC=C1CCC(=O)CC1 Amb28129794 [0,1,0,1,0,0|0,0,2]=4 14135 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,1,0,1,0,0|0,0,1]=3 14136 B9R1.1 CCC1CCC(=O)CC1 Amb6296028 [0,1,0,1,0,0|0,0,0]=2 14137 B9R1.1 CCC1CCC(Br)CC1 Amb8835445 [0,1,0,1,0,0|1,0,1]=4 14138 B9R1.1 CCC1CCC(C)CC1 Amb22227949 [0,1,0,1,0,0|1,0,1]=4 14139 B9R1.1 CCC1CCC(C)CN1 Amb27668440 [0,1,0,1,0,0|1,0,1]=4 14140 B9R1.1 CCC1CCC(C)NC1 Amb2782904 [0,1,0,1,0,0|1,0,1]=4 14141 B9R1.1 CCC1CCC(C)NC1 Amb28934993 [0,1,0,1,0,0|1,0,1]=4 14142 B9R1.1 CCC1CCC(N)CC1 Amb1117745 [0,1,0,1,0,0|1,0,1]=4 14143 B9R1.1 CCC1CCC(N)CC1 Amb32661500 [0,1,0,1,0,0|1,0,1]=4 14144 B9R1.1 CCC1CCC(N)CN1 Amb33275542 [0,1,0,1,0,0|1,0,1]=4 14145 B9R1.1 CCC1CCC(S)CC1 Amb9208051 [0,1,0,1,0,0|0,1,1]=4 14146 B9R1.1 CCC1CNC(=O)CN1 Amb18832614 [0,1,0,1,0,0|1,0,0]=3 14147 B9R1.1 CCC1CNC(=O)CO1 Amb27427622 [0,1,0,1,0,0|1,0,0]=3 14148 B9R1.1 CCC1CNC(=O)NC1 Amb25960166 [0,1,0,1,0,0|1,0,0]=3 14149 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,0]=3 14150 B9R1.1 CCN1CCC(=O)CC1 Amb4606003 [0,1,0,1,0,0|1,0,0]=3 14151 B9R1.1 CCP1CCC(=O)CC1 Amb28285169 [0,1,0,1,0,0|1,0,0]=3 14152 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb32665354 [0,1,0,1,0,0|1,0,1]=4 14153 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb33484385 [0,1,0,1,0,0|1,0,1]=4 14154 B9R1.1 CC[C@@H]1CC[C@H](C)NC1 Amb26423925 [0,1,0,1,0,0|1,0,1]=4 14155 B9R1.1 CC[C@H]1CCC(C)NC1 Amb28196699 [0,1,0,1,0,0|1,0,1]=4 14156 B9R1.1 CC[C@H]1CC[C@@H](C)CC1 Amb22230416 [0,1,0,1,0,0|1,0,1]=4 14157 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb26528612 [0,1,0,1,0,0|1,0,1]=4 14158 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb32652730 [0,1,0,1,0,0|1,0,1]=4 14159 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb27759922 [0,1,0,1,0,0|1,0,1]=4 14160 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb28935024 [0,1,0,1,0,0|1,0,1]=4 14161 B9R1.1 CC[C@H]1CC[C@H](O)CC1 Amb22231677 [0,1,0,1,0,0|0,0,2]=4 14162 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,1,0,1,0,0|1,0,0]=3 14163 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,1,0,1,0,0|1,0,0]=3 14164 B9R1.1 CNC1CCC(=O)NC1 Amb28047809 [0,1,0,1,0,0|1,0,0]=3 14165 B9R1.1 CNC1CCS(=O)CC1 Amb18948971 [0,1,0,1,0,0|2,0,0]=4 14166 B9R1.1 CNC1CCS(=O)CC1 Amb33549853 [0,1,0,1,0,0|2,0,0]=4 14167 B9R1.1 CN[C@@H]1CC=C(C)CC1 Amb28049919 [0,1,0,1,0,0|2,0,0]=4 14168 B9R1.1 COC1C=CC(=O)CC1 Amb27256443 [0,1,0,1,0,0|1,0,1]=4 14169 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|2,0,0]=4 14170 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,1,0,1,0,0|1,0,0]=3 14171 B9R1.1 COC1CCC(=O)CO1 Amb27265592 [0,1,0,1,0,0|1,0,0]=3 14172 B9R1.1 CON1CCC(=O)CC1 Amb20670427 [0,1,0,1,0,0|2,0,0]=4 14173 B9R1.1 CO[C@@H]1CCC(=O)CO1 Amb27659850 [0,1,0,1,0,0|1,0,0]=3 14174 B9R1.1 CSC1C=CC(=O)CC1 Amb27211800 [0,1,0,1,0,0|1,0,1]=4 14175 B9R1.1 N#CC1CCC(=O)CC1 Amb16231535 [0,1,0,1,0,0|1,0,1]=4 14176 B9R1.1 N#CC1CCC(=O)CS1 Amb23596953 [0,1,0,1,0,0|1,0,1]=4 14177 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,1,0,1,0,0|1,0,0]=3 14178 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,1,0,1,0,0|1,0,0]=3 14179 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,1,0,1,0,0|1,0,0]=3 14180 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,1,0,1,0,0|1,0,0]=3 14181 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,1,0,1,0,0|1,0,0]=3 14182 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,1,0,1,0,0|2,0,0]=4 14183 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,1,0,1,0,0|2,0,0]=4 14184 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,1,0,1,0,0|2,0,0]=4 14185 B9R1.1 O=C1C=C[C@@H](CO)CC1 Amb27838659 [0,1,0,1,0,0|1,0,1]=4 14186 B9R1.1 O=C1CC=C(CO)CC1 Amb28253672 [0,1,0,1,0,0|1,0,1]=4 14187 B9R1.1 O=C1CCC(CBr)CC1 Amb26583100 [0,1,0,1,0,0|1,0,0]=3 14188 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,1,0,1,0,0|1,0,0]=3 14189 B9R1.1 O=C1CCC(CCl)CC1 Amb27196238 [0,1,0,1,0,0|1,0,0]=3 14190 B9R1.1 O=C1CCC(CO)CC1 Amb10071596 [0,1,0,1,0,0|1,0,0]=3 14191 B9R1.1 O=C1CCC(CO)CN1 Amb19958990 [0,1,0,1,0,0|1,0,0]=3 14192 B9R1.1 O=C1COC(CBr)CN1 Amb28281419 [0,1,0,1,0,0|2,0,0]=4 14193 B9R1.1 O=C1COC(CCl)CO1 Amb33734959 [0,1,0,1,0,0|2,0,0]=4 14194 B9R1.1 O=C1COC(CO)CN1 Amb22236094 [0,1,0,1,0,0|2,0,0]=4 14195 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|2,0,0]=4 14196 B9R1.1 O=C1CO[C@H](CO)CN1 Amb10067153 [0,1,0,1,0,0|2,0,0]=4 14197 B9R1.1 O=CC1CCC(=O)CC1 Amb8385725 [0,1,0,1,0,0|1,0,1]=4 14198 B9R1.1 OCC1CC=C(O)CC1 Amb27465669 [0,1,0,1,0,0|1,0,1]=4 14199 B9R1.2 C#CC1CCCC(=O)C1 Amb26842390 [0,1,0,1,0,0|0,0,1]=3 14200 B9R1.2 C#CC1CCCC(=O)N1 Amb27211198 [0,1,0,1,0,0|1,0,1]=4 14201 B9R1.2 C#CC1CCCC(C)C1 Amb27440120 [0,1,0,1,0,0|1,0,1]=4 14202 B9R1.2 C#C[C@H]1CCCC(=O)N1 Amb27863767 [0,1,0,1,0,0|1,0,1]=4 14203 B9R1.2 C=CC1CCCC(=O)C1 Amb28250679 [0,1,0,1,0,0|0,0,1]=3 14204 B9R1.2 C=CC1CCCC(=O)N1 Amb26036889 [0,1,0,1,0,0|1,0,1]=4 14205 B9R1.2 C=CN1CCCC(=O)C1 Amb25887409 [0,1,0,1,0,0|0,0,2]=4 14206 B9R1.2 CC1C=C(C=O)CCC1 Amb4035517 [0,1,0,1,0,0|0,0,1]=3 14207 B9R1.2 CC1CC(C=O)CCO1 Amb18642617 [0,1,0,1,0,0|1,0,1]=4 14208 B9R1.2 CC1CCCC(C#N)C1 Amb8950073 [0,1,0,1,0,0|1,0,1]=4 14209 B9R1.2 CC1CCCC(C=O)C1 Amb22059519 [0,1,0,1,0,0|0,0,1]=3 14210 B9R1.2 CC1CCCC(C=O)O1 Amb27956485 [0,1,0,1,0,0|1,0,1]=4 14211 B9R1.2 CC1CCCC(CBr)C1 Amb22059638 [0,1,0,1,0,0|1,0,1]=4 14212 B9R1.2 CC1CCCC(CBr)O1 Amb28341224 [0,1,0,1,0,0|0,0,2]=4 14213 B9R1.2 CC1CCCC(CCl)C1 Amb27664585 [0,1,0,1,0,0|1,0,1]=4 14214 B9R1.2 CC1CCCC(CI)C1 Amb28128033 [0,1,0,1,0,0|1,0,1]=4 14215 B9R1.2 CC1CCCC(CI)O1 Amb27236991 [0,1,0,1,0,0|0,0,2]=4 14216 B9R1.2 CC1CCCC(CN)C1 Amb8950171 [0,1,0,1,0,0|1,0,1]=4 14217 B9R1.2 CC1CCCC(CN)N1 Amb25930766 [0,1,0,1,0,0|1,0,1]=4 14218 B9R1.2 CC1CCCC(CN)O1 Amb25940618 [0,1,0,1,0,0|0,0,2]=4 14219 B9R1.2 CC1CCCC(CO)C1 Amb20248640 [0,1,0,1,0,0|0,0,2]=4 14220 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|1,0,1]=4 14221 B9R1.2 CC1CCCC(CS)C1 Amb26505263 [0,1,0,1,0,0|0,1,1]=4 14222 B9R1.2 CC1CCCC(NN)C1 Amb10610509 [0,1,0,1,0,0|1,0,1]=4 14223 B9R1.2 CC1CCCC(NN)C1 Amb28990931 [0,1,0,1,0,0|1,0,1]=4 14224 B9R1.2 CC1CCCC(NN)C1 Amb6246756 [0,1,0,1,0,0|1,0,1]=4 14225 B9R1.2 CC1CCCC(NO)C1 Amb27436769 [0,1,0,1,0,0|0,0,2]=4 14226 B9R1.2 CC1CCCN(C#N)C1 Amb27250661 [0,1,0,1,0,0|2,0,0]=4 14227 B9R1.2 CC1CCCN(N=O)C1 Amb27266128 [0,1,0,1,0,0|1,0,0]=3 14228 B9R1.2 CC1CCC\C(=N/N)C1 Amb27208036 [0,1,0,1,0,0|1,0,0]=3 14229 B9R1.2 CC1CCC\C(=N/O)C1 Amb27752449 [0,1,0,1,0,0|0,0,1]=3 14230 B9R1.2 CC1CCC\[N+](=C/Cl)C1 Amb27484106 [0,1,0,1,0,0|2,0,0]=4 14231 B9R1.2 CC1CCNC(CO)=N1 Amb27246454 [0,1,0,1,0,0|2,0,0]=4 14232 B9R1.2 CC1CCOC(C=O)C1 Amb25032291 [0,1,0,1,0,0|1,0,1]=4 14233 B9R1.2 CC1CN(C=O)CCN1 Amb27984457 [0,1,0,1,0,0|2,0,0]=4 14234 B9R1.2 CC1C\C(=N\N)CCO1 Amb27837611 [0,1,0,1,0,0|2,0,0]=4 14235 B9R1.2 CCC1=CC(=O)CCC1 Amb27599813 [0,1,0,1,0,0|0,0,1]=3 14236 B9R1.2 CCC1=CC(=O)CCN1 Amb27595544 [0,1,0,1,0,0|0,0,2]=4 14237 B9R1.2 CCC1=CC(=O)CSC1 Amb27838665 [0,1,0,1,0,0|0,0,2]=4 14238 B9R1.2 CCC1=CC(N)CCC1 Amb27173637 [0,1,0,1,0,0|2,0,0]=4 14239 B9R1.2 CCC1=C[C@H](O)CCC1 Amb28064187 [0,1,0,1,0,0|2,0,0]=4 14240 B9R1.2 CCC1CC(=O)C=CN1 Amb28285113 [0,1,0,1,0,0|0,0,2]=4 14241 B9R1.2 CCC1CC(=O)C=CO1 Amb28076224 [0,1,0,1,0,0|0,0,2]=4 14242 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|0,0,0]=2 14243 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|0,0,0]=2 14244 B9R1.2 CCC1CC(=O)CCS1 Amb27838781 [0,1,0,1,0,0|0,0,0]=2 14245 B9R1.2 CCC1CC(C)CCN1 Amb27263401 [0,1,0,1,0,0|1,0,1]=4 14246 B9R1.2 CCC1CC(Cl)CCO1 Amb28458111 [0,1,0,1,0,0|1,0,1]=4 14247 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|1,0,1]=4 14248 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|1,0,1]=4 14249 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|0,0,2]=4 14250 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|0,1,1]=4 14251 B9R1.2 CCC1CC=CC(=O)O1 Amb27480728 [0,1,0,1,0,0|1,0,1]=4 14252 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,1,0,1,0,0|0,0,0]=2 14253 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,1,0,1,0,0|1,0,0]=3 14254 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [0,1,0,1,0,0|1,0,0]=3 14255 B9R1.2 CCC1CCCC(C)C1 Amb27267046 [0,1,0,1,0,0|1,0,1]=4 14256 B9R1.2 CCC1CCCC(C)N1 Amb25146110 [0,1,0,1,0,0|1,0,1]=4 14257 B9R1.2 CCC1CCCC(N)=N1 Amb27407342 [0,1,0,1,0,0|2,0,0]=4 14258 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|1,0,1]=4 14259 B9R1.2 CCC1CCCC(O)C1 Amb17593352 [0,1,0,1,0,0|0,0,2]=4 14260 B9R1.2 CCC1CCCC(S)C1 Amb25861249 [0,1,0,1,0,0|0,1,1]=4 14261 B9R1.2 CCC1CCCN(N)C1 Amb25974186 [0,1,0,1,0,0|2,0,0]=4 14262 B9R1.2 CCC1CCN=C(N)C1 Amb25779626 [0,1,0,1,0,0|1,0,0]=3 14263 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [0,1,0,1,0,0|0,0,0]=2 14264 B9R1.2 CCC1CCNC(C)=N1 Amb30021226 [0,1,0,1,0,0|1,0,0]=3 14265 B9R1.2 CCC1CCNC(C)C1 Amb25063477 [0,1,0,1,0,0|1,0,1]=4 14266 B9R1.2 CCC1CCNC(C)O1 Amb33193375 [0,1,0,1,0,0|0,0,2]=4 14267 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [0,1,0,1,0,0|1,0,1]=4 14268 B9R1.2 CCC1CCOC(O)C1 Amb28049146 [0,1,0,1,0,0|0,0,2]=4 14269 B9R1.2 CCC1CN(C)CCN1 Amb18832590 [0,1,0,1,0,0|2,0,0]=4 14270 B9R1.2 CCC1CN(N)CCO1 Amb28345010 [0,1,0,1,0,0|2,0,0]=4 14271 B9R1.2 CCC1CNCC(=O)N1 Amb24427566 [0,1,0,1,0,0|1,0,0]=3 14272 B9R1.2 CCC1CNCC(C)C1 Amb24477764 [0,1,0,1,0,0|1,0,1]=4 14273 B9R1.2 CCC1CNCC(C)N1 Amb26512115 [0,1,0,1,0,0|1,0,1]=4 14274 B9R1.2 CCC1CNCC(C)O1 Amb9028109 [0,1,0,1,0,0|0,0,2]=4 14275 B9R1.2 CCC1CNCC(C)S1 Amb26033062 [0,1,0,1,0,0|0,1,1]=4 14276 B9R1.2 CCC1CNCC(N)C1 Amb33275585 [0,1,0,1,0,0|1,0,1]=4 14277 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|1,0,0]=3 14278 B9R1.2 CCC1COCC(C)N1 Amb18063152 [0,1,0,1,0,0|1,0,1]=4 14279 B9R1.2 CCC1CS(=O)CCN1 Amb27424706 [0,1,0,1,0,0|1,0,0]=3 14280 B9R1.2 CCC1NC(C)CCO1 Amb33194316 [0,1,0,1,0,0|1,0,1]=4 14281 B9R1.2 CCC1NCCC(C)O1 Amb33193306 [0,1,0,1,0,0|0,0,2]=4 14282 B9R1.2 CCC1NCCC(C)S1 Amb27792488 [0,1,0,1,0,0|0,1,1]=4 14283 B9R1.2 CCN1CCCC(=O)C1 Amb23440927 [0,1,0,1,0,0|0,0,0]=2 14284 B9R1.2 CCN1CCCC(=O)C1 Amb9825829 [0,1,0,1,0,0|0,0,0]=2 14285 B9R1.2 CCN1CCCC(Br)C1 Amb25831004 [0,1,0,1,0,0|1,0,1]=4 14286 B9R1.2 CCN1CCCC(Cl)C1 Amb19651964 [0,1,0,1,0,0|1,0,1]=4 14287 B9R1.2 CCN1CCCC(N)C1 Amb1099118 [0,1,0,1,0,0|1,0,1]=4 14288 B9R1.2 CCN1CCCC(N)C1 Amb19374686 [0,1,0,1,0,0|1,0,1]=4 14289 B9R1.2 CCN1CCCC(O)C1 Amb9703152 [0,1,0,1,0,0|0,0,2]=4 14290 B9R1.2 CCN1CCCC(S)C1 Amb25974109 [0,1,0,1,0,0|0,1,1]=4 14291 B9R1.2 CCN1CCC[C@@H](N)C1 Amb24393166 [0,1,0,1,0,0|1,0,1]=4 14292 B9R1.2 CCN1CCC[C@@H](N)C1 Amb32668394 [0,1,0,1,0,0|1,0,1]=4 14293 B9R1.2 CCN1CCC[C@@H](O)C1 Amb27949660 [0,1,0,1,0,0|0,0,2]=4 14294 B9R1.2 CCN1CCC[C@H](C)C1 Amb25887224 [0,1,0,1,0,0|1,0,1]=4 14295 B9R1.2 CCN1CCC[C@H](N)C1 Amb17134811 [0,1,0,1,0,0|1,0,1]=4 14296 B9R1.2 CCN1CCC[C@H](N)C1 Amb33097407 [0,1,0,1,0,0|1,0,1]=4 14297 B9R1.2 CCN1CCC[C@H](O)C1 Amb28049184 [0,1,0,1,0,0|0,0,2]=4 14298 B9R1.2 CCN1CCNC(=O)C1 Amb19516973 [0,1,0,1,0,0|1,0,0]=3 14299 B9R1.2 CCN1CCNC(=O)C1 Amb21961561 [0,1,0,1,0,0|1,0,0]=3 14300 B9R1.2 CC[C@@H]1CC=CC(=O)C1 Amb27828949 [0,1,0,1,0,0|0,0,1]=3 14301 B9R1.2 CC[C@@H]1CCC[C@@H](C)N1 Amb27216626 [0,1,0,1,0,0|1,0,1]=4 14302 B9R1.2 CC[C@@H]1CCC[C@@H](O)C1 Amb28319548 [0,1,0,1,0,0|0,0,2]=4 14303 B9R1.2 CC[C@@H]1CCC[C@H](C)N1 Amb24562231 [0,1,0,1,0,0|1,0,1]=4 14304 B9R1.2 CC[C@@H]1CCC[C@H](O)C1 Amb27491475 [0,1,0,1,0,0|0,0,2]=4 14305 B9R1.2 CC[C@@H]1CNC[C@H](C)N1 Amb28904227 [0,1,0,1,0,0|1,0,1]=4 14306 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|1,0,0]=3 14307 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [0,1,0,1,0,0|0,0,2]=4 14308 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 Amb27248320 [0,1,0,1,0,0|1,0,1]=4 14309 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [0,1,0,1,0,0|0,0,2]=4 14310 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [0,1,0,1,0,0|0,0,2]=4 14311 B9R1.2 CC[C@H]1CC=CC(=O)C1 Amb28461147 [0,1,0,1,0,0|0,0,1]=3 14312 B9R1.2 CC[C@H]1CCCC(=O)N1 Amb28049339 [0,1,0,1,0,0|1,0,0]=3 14313 B9R1.2 CC[C@H]1CCC[C@@H](C)N1 Amb32667683 [0,1,0,1,0,0|1,0,1]=4 14314 B9R1.2 CC[C@H]1CCC[C@H](O)C1 Amb28207111 [0,1,0,1,0,0|0,0,2]=4 14315 B9R1.2 CC[C@H]1COC[C@H](C)N1 Amb27781190 [0,1,0,1,0,0|1,0,1]=4 14316 B9R1.2 CC[C@H]1C[C@H](O)CCS1 Amb27451909 [0,1,0,1,0,0|0,0,2]=4 14317 B9R1.2 CN1CCC=C(C=O)C1 Amb17593300 [0,1,0,1,0,0|1,0,1]=4 14318 B9R1.2 CN1CCCC(C=O)C1 Amb33532140 [0,1,0,1,0,0|1,0,1]=4 14319 B9R1.2 CN1CCCC(CBr)C1 Amb15701567 [0,1,0,1,0,0|2,0,0]=4 14320 B9R1.2 CN1CCCC(CBr)C1 Amb21959789 [0,1,0,1,0,0|2,0,0]=4 14321 B9R1.2 CN1CCCC(CCl)C1 Amb19514801 [0,1,0,1,0,0|2,0,0]=4 14322 B9R1.2 CN1CCCC(CCl)C1 Amb3940536 [0,1,0,1,0,0|2,0,0]=4 14323 B9R1.2 CN1CCCC(CN)C1 Amb1995183 [0,1,0,1,0,0|2,0,0]=4 14324 B9R1.2 CN1CCCC(CO)C1 Amb615876 [0,1,0,1,0,0|2,0,0]=4 14325 B9R1.2 CN1CCCC(CS)C1 Amb32788061 [0,1,0,1,0,0|2,0,0]=4 14326 B9R1.2 CN1CCC[C@@H](CN)C1 Amb22405895 [0,1,0,1,0,0|2,0,0]=4 14327 B9R1.2 CN1CCC[C@@H](CN)C1 Amb26969349 [0,1,0,1,0,0|2,0,0]=4 14328 B9R1.2 CN1CCC[C@@H](CO)C1 Amb10068404 [0,1,0,1,0,0|2,0,0]=4 14329 B9R1.2 CN1CCC[C@H](CN)C1 Amb22405892 [0,1,0,1,0,0|2,0,0]=4 14330 B9R1.2 CN1CCC[C@H](CN)C1 Amb22899759 [0,1,0,1,0,0|2,0,0]=4 14331 B9R1.2 CN1CCC[C@H](CO)C1 Amb10068405 [0,1,0,1,0,0|2,0,0]=4 14332 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [0,1,0,1,0,0|0,0,2]=4 14333 B9R1.2 CNC1CCC=C(C)C1 Amb27752187 [0,1,0,1,0,0|1,0,1]=4 14334 B9R1.2 CNC1CCCC(C)C1 Amb33526835 [0,1,0,1,0,0|1,0,1]=4 14335 B9R1.2 CNC1CCCC(C)C1 Amb6892926 [0,1,0,1,0,0|1,0,1]=4 14336 B9R1.2 CNC1CCCC(Cl)C1 Amb35740080 [0,1,0,1,0,0|1,0,1]=4 14337 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|0,0,2]=4 14338 B9R1.2 CNC1CCCN(C)C1 Amb18947664 [0,1,0,1,0,0|2,0,0]=4 14339 B9R1.2 CNC1CCCN(C)C1 Amb30621905 [0,1,0,1,0,0|2,0,0]=4 14340 B9R1.2 CNC1CCC[C@@H](O)C1 Amb28051135 [0,1,0,1,0,0|0,0,2]=4 14341 B9R1.2 CN[C@@H]1CCCC(C)C1 Amb27947967 [0,1,0,1,0,0|1,0,1]=4 14342 B9R1.2 CN[C@@H]1CCCN(C)C1 Amb22230886 [0,1,0,1,0,0|2,0,0]=4 14343 B9R1.2 CN[C@@H]1CCC[C@@H](O)C1 Amb27463767 [0,1,0,1,0,0|0,0,2]=4 14344 B9R1.2 COC1=CC(=O)CCC1 Amb19930192 [0,1,0,1,0,0|0,0,2]=4 14345 B9R1.2 COC1=CC(O)CCC1 Amb28194168 [0,1,0,1,0,0|2,0,0]=4 14346 B9R1.2 COC1=NC(C)CCC1 Amb27492779 [0,1,0,1,0,0|1,0,0]=3 14347 B9R1.2 COC1=NCCC(C)C1 Amb27976368 [0,1,0,1,0,0|1,0,1]=4 14348 B9R1.2 COC1CC(=O)NCN1 Amb27424652 [0,1,0,1,0,0|2,0,0]=4 14349 B9R1.2 COC1CCCC(=O)C1 Amb20671002 [0,1,0,1,0,0|0,0,0]=2 14350 B9R1.2 COC1CCCC(=O)N1 Amb27594844 [0,1,0,1,0,0|1,0,0]=3 14351 B9R1.2 COC1CCCC(Br)C1 Amb24436237 [0,1,0,1,0,0|1,0,1]=4 14352 B9R1.2 COC1CCCC(C)C1 Amb6608954 [0,1,0,1,0,0|0,0,2]=4 14353 B9R1.2 COC1CCCC(I)C1 Amb33546465 [0,1,0,1,0,0|1,0,1]=4 14354 B9R1.2 COC1CCCC(N)C1 Amb33541880 [0,1,0,1,0,0|1,0,1]=4 14355 B9R1.2 COC1CCCC(O)C1 Amb13951102 [0,1,0,1,0,0|0,0,2]=4 14356 B9R1.2 COC1CCCC(S)C1 Amb27407675 [0,1,0,1,0,0|0,1,1]=4 14357 B9R1.2 COC1CCCN(N)C1 Amb26457196 [0,1,0,1,0,0|2,0,0]=4 14358 B9R1.2 COC1COCC(=O)N1 Amb28043309 [0,1,0,1,0,0|2,0,0]=4 14359 B9R1.2 CO[C@@H]1CCC[C@@H](N)C1 Amb34913074 [0,1,0,1,0,0|1,0,1]=4 14360 B9R1.2 CO[C@@H]1CCC[C@@H](O)C1 Amb27843394 [0,1,0,1,0,0|0,0,2]=4 14361 B9R1.2 CO[C@@H]1CCC[C@H](Br)C1 Amb28076634 [0,1,0,1,0,0|1,0,1]=4 14362 B9R1.2 CO[C@@H]1CCC[C@H](N)C1 Amb25834599 [0,1,0,1,0,0|1,0,1]=4 14363 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 Amb26575107 [0,1,0,1,0,0|0,0,2]=4 14364 B9R1.2 CO[C@H]1CCC[C@@H](N)C1 Amb24539646 [0,1,0,1,0,0|1,0,1]=4 14365 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|0,0,2]=4 14366 B9R1.2 CO[C@H]1CCC[C@H](O)C1 Amb27969202 [0,1,0,1,0,0|0,0,2]=4 14367 B9R1.2 CSC1CCCC(=O)C1 Amb25328147 [0,1,0,1,0,0|0,0,0]=2 14368 B9R1.2 CSC1CCCC(C)C1 Amb28288627 [0,1,0,1,0,0|0,1,1]=4 14369 B9R1.2 CSC1CCCC(N)C1 Amb19335809 [0,1,0,1,0,0|1,0,1]=4 14370 B9R1.2 CSC1CCCC(O)C1 Amb28315413 [0,1,0,1,0,0|0,0,2]=4 14371 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [0,1,0,1,0,0|1,0,1]=4 14372 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [0,1,0,1,0,0|0,0,2]=4 14373 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb32675684 [0,1,0,1,0,0|1,0,1]=4 14374 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb35751635 [0,1,0,1,0,0|1,0,1]=4 14375 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|1,0,1]=4 14376 B9R1.2 C[C@@H]1C[C@@H](C=O)CCO1 Amb27966706 [0,1,0,1,0,0|1,0,1]=4 14377 B9R1.2 C[C@H]1CCC[C@@H](C=O)N1 Amb27866254 [0,1,0,1,0,0|1,0,1]=4 14378 B9R1.2 C[C@H]1CCOC(C=O)C1 Amb26406399 [0,1,0,1,0,0|1,0,1]=4 14379 B9R1.2 C[C@H]1CCO[C@H](C=O)C1 Amb25914480 [0,1,0,1,0,0|1,0,1]=4 14380 B9R1.2 C[C@H]1C[C@@H](C=O)CCO1 Amb27194769 [0,1,0,1,0,0|1,0,1]=4 14381 B9R1.2 C[C@H]1C[C@H](C=O)CCO1 Amb27629806 [0,1,0,1,0,0|1,0,1]=4 14382 B9R1.2 C\C=C1\CCNC(C)C1 Amb35722020 [0,1,0,1,0,0|2,0,0]=4 14383 B9R1.2 C\C=C1\CNCC(C)C1 Amb35719513 [0,1,0,1,0,0|2,0,0]=4 14384 B9R1.2 FC1CCCC(CBr)C1 Amb27879072 [0,1,0,1,0,0|1,0,1]=4 14385 B9R1.2 FC1CCCC(CCl)C1 Amb32943617 [0,1,0,1,0,0|1,0,1]=4 14386 B9R1.2 N#CC1CC(=O)CCN1 Amb18203328 [0,1,0,1,0,0|1,0,1]=4 14387 B9R1.2 N#CC1CCCC(=O)C1 Amb18642100 [0,1,0,1,0,0|0,0,1]=3 14388 B9R1.2 N#CC1CCNC(=O)C1 Amb26984825 [0,1,0,1,0,0|1,0,1]=4 14389 B9R1.2 N#C[C@H]1CCCC(=O)C1 Amb27838628 [0,1,0,1,0,0|0,0,1]=3 14390 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [0,1,0,1,0,0|1,0,1]=4 14391 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,1,0,1,0,0|1,0,0]=3 14392 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,1,0,1,0,0|1,0,0]=3 14393 B9R1.2 NCC1CCCC(=O)N1 Amb33313533 [0,1,0,1,0,0|1,0,0]=3 14394 B9R1.2 NCC1CCCC(Br)C1 Amb26472114 [0,1,0,1,0,0|1,0,1]=4 14395 B9R1.2 NCC1CCCC(Cl)C1 Amb27768829 [0,1,0,1,0,0|1,0,1]=4 14396 B9R1.2 NCC1CCCC(F)C1 Amb26613805 [0,1,0,1,0,0|1,0,1]=4 14397 B9R1.2 NCC1CCCC(F)C1 Amb28555389 [0,1,0,1,0,0|1,0,1]=4 14398 B9R1.2 NCC1CCCC(N)C1 Amb16233731 [0,1,0,1,0,0|1,0,1]=4 14399 B9R1.2 NCC1CCCC(O)C1 Amb9782617 [0,1,0,1,0,0|0,0,2]=4 14400 B9R1.2 NCC1CCCC(S)C1 Amb32788397 [0,1,0,1,0,0|0,1,1]=4 14401 B9R1.2 NCC1CCNC(=O)C1 Amb18832611 [0,1,0,1,0,0|1,0,0]=3 14402 B9R1.2 NCC1CCNC(=O)C1 Amb22405878 [0,1,0,1,0,0|1,0,0]=3 14403 B9R1.2 NCC1CCNC(=O)C1 Amb35747931 [0,1,0,1,0,0|1,0,0]=3 14404 B9R1.2 NCC1CNCC(=O)N1 Amb27793712 [0,1,0,1,0,0|2,0,0]=4 14405 B9R1.2 NCC1CSCC(=O)N1 Amb18251299 [0,1,0,1,0,0|2,0,0]=4 14406 B9R1.2 NC[C@@H]1CCC[C@@H](N)C1 Amb26921446 [0,1,0,1,0,0|1,0,1]=4 14407 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687113 [0,1,0,1,0,0|1,0,0]=3 14408 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687289 [0,1,0,1,0,0|1,0,0]=3 14409 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [0,1,0,1,0,0|1,0,1]=4 14410 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [0,1,0,1,0,0|1,0,1]=4 14411 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [0,1,0,1,0,0|1,0,1]=4 14412 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [0,1,0,1,0,0|1,0,1]=4 14413 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [0,1,0,1,0,0|1,0,1]=4 14414 B9R1.2 O=C1C=C(CCl)CCC1 Amb27882739 [0,1,0,1,0,0|0,0,2]=4 14415 B9R1.2 O=C1C=C(CO)CCC1 Amb27843949 [0,1,0,1,0,0|0,0,2]=4 14416 B9R1.2 O=C1CC(CBr)CCN1 Amb27980511 [0,1,0,1,0,0|1,0,0]=3 14417 B9R1.2 O=C1CC(CCl)CCO1 Amb27482669 [0,1,0,1,0,0|1,0,0]=3 14418 B9R1.2 O=C1CC(CO)CCN1 Amb21960758 [0,1,0,1,0,0|1,0,0]=3 14419 B9R1.2 O=C1CCCC(CBr)C1 Amb28396522 [0,1,0,1,0,0|0,0,0]=2 14420 B9R1.2 O=C1CCCC(CBr)O1 Amb28325542 [0,1,0,1,0,0|1,0,0]=3 14421 B9R1.2 O=C1CCCC(CCl)C1 Amb17593666 [0,1,0,1,0,0|0,0,0]=2 14422 B9R1.2 O=C1CCCC(CCl)N1 Amb19374373 [0,1,0,1,0,0|1,0,0]=3 14423 B9R1.2 O=C1CCCC(CI)N1 Amb28044882 [0,1,0,1,0,0|1,0,0]=3 14424 B9R1.2 O=C1CCCC(CO)C1 Amb16231079 [0,1,0,1,0,0|0,0,0]=2 14425 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [0,1,0,1,0,0|1,0,0]=3 14426 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [0,1,0,1,0,0|1,0,0]=3 14427 B9R1.2 O=C1CCC[C@@H](CO)C1 Amb26479307 [0,1,0,1,0,0|0,0,0]=2 14428 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [0,1,0,1,0,0|1,0,0]=3 14429 B9R1.2 O=C1CCC\C(=N/O)C1 Amb27756076 [0,1,0,1,0,0|1,0,1]=4 14430 B9R1.2 O=C1CNCC(CO)C1 Amb27621654 [0,1,0,1,0,0|1,0,0]=3 14431 B9R1.2 O=C1CNCC(CO)N1 Amb27834544 [0,1,0,1,0,0|2,0,0]=4 14432 B9R1.2 O=C1CNCC(CO)N1 Amb32665951 [0,1,0,1,0,0|2,0,0]=4 14433 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb26994402 [0,1,0,1,0,0|2,0,0]=4 14434 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb30526697 [0,1,0,1,0,0|2,0,0]=4 14435 B9R1.2 O=C1CNC[C@H](CO)N1 Amb27828103 [0,1,0,1,0,0|2,0,0]=4 14436 B9R1.2 O=C1COCC(CO)N1 Amb22236095 [0,1,0,1,0,0|2,0,0]=4 14437 B9R1.2 O=C1CSCC(CO)N1 Amb28388256 [0,1,0,1,0,0|2,0,0]=4 14438 B9R1.2 O=C1C[C@H](CCl)CCO1 Amb27656328 [0,1,0,1,0,0|1,0,0]=3 14439 B9R1.2 O=CC1CCCC(Cl)C1 Amb28456028 [0,1,0,1,0,0|1,0,1]=4 14440 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [0,1,0,1,0,0|1,0,1]=4 14441 B9R1.2 O=CC1CCCS(=O)C1 Amb27767985 [0,1,0,1,0,0|1,0,1]=4 14442 B9R1.2 O=CN1CCCC(=O)C1 Amb27595139 [0,1,0,1,0,0|1,0,1]=4 14443 B9R1.2 O=CN1CCCC(F)C1 Amb29876084 [0,1,0,1,0,0|2,0,0]=4 14444 B9R1.2 O=CN1CCCC(O)C1 Amb27401500 [0,1,0,1,0,0|2,0,0]=4 14445 B9R1.2 O=NN1CCCC(Cl)C1 Amb26865282 [0,1,0,1,0,0|2,0,0]=4 14446 B9R1.2 O=NN1CCCC(O)C1 Amb25829015 [0,1,0,1,0,0|2,0,0]=4 14447 B9R1.2 OC1CCCC(CBr)C1 Amb26885621 [0,1,0,1,0,0|0,0,2]=4 14448 B9R1.2 OC1CCCC(CCl)C1 Amb25342173 [0,1,0,1,0,0|0,0,2]=4 14449 B9R1.2 OCC1=CC(O)CCC1 Amb28315569 [0,1,0,1,0,0|2,0,0]=4 14450 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|1,0,1]=4 14451 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [0,1,0,1,0,0|0,0,2]=4 14452 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [0,1,0,1,0,0|0,0,2]=4 14453 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [0,1,0,1,0,0|0,0,2]=4 14454 B9R1.2 O\N=C1/CCCC(Cl)C1 Amb27245794 [0,1,0,1,0,0|1,0,1]=4 14455 B9R1.2 [N-]=[N+]=C1CCCC(=O)C1 Amb17593275 [0,1,0,1,0,0|1,0,1]=4 14456 B9R1.3 C=C1C(=O)CCC[C@@H]1C Amb27838735 [0,1,0,1,0,0|0,0,1]=3 14457 B9R1.3 C=C1CCCC(C)C1C Amb27262099 [0,1,0,1,0,0|1,0,0]=3 14458 B9R1.3 C=C1CCCC(C)C1O Amb27207403 [0,1,0,1,0,0|1,0,0]=3 14459 B9R1.3 C=C1CCCN(C)C1=O Amb522206 [0,1,0,1,0,0|1,0,1]=4 14460 B9R1.3 C=C1[C@@H](C)CCC[C@H]1C Amb22230413 [0,1,0,1,0,0|1,0,1]=4 14461 B9R1.3 C=C1[C@H](C)CCC[C@H]1C Amb24499561 [0,1,0,1,0,0|1,0,1]=4 14462 B9R1.3 CC1=C(Br)C(O)CCC1 Amb25811521 [0,1,0,1,0,0|2,0,0]=4 14463 B9R1.3 CC1=C(Br)[C@H](O)CCC1 Amb27772139 [0,1,0,1,0,0|2,0,0]=4 14464 B9R1.3 CC1=C(C)C(=O)CCC1 Amb17593288 [0,1,0,1,0,0|0,0,1]=3 14465 B9R1.3 CC1=C(C)C(=O)NCC1 Amb26025701 [0,1,0,1,0,0|1,0,1]=4 14466 B9R1.3 CC1=C(C)C(Br)CCC1 Amb27862157 [0,1,0,1,0,0|2,0,0]=4 14467 B9R1.3 CC1=C(C)C(O)CCC1 Amb27450753 [0,1,0,1,0,0|2,0,0]=4 14468 B9R1.3 CC1=C(C)[C@H](O)CCC1 Amb27399340 [0,1,0,1,0,0|2,0,0]=4 14469 B9R1.3 CC1=C(Cl)CCCC1=O Amb4036614 [0,1,0,1,0,0|1,0,1]=4 14470 B9R1.3 CC1=C(Cl)CCCC1O Amb10552852 [0,1,0,1,0,0|2,0,0]=4 14471 B9R1.3 CC1=C(N)CCCC1=O Amb27798039 [0,1,0,1,0,0|1,0,1]=4 14472 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [0,1,0,1,0,0|1,0,1]=4 14473 B9R1.3 CC1=CCCC(C)C1=O Amb17593286 [0,1,0,1,0,0|0,0,1]=3 14474 B9R1.3 CC1=CCC[C@@H](C)C1Br Amb27407012 [0,1,0,1,0,0|1,0,1]=4 14475 B9R1.3 CC1=COCC(C)C1=O Amb24545605 [0,1,0,1,0,0|1,0,1]=4 14476 B9R1.3 CC1C(=O)CCCC1=O Amb3993683 [0,1,0,1,0,0|1,0,1]=4 14477 B9R1.3 CC1C(=O)CCCN1C Amb28253362 [0,1,0,1,0,0|1,0,0]=3 14478 B9R1.3 CC1C(=O)CCC[C@H]1C Amb27951545 [0,1,0,1,0,0|0,0,0]=2 14479 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,1,0,1,0,0|2,0,0]=4 14480 B9R1.3 CC1C(=O)NCCN1C Amb19723393 [0,1,0,1,0,0|2,0,0]=4 14481 B9R1.3 CC1C=CCC(=O)C1C Amb28245024 [0,1,0,1,0,0|0,0,2]=4 14482 B9R1.3 CC1CC=CC(=O)C1C Amb27838646 [0,1,0,1,0,0|0,0,2]=4 14483 B9R1.3 CC1CCCC(=O)C1Br Amb24355950 [0,1,0,1,0,0|0,0,0]=2 14484 B9R1.3 CC1CCCC(=O)C1C Amb27593439 [0,1,0,1,0,0|0,0,0]=2 14485 B9R1.3 CC1CCCC(=O)C1F Amb28381160 [0,1,0,1,0,0|0,0,0]=2 14486 B9R1.3 CC1CCCC(=O)C1O Amb27838796 [0,1,0,1,0,0|0,0,0]=2 14487 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|1,0,1]=4 14488 B9R1.3 CC1CCCC(C)C1=O Amb9702826 [0,1,0,1,0,0|0,0,1]=3 14489 B9R1.3 CC1CCCC(C)C1Br Amb8835441 [0,1,0,1,0,0|1,0,1]=4 14490 B9R1.3 CC1CCCC(C)C1C Amb22227691 [0,1,0,1,0,0|1,0,1]=4 14491 B9R1.3 CC1CCCC(C)C1N Amb6892747 [0,1,0,1,0,0|1,0,1]=4 14492 B9R1.3 CC1CCCC(C)C1N Amb9705390 [0,1,0,1,0,0|1,0,1]=4 14493 B9R1.3 CC1CCCC(C)C1O Amb2227580 [0,1,0,1,0,0|0,0,2]=4 14494 B9R1.3 CC1CCCC(C)C1S Amb9208048 [0,1,0,1,0,0|0,1,1]=4 14495 B9R1.3 CC1CCCC(C)N1N Amb9703083 [0,1,0,1,0,0|1,0,1]=4 14496 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|1,0,1]=4 14497 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [0,1,0,1,0,0|1,0,1]=4 14498 B9R1.3 CC1CCCC(F)C1N Amb24650619 [0,1,0,1,0,0|1,0,1]=4 14499 B9R1.3 CC1CCCC(N)C1C Amb3939985 [0,1,0,1,0,0|1,0,1]=4 14500 B9R1.3 CC1CCCC(O)C1C Amb9825841 [0,1,0,1,0,0|0,0,2]=4 14501 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|0,1,1]=4 14502 B9R1.3 CC1CCC[C@@H](C)C1=O Amb27262957 [0,1,0,1,0,0|0,0,1]=3 14503 B9R1.3 CC1CCC[C@@H](O)[C@@H]1N Amb27636307 [0,1,0,1,0,0|0,0,2]=4 14504 B9R1.3 CC1CCC[C@@H](O)[C@@H]1O Amb28318183 [0,1,0,1,0,0|0,0,2]=4 14505 B9R1.3 CC1CCC[C@H](Cl)C1=O Amb28388615 [0,1,0,1,0,0|1,0,1]=4 14506 B9R1.3 CC1CCC[C@H](O)[C@@H]1O Amb27844355 [0,1,0,1,0,0|0,0,2]=4 14507 B9R1.3 CC1CCNC(=O)C1Br Amb27658951 [0,1,0,1,0,0|1,0,0]=3 14508 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|1,0,0]=3 14509 B9R1.3 CC1CNCC(=O)N1C Amb25840155 [0,1,0,1,0,0|1,0,0]=3 14510 B9R1.3 CC1CNCC(=O)N1C Amb33527005 [0,1,0,1,0,0|1,0,0]=3 14511 B9R1.3 CC1CNCC(C)C1=O Amb24351098 [0,1,0,1,0,0|1,0,1]=4 14512 B9R1.3 CC1CNCC(C)C1=O Amb32666719 [0,1,0,1,0,0|1,0,1]=4 14513 B9R1.3 CC1CNCC(C)S1=O Amb27185798 [0,1,0,1,0,0|1,0,1]=4 14514 B9R1.3 CC1CNCC(C)S1=O Amb28555358 [0,1,0,1,0,0|1,0,1]=4 14515 B9R1.3 CC1COCC(C)C1=O Amb22299425 [0,1,0,1,0,0|1,0,1]=4 14516 B9R1.3 CC1CSCC(C)C1=O Amb28321902 [0,1,0,1,0,0|1,0,1]=4 14517 B9R1.3 CC1NCCC(=O)C1C Amb18642528 [0,1,0,1,0,0|1,0,0]=3 14518 B9R1.3 CC1NCCN(C)C1=O Amb10607449 [0,1,0,1,0,0|2,0,0]=4 14519 B9R1.3 CC1NCCN(C)C1=O Amb22499042 [0,1,0,1,0,0|2,0,0]=4 14520 B9R1.3 CC1NCCS(=O)C1C Amb19514961 [0,1,0,1,0,0|2,0,0]=4 14521 B9R1.3 CC1NCCS(=O)C1C Amb33379115 [0,1,0,1,0,0|2,0,0]=4 14522 B9R1.3 CC1NCNC(=O)C1Cl Amb27264908 [0,1,0,1,0,0|2,0,0]=4 14523 B9R1.3 CC1OCCC(=O)C1C Amb33715158 [0,1,0,1,0,0|1,0,0]=3 14524 B9R1.3 CC1[C@H](C)CCC[C@H]1C Amb27493255 [0,1,0,1,0,0|1,0,1]=4 14525 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [0,1,0,1,0,0|1,0,1]=4 14526 B9R1.3 CN1C(=O)CCCC1N Amb28285249 [0,1,0,1,0,0|1,0,0]=3 14527 B9R1.3 CN1CCCC(=O)C1=O Amb33547367 [0,1,0,1,0,0|1,0,1]=4 14528 B9R1.3 CN1CCCC(Br)C1=O Amb25924539 [0,1,0,1,0,0|2,0,0]=4 14529 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [0,1,0,1,0,0|2,0,0]=4 14530 B9R1.3 CN1CCCC(N)C1=O Amb33536522 [0,1,0,1,0,0|2,0,0]=4 14531 B9R1.3 CN1CCCC(O)C1=O Amb17593360 [0,1,0,1,0,0|2,0,0]=4 14532 B9R1.3 CN1CCCN(C)C1=O Amb24054545 [0,1,0,1,0,0|2,0,0]=4 14533 B9R1.3 CN1CCCN(C)C1=O Amb32674663 [0,1,0,1,0,0|2,0,0]=4 14534 B9R1.3 CN1CCCN(C)C1=O Amb8514675 [0,1,0,1,0,0|2,0,0]=4 14535 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [0,1,0,1,0,0|2,0,0]=4 14536 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [0,1,0,1,0,0|2,0,0]=4 14537 B9R1.3 CN1CCC[C@@H](O)C1=O Amb27250591 [0,1,0,1,0,0|2,0,0]=4 14538 B9R1.3 CN1CCC[C@H](N)C1=O Amb26503808 [0,1,0,1,0,0|2,0,0]=4 14539 B9R1.3 CN1CCC[C@H](N)C1=O Amb33801269 [0,1,0,1,0,0|2,0,0]=4 14540 B9R1.3 C[C@@H]1C(=O)C=CC[C@H]1C Amb28054028 [0,1,0,1,0,0|0,0,2]=4 14541 B9R1.3 C[C@@H]1C(=O)CCC[C@@H]1N Amb27818101 [0,1,0,1,0,0|1,0,0]=3 14542 B9R1.3 C[C@@H]1C(O)CCC[C@H]1C Amb27451971 [0,1,0,1,0,0|0,0,2]=4 14543 B9R1.3 C[C@@H]1CCCC(=O)C1F Amb27802756 [0,1,0,1,0,0|0,0,0]=2 14544 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1F Amb28324355 [0,1,0,1,0,0|0,0,0]=2 14545 B9R1.3 C[C@@H]1CCCC(O)[C@@H]1C Amb27664284 [0,1,0,1,0,0|0,0,2]=4 14546 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1C Amb27876256 [0,1,0,1,0,0|0,0,2]=4 14547 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1O Amb28320895 [0,1,0,1,0,0|0,0,2]=4 14548 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1C Amb28055489 [0,1,0,1,0,0|1,0,1]=4 14549 B9R1.3 C[C@@H]1CCC[C@H](O)C1O Amb27198139 [0,1,0,1,0,0|0,0,2]=4 14550 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,1,0,1,0,0|1,0,0]=3 14551 B9R1.3 C[C@@H]1CNCC(=O)N1C Amb23385273 [0,1,0,1,0,0|1,0,0]=3 14552 B9R1.3 C[C@@H]1CNCC(=O)N1C Amb27838533 [0,1,0,1,0,0|1,0,0]=3 14553 B9R1.3 C[C@@H]1CNC[C@@H](C)C1=O Amb32666988 [0,1,0,1,0,0|1,0,1]=4 14554 B9R1.3 C[C@@H]1CNC[C@@H](C)C1=O Amb32666990 [0,1,0,1,0,0|1,0,1]=4 14555 B9R1.3 C[C@@H]1NCCC(=O)[C@H]1C Amb27967343 [0,1,0,1,0,0|1,0,0]=3 14556 B9R1.3 C[C@@H]1NCCN(C)C1=O Amb26991383 [0,1,0,1,0,0|2,0,0]=4 14557 B9R1.3 C[C@@H]1NCCN(C)C1=O Amb33716075 [0,1,0,1,0,0|2,0,0]=4 14558 B9R1.3 C[C@H]1C=CCC(=O)[C@H]1C Amb27441703 [0,1,0,1,0,0|0,0,2]=4 14559 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1C Amb27441720 [0,1,0,1,0,0|0,0,2]=4 14560 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1C Amb27432624 [0,1,0,1,0,0|0,0,0]=2 14561 B9R1.3 C[C@H]1CCC[C@@H](Br)C1=O Amb28132271 [0,1,0,1,0,0|1,0,1]=4 14562 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1C Amb25245256 [0,1,0,1,0,0|1,0,1]=4 14563 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1O Amb28350332 [0,1,0,1,0,0|0,0,2]=4 14564 B9R1.3 C[C@H]1CCC[C@@H](F)[C@@H]1N Amb27778713 [0,1,0,1,0,0|1,0,1]=4 14565 B9R1.3 C[C@H]1CCC[C@@H](N)[C@@H]1O Amb28252463 [0,1,0,1,0,0|1,0,1]=4 14566 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1C Amb27253637 [0,1,0,1,0,0|1,0,1]=4 14567 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1N Amb27215993 [0,1,0,1,0,0|1,0,1]=4 14568 B9R1.3 C[C@H]1CCC[C@@H](O)[C@@H]1O Amb27186925 [0,1,0,1,0,0|0,0,2]=4 14569 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1C Amb27980719 [0,1,0,1,0,0|0,0,2]=4 14570 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1O Amb27647956 [0,1,0,1,0,0|0,0,2]=4 14571 B9R1.3 C[C@H]1CCC[C@H](C)C1N Amb27860934 [0,1,0,1,0,0|1,0,1]=4 14572 B9R1.3 C[C@H]1CCC[C@H](C)C1O Amb27196772 [0,1,0,1,0,0|0,0,2]=4 14573 B9R1.3 C[C@H]1CCC[C@H](F)C1=O Amb28202070 [0,1,0,1,0,0|1,0,1]=4 14574 B9R1.3 C[C@H]1CCC[C@H](O)[C@@H]1O Amb27844257 [0,1,0,1,0,0|0,0,2]=4 14575 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,1,0,1,0,0|1,0,0]=3 14576 B9R1.3 C[C@H]1CNCC(=O)N1C Amb23385254 [0,1,0,1,0,0|1,0,0]=3 14577 B9R1.3 C[C@H]1CNC[C@@H](C)C1=O Amb27784954 [0,1,0,1,0,0|1,0,1]=4 14578 B9R1.3 C[C@H]1NCCN(C)C1=O Amb26503872 [0,1,0,1,0,0|2,0,0]=4 14579 B9R1.3 C[C@H]1NCCN(C)C1=O Amb28993779 [0,1,0,1,0,0|2,0,0]=4 14580 B9R1.3 C[C@H]1[C@H](C)CCC[C@H]1N Amb28055501 [0,1,0,1,0,0|1,0,1]=4 14581 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [0,1,0,1,0,0|1,0,1]=4 14582 B9R1.3 O=C1CCCC(=O)C1Br Amb33527290 [0,1,0,1,0,0|1,0,1]=4 14583 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [0,1,0,1,0,0|1,0,1]=4 14584 B9R1.3 O=C1CCCC(Br)C1=O Amb27866033 [0,1,0,1,0,0|1,0,1]=4 14585 B9R1.3 O=C1CCCC(Br)C1O Amb27858762 [0,1,0,1,0,0|1,0,0]=3 14586 B9R1.3 O=C1CCCC(Cl)C1Br Amb26624735 [0,1,0,1,0,0|1,0,0]=3 14587 B9R1.3 O=C1CCCC(F)C1Br Amb25840986 [0,1,0,1,0,0|1,0,0]=3 14588 B9R1.3 O=C1CCC[C@H](Br)[C@@H]1O Amb27974655 [0,1,0,1,0,0|1,0,0]=3 14589 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,1,0,1,0,0|2,0,0]=4 14590 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,1,0,1,0,0|2,0,0]=4 14591 B9R1.5 BrC1CCCCCC1Br Amb17669998 [0,1,0,1,0,0|1,0,1]=4 14592 B9R1.5 Br[C@@H]1CCCCC[C@H]1Br Amb25952818 [0,1,0,1,0,0|1,0,1]=4 14593 B9R1.5 Br[C@H]1CCCCC[C@H]1Br Amb24425642 [0,1,0,1,0,0|1,0,1]=4 14594 B9R1.5 C=C1CCCCCC1C Amb35681188 [0,1,0,1,0,0|1,0,0]=3 14595 B9R1.5 C=C1CCCCC[C@@H]1O Amb27456695 [0,1,0,1,0,0|1,0,0]=3 14596 B9R1.5 CC1=CCCCCC1O Amb27184844 [0,1,0,1,0,0|1,0,0]=3 14597 B9R1.5 CC1C=CCCCC1=O Amb27600759 [0,1,0,1,0,0|0,0,2]=4 14598 B9R1.5 CC1CCCC=CC1=O Amb27838624 [0,1,0,1,0,0|0,0,2]=4 14599 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,1,0,1,0,0|0,0,0]=2 14600 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|1,0,1]=4 14601 B9R1.5 CC1CCCCCC1Cl Amb27164800 [0,1,0,1,0,0|1,0,1]=4 14602 B9R1.5 CC1CCCCCC1N Amb33539533 [0,1,0,1,0,0|1,0,1]=4 14603 B9R1.5 CC1CCCCCC1O Amb27243169 [0,1,0,1,0,0|0,0,2]=4 14604 B9R1.5 CC1CCCCCC1S Amb32788094 [0,1,0,1,0,0|0,1,1]=4 14605 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,1,0,0|1,0,0]=3 14606 B9R1.5 CC1CCNCCS1=O Amb25948110 [0,1,0,1,0,0|1,0,1]=4 14607 B9R1.5 CC1CCNCCS1=O Amb28555359 [0,1,0,1,0,0|1,0,1]=4 14608 B9R1.5 CC1CNCCNC1=O Amb27228560 [0,1,0,1,0,0|2,0,0]=4 14609 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,1,0,1,0,0|2,0,0]=4 14610 B9R1.5 CC1SCCCCC1=O Amb28048147 [0,1,0,1,0,0|1,0,0]=3 14611 B9R1.5 CN1CCCCCC1=O Amb2779825 [0,1,0,1,0,0|0,0,0]=2 14612 B9R1.5 CN1CCCCNC1=S Amb28346274 [0,1,0,1,0,0|1,1,0]=4 14613 B9R1.5 CN1CCCNCC1=O Amb15690772 [0,1,0,1,0,0|1,0,0]=3 14614 B9R1.5 CN1CCCNCC1=O Amb21960817 [0,1,0,1,0,0|1,0,0]=3 14615 B9R1.5 CN1CCNCCC1=O Amb16231373 [0,1,0,1,0,0|1,0,0]=3 14616 B9R1.5 CN1CCNCCC1=O Amb21959037 [0,1,0,1,0,0|1,0,0]=3 14617 B9R1.5 CN1CCNCCC1=O Amb28934999 [0,1,0,1,0,0|1,0,0]=3 14618 B9R1.5 C[C@@H]1CCCCC[C@@H]1N Amb28346949 [0,1,0,1,0,0|1,0,1]=4 14619 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [0,1,0,1,0,0|0,0,2]=4 14620 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,1,0,1,0,0|1,0,0]=3 14621 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,1,0,1,0,0|2,0,0]=4 14622 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [0,1,0,1,0,0|0,0,2]=4 14623 B9R1.5 C[C@H]1CCCCC[C@H]1Br Amb28428934 [0,1,0,1,0,0|1,0,1]=4 14624 B9R1.5 C[C@H]1CCCCC[C@H]1N Amb28388330 [0,1,0,1,0,0|1,0,1]=4 14625 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [0,1,0,1,0,0|0,0,2]=4 14626 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,1,0,1,0,0|2,0,0]=4 14627 B9R1.5 ClC1CCCCCC1Cl Amb17669999 [0,1,0,1,0,0|1,0,1]=4 14628 B9R1.5 Cl[C@@H]1CCCCC[C@H]1Br Amb28287349 [0,1,0,1,0,0|1,0,1]=4 14629 B9R1.5 NC1CCCCC=C1Br Amb27747172 [0,1,0,1,0,0|1,0,1]=4 14630 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,1,0,1,0,0|0,0,0]=2 14631 B9R1.5 NC1CCCCCC1=O Amb28934932 [0,1,0,1,0,0|0,0,0]=2 14632 B9R1.5 NC1CCCCCC1Cl Amb27447248 [0,1,0,1,0,0|1,0,1]=4 14633 B9R1.5 NC1CCCCCC1F Amb27838500 [0,1,0,1,0,0|1,0,1]=4 14634 B9R1.5 NC1CCCCCC1F Amb35788792 [0,1,0,1,0,0|1,0,1]=4 14635 B9R1.5 NC1CCCCCC1N Amb18832604 [0,1,0,1,0,0|1,0,1]=4 14636 B9R1.5 NC1CCCCCC1N Amb32666380 [0,1,0,1,0,0|1,0,1]=4 14637 B9R1.5 NC1CCCCCC1O Amb8855257 [0,1,0,1,0,0|0,0,2]=4 14638 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,1,0,1,0,0|1,0,0]=3 14639 B9R1.5 NC1CCCCNC1=O Amb9721937 [0,1,0,1,0,0|1,0,0]=3 14640 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,1,0,1,0,0|2,0,0]=4 14641 B9R1.5 NC1CSCCNC1=O Amb32412582 [0,1,0,1,0,0|2,0,0]=4 14642 B9R1.5 NN1CCCCCC1=O Amb22495331 [0,1,0,1,0,0|1,0,0]=3 14643 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|0,0,2]=4 14644 B9R1.5 N[C@@H]1CCCCC[C@H]1Br Amb28057796 [0,1,0,1,0,0|1,0,1]=4 14645 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb24546493 [0,1,0,1,0,0|1,0,1]=4 14646 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb32656071 [0,1,0,1,0,0|1,0,1]=4 14647 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|0,0,2]=4 14648 B9R1.5 N[C@@H]1CCCCC[C@H]1S Amb27246750 [0,1,0,1,0,0|0,1,1]=4 14649 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [0,1,0,1,0,0|1,0,0]=3 14650 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,1,0,1,0,0|1,0,0]=3 14651 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,1,0,1,0,0|2,0,0]=4 14652 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [0,1,0,1,0,0|2,0,0]=4 14653 B9R1.5 N[C@H]1CCCCC[C@@H]1N Amb25790654 [0,1,0,1,0,0|1,0,1]=4 14654 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [0,1,0,1,0,0|0,0,2]=4 14655 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb24659857 [0,1,0,1,0,0|1,0,1]=4 14656 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb30585192 [0,1,0,1,0,0|1,0,1]=4 14657 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,1,0,1,0,0|1,0,0]=3 14658 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [0,1,0,1,0,0|1,0,0]=3 14659 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [0,1,0,1,0,0|2,0,0]=4 14660 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [0,1,0,1,0,0|2,0,0]=4 14661 B9R1.5 O=C1C=CCCCC1O Amb27838742 [0,1,0,1,0,0|0,0,2]=4 14662 B9R1.5 O=C1CCCCC=C1Br Amb27482990 [0,1,0,1,0,0|0,0,2]=4 14663 B9R1.5 O=C1CCCCC=C1F Amb27835100 [0,1,0,1,0,0|0,0,2]=4 14664 B9R1.5 O=C1CCCCCC1=O Amb17593310 [0,1,0,1,0,0|0,0,1]=3 14665 B9R1.5 O=C1CCCCCC1Br Amb18325296 [0,1,0,1,0,0|0,0,0]=2 14666 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [0,1,0,1,0,0|0,0,0]=2 14667 B9R1.5 O=C1CCCCCC1F Amb21965071 [0,1,0,1,0,0|0,0,0]=2 14668 B9R1.5 O=C1CCCCCC1O Amb25284997 [0,1,0,1,0,0|0,0,0]=2 14669 B9R1.5 O=C1CCCCCC1S Amb28199868 [0,1,0,1,0,0|0,0,0]=2 14670 B9R1.5 O=C1CCCCCN1Br Amb9786551 [0,1,0,1,0,0|1,0,0]=3 14671 B9R1.5 O=C1CCCCCN1Cl Amb10572732 [0,1,0,1,0,0|1,0,0]=3 14672 B9R1.5 O=C1CCCCOC1=O Amb27227093 [0,1,0,1,0,0|1,0,1]=4 14673 B9R1.5 O=C1CCCNCC1F Amb22886244 [0,1,0,1,0,0|1,0,0]=3 14674 B9R1.5 O=C1CCNCCC1=O Amb32415899 [0,1,0,1,0,0|1,0,1]=4 14675 B9R1.5 O=C1CCNCCC1Br Amb27201712 [0,1,0,1,0,0|1,0,0]=3 14676 B9R1.5 O=C1CCNCCC1Br Amb33621267 [0,1,0,1,0,0|1,0,0]=3 14677 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,1,0,1,0,0|1,0,0]=3 14678 B9R1.5 O=C1CCOCCC1=O Amb32642050 [0,1,0,1,0,0|1,0,1]=4 14679 B9R1.5 O=C1CCSCCC1=O Amb32642055 [0,1,0,1,0,0|1,0,1]=4 14680 B9R1.5 O=C1CNCCCC1F Amb22886238 [0,1,0,1,0,0|1,0,0]=3 14681 B9R1.5 O=C1NCCCCC1Br Amb9781677 [0,1,0,1,0,0|1,0,0]=3 14682 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [0,1,0,1,0,0|1,0,0]=3 14683 B9R1.5 O=C1NCCCCC1I Amb35751097 [0,1,0,1,0,0|1,0,0]=3 14684 B9R1.5 OC1CCCCC=C1Br Amb27604372 [0,1,0,1,0,0|1,0,1]=4 14685 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [0,1,0,1,0,0|1,0,1]=4 14686 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|0,0,2]=4 14687 B9R1.5 OC1CCCCCC1Cl Amb27974196 [0,1,0,1,0,0|0,0,2]=4 14688 B9R1.5 OC1CCCCCC1I Amb27640772 [0,1,0,1,0,0|0,0,2]=4 14689 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|0,0,2]=4 14690 B9R1.5 O[C@@H]1CCCCC[C@H]1F Amb27853128 [0,1,0,1,0,0|0,0,2]=4 14691 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|0,0,2]=4 14692 B9R1.5 O[C@H]1CCCCC[C@@H]1Cl Amb27440550 [0,1,0,1,0,0|0,0,2]=4 14693 B9R1.5 O[C@H]1CCCCC[C@@H]1F Amb28344995 [0,1,0,1,0,0|0,0,2]=4 14694 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|0,0,2]=4 14695 B9R1.5 O[C@H]1CCCCC[C@H]1Br Amb28051852 [0,1,0,1,0,0|0,0,2]=4 14696 B9R1.5 O[C@H]1CCCCC[C@H]1Cl Amb27657604 [0,1,0,1,0,0|0,0,2]=4 14697 B9R1.11 C#CC(=O)C1CCCC1 Amb22498876 [0,1,0,1,0,0|0,0,1]=3 14698 B9R1.11 C#CC(=O)C1CCCN1 Amb26983722 [0,1,0,1,0,0|1,0,1]=4 14699 B9R1.11 C#CC(=O)C1CCCS1 Amb28345587 [0,1,0,1,0,0|1,0,1]=4 14700 B9R1.11 C#CC(=O)C1CCNC1 Amb25889703 [0,1,0,1,0,0|1,0,1]=4 14701 B9R1.11 C#CC(=O)N1CCCC1 Amb24532877 [0,1,0,1,0,0|1,0,1]=4 14702 B9R1.11 C#CC(=O)[C@@H]1CCCN1 Amb33132129 [0,1,0,1,0,0|1,0,1]=4 14703 B9R1.11 C#CC(=O)[C@@H]1CCNC1 Amb30039103 [0,1,0,1,0,0|1,0,1]=4 14704 B9R1.11 C#CC(=O)[C@H]1CCCN1 Amb30038901 [0,1,0,1,0,0|1,0,1]=4 14705 B9R1.11 C#CC(=O)[C@H]1CCNC1 Amb33132072 [0,1,0,1,0,0|1,0,1]=4 14706 B9R1.11 C#CC(C)C1CCCC1 Amb33169161 [0,1,0,1,0,0|1,0,1]=4 14707 B9R1.11 C=C(C#N)C1CCCC1 Amb25943313 [0,1,0,1,0,0|1,0,1]=4 14708 B9R1.11 C=C(CBr)C1CCCC1 Amb33477077 [0,1,0,1,0,0|1,0,0]=3 14709 B9R1.11 C=C(CBr)C1CCCO1 Amb33388747 [0,1,0,1,0,0|2,0,0]=4 14710 B9R1.11 C=C(CBr)C1CCCS1 Amb33433096 [0,1,0,1,0,0|2,0,0]=4 14711 B9R1.11 C=C(CBr)C1CCOC1 Amb33332488 [0,1,0,1,0,0|2,0,0]=4 14712 B9R1.11 C=C(CBr)C1CCSC1 Amb33435937 [0,1,0,1,0,0|2,0,0]=4 14713 B9R1.11 C=C(CC)C1CCCC1 Amb27452572 [0,1,0,1,0,0|1,0,0]=3 14714 B9R1.11 C=C(CC)C1CCCN1 Amb23536671 [0,1,0,1,0,0|2,0,0]=4 14715 B9R1.11 C=C(CC)C1CCNC1 Amb27789654 [0,1,0,1,0,0|2,0,0]=4 14716 B9R1.11 C=C(CC)C1CCOC1 Amb28410630 [0,1,0,1,0,0|2,0,0]=4 14717 B9R1.11 C=C(CCl)C1CCCC1 Amb33220531 [0,1,0,1,0,0|1,0,0]=3 14718 B9R1.11 C=C(CCl)C1CCCO1 Amb33261558 [0,1,0,1,0,0|2,0,0]=4 14719 B9R1.11 C=C(CCl)C1CCOC1 Amb33058516 [0,1,0,1,0,0|2,0,0]=4 14720 B9R1.11 C=C(CCl)C1CCSC1 Amb33056752 [0,1,0,1,0,0|2,0,0]=4 14721 B9R1.11 C=C(CN)C1CCCC1 Amb33315746 [0,1,0,1,0,0|1,0,0]=3 14722 B9R1.11 C=C(CN)C1CCCO1 Amb33318652 [0,1,0,1,0,0|2,0,0]=4 14723 B9R1.11 C=C(CN)C1CCCS1 Amb33415557 [0,1,0,1,0,0|2,0,0]=4 14724 B9R1.11 C=C(CN)C1CCOC1 Amb33420703 [0,1,0,1,0,0|2,0,0]=4 14725 B9R1.11 C=C(CN)C1CCSC1 Amb33345709 [0,1,0,1,0,0|2,0,0]=4 14726 B9R1.11 C=C(CO)C1CCCC1 Amb27751861 [0,1,0,1,0,0|1,0,0]=3 14727 B9R1.11 C=C(CO)[C@@H]1CCCN1 Amb27473829 [0,1,0,1,0,0|2,0,0]=4 14728 B9R1.11 C=C(SC)N1CCCC1 Amb27872588 [0,1,0,1,0,0|2,0,0]=4 14729 B9R1.11 C=CC(=O)C1CCCC1 Amb25180831 [0,1,0,1,0,0|0,0,1]=3 14730 B9R1.11 C=CC(=O)C1CCCN1 Amb24376988 [0,1,0,1,0,0|1,0,1]=4 14731 B9R1.11 C=CC(=O)C1CCCO1 Amb25139821 [0,1,0,1,0,0|1,0,1]=4 14732 B9R1.11 C=CC(=O)C1CCCS1 Amb24462018 [0,1,0,1,0,0|1,0,1]=4 14733 B9R1.11 C=CC(=O)C1CCNC1 Amb25359839 [0,1,0,1,0,0|1,0,1]=4 14734 B9R1.11 C=CC(=O)C1CCOC1 Amb24478661 [0,1,0,1,0,0|1,0,1]=4 14735 B9R1.11 C=CC(=O)C1CCSC1 Amb24393990 [0,1,0,1,0,0|1,0,1]=4 14736 B9R1.11 C=CC(=O)N1CCCC1 Amb9480389 [0,1,0,1,0,0|1,0,1]=4 14737 B9R1.11 C=CC(=O)[C@@H]1CCCN1 Amb33132130 [0,1,0,1,0,0|1,0,1]=4 14738 B9R1.11 C=CC(=O)[C@@H]1CCNC1 Amb30039109 [0,1,0,1,0,0|1,0,1]=4 14739 B9R1.11 C=CC(=O)[C@H]1CCCN1 Amb33132116 [0,1,0,1,0,0|1,0,1]=4 14740 B9R1.11 C=CC(=O)[C@H]1CCNC1 Amb33132073 [0,1,0,1,0,0|1,0,1]=4 14741 B9R1.11 CC(C#N)=C1CCCC1 Amb18642035 [0,1,0,1,0,0|1,0,1]=4 14742 B9R1.11 CC(C#N)C1CCCC1 Amb25714069 [0,1,0,1,0,0|1,0,1]=4 14743 B9R1.11 CC(C=O)C1CCCC1 Amb20668888 [0,1,0,1,0,0|0,0,1]=3 14744 B9R1.11 CC(C=O)C1CCCO1 Amb18642610 [0,1,0,1,0,0|1,0,1]=4 14745 B9R1.11 CC(C=O)C1CCCS1 Amb33415663 [0,1,0,1,0,0|1,0,1]=4 14746 B9R1.11 CC(C=O)C1CCOC1 Amb24429348 [0,1,0,1,0,0|1,0,1]=4 14747 B9R1.11 CC(C=O)C1CCSC1 Amb27637383 [0,1,0,1,0,0|1,0,1]=4 14748 B9R1.11 CC(CBr)C1CCCC1 Amb24478814 [0,1,0,1,0,0|1,0,1]=4 14749 B9R1.11 CC(CCl)C1CCCC1 Amb25327474 [0,1,0,1,0,0|1,0,1]=4 14750 B9R1.11 CC(CN)=C1CCCC1 Amb27807756 [0,1,0,1,0,0|1,0,1]=4 14751 B9R1.11 CC(CN)C1CCCC1 Amb17087397 [0,1,0,1,0,0|1,0,1]=4 14752 B9R1.11 CC(CO)C1CCCC1 Amb25997168 [0,1,0,1,0,0|0,0,2]=4 14753 B9R1.11 CC(NN)C1CCCC1 Amb25303294 [0,1,0,1,0,0|1,0,1]=4 14754 B9R1.11 CC(ON)C1CCCC1 Amb33315755 [0,1,0,1,0,0|0,0,2]=4 14755 B9R1.11 CCC(=O)C1=CCCC1 Amb23558951 [0,1,0,1,0,0|0,0,2]=4 14756 B9R1.11 CCC(=O)C1CCCC1 Amb33534974 [0,1,0,1,0,0|0,0,0]=2 14757 B9R1.11 CCC(=O)C1CCCN1 Amb17231849 [0,1,0,1,0,0|1,0,0]=3 14758 B9R1.11 CCC(=O)C1CCCN1 Amb32666386 [0,1,0,1,0,0|1,0,0]=3 14759 B9R1.11 CCC(=O)C1CCNC1 Amb25313307 [0,1,0,1,0,0|1,0,0]=3 14760 B9R1.11 CCC(=O)C1CCOC1 Amb19148917 [0,1,0,1,0,0|1,0,0]=3 14761 B9R1.11 CCC(=O)C1CCSC1 Amb25139897 [0,1,0,1,0,0|1,0,0]=3 14762 B9R1.11 CCC(=O)N1CCCC1 Amb3886543 [0,1,0,1,0,0|1,0,0]=3 14763 B9R1.11 CCC(=O)N1CCCO1 Amb28381452 [0,1,0,1,0,0|2,0,0]=4 14764 B9R1.11 CCC(=O)N1CCNC1 Amb24670282 [0,1,0,1,0,0|2,0,0]=4 14765 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb26856430 [0,1,0,1,0,0|1,0,0]=3 14766 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb32663156 [0,1,0,1,0,0|1,0,0]=3 14767 B9R1.11 CCC(=O)[C@@H]1CCNC1 Amb30039125 [0,1,0,1,0,0|1,0,0]=3 14768 B9R1.11 CCC(=O)[C@H]1CCCN1 Amb33132117 [0,1,0,1,0,0|1,0,0]=3 14769 B9R1.11 CCC(=O)[C@H]1CCNC1 Amb33132074 [0,1,0,1,0,0|1,0,0]=3 14770 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|1,0,1]=4 14771 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|1,0,1]=4 14772 B9R1.11 CCC(S)C1CCCC1 Amb25984964 [0,1,0,1,0,0|0,1,1]=4 14773 B9R1.11 CCS(=O)C1CCNC1 Amb27239417 [0,1,0,1,0,0|2,0,0]=4 14774 B9R1.11 CC[C@H](N)C1CCCC1 Amb27436954 [0,1,0,1,0,0|1,0,1]=4 14775 B9R1.11 CC[C@H](O)C1CCCC1 Amb27758989 [0,1,0,1,0,0|0,0,2]=4 14776 B9R1.11 CN(C=O)C1CCCC1 Amb17939454 [0,1,0,1,0,0|1,0,0]=3 14777 B9R1.11 CNC(=N)C1CCCC1 Amb27162038 [0,1,0,1,0,0|1,0,0]=3 14778 B9R1.11 CNC(=N)C1CCCS1 Amb27787663 [0,1,0,1,0,0|2,0,0]=4 14779 B9R1.11 CNC(=N)C1CCSC1 Amb35689162 [0,1,0,1,0,0|2,0,0]=4 14780 B9R1.11 CNC(=N)N1CCCC1 Amb27837416 [0,1,0,1,0,0|2,0,0]=4 14781 B9R1.11 CNC(=O)C1=CCCC1 Amb28423727 [0,1,0,1,0,0|0,0,2]=4 14782 B9R1.11 CNC(=O)C1CC=CC1 Amb28292101 [0,1,0,1,0,0|0,0,2]=4 14783 B9R1.11 CNC(=O)C1CCCC1 Amb8340768 [0,1,0,1,0,0|0,0,0]=2 14784 B9R1.11 CNC(=O)C1CCCN1 Amb10609065 [0,1,0,1,0,0|1,0,0]=3 14785 B9R1.11 CNC(=O)C1CCCN1 Amb9717334 [0,1,0,1,0,0|1,0,0]=3 14786 B9R1.11 CNC(=O)C1CCCO1 Amb3445623 [0,1,0,1,0,0|1,0,0]=3 14787 B9R1.11 CNC(=O)C1CCNC1 Amb10608170 [0,1,0,1,0,0|1,0,0]=3 14788 B9R1.11 CNC(=O)C1CCNC1 Amb21960149 [0,1,0,1,0,0|1,0,0]=3 14789 B9R1.11 CNC(=O)C1NCCS1 Amb27975503 [0,1,0,1,0,0|2,0,0]=4 14790 B9R1.11 CNC(=O)N1CCCC1 Amb27640219 [0,1,0,1,0,0|1,0,0]=3 14791 B9R1.11 CNC(=O)N1CCCN1 Amb27250602 [0,1,0,1,0,0|2,0,0]=4 14792 B9R1.11 CNC(=O)N1CCCO1 Amb27836494 [0,1,0,1,0,0|2,0,0]=4 14793 B9R1.11 CNC(=O)N1CCNC1 Amb28345899 [0,1,0,1,0,0|2,0,0]=4 14794 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb10874670 [0,1,0,1,0,0|1,0,0]=3 14795 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb15740702 [0,1,0,1,0,0|1,0,0]=3 14796 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb22587500 [0,1,0,1,0,0|1,0,0]=3 14797 B9R1.11 CNC(=O)[C@@H]1CCCO1 Amb25864777 [0,1,0,1,0,0|1,0,0]=3 14798 B9R1.11 CNC(=O)[C@@H]1CCNC1 Amb27408789 [0,1,0,1,0,0|1,0,0]=3 14799 B9R1.11 CNC(=O)[C@@H]1CCNC1 Amb30009651 [0,1,0,1,0,0|1,0,0]=3 14800 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22232105 [0,1,0,1,0,0|1,0,0]=3 14801 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22587598 [0,1,0,1,0,0|1,0,0]=3 14802 B9R1.11 CNC(=O)[C@H]1CCNC1 Amb28411197 [0,1,0,1,0,0|1,0,0]=3 14803 B9R1.11 CNC(=O)[C@H]1CCNC1 Amb33483908 [0,1,0,1,0,0|1,0,0]=3 14804 B9R1.11 CNC(=O)[C@H]1CCOC1 Amb33228700 [0,1,0,1,0,0|1,0,0]=3 14805 B9R1.11 CNS(=O)C1CCCC1 Amb28254388 [0,1,0,1,0,0|1,0,0]=3 14806 B9R1.11 CN[C@@H](C)C1CCCC1 Amb27806619 [0,1,0,1,0,0|1,0,1]=4 14807 B9R1.11 CN[C@H](C)C1CCCC1 Amb27838543 [0,1,0,1,0,0|1,0,1]=4 14808 B9R1.11 COC(=N)C1CCCC1 Amb25713898 [0,1,0,1,0,0|1,0,0]=3 14809 B9R1.11 COC(=N)C1CCCC1 Amb33249615 [0,1,0,1,0,0|1,0,0]=3 14810 B9R1.11 COC(=N)C1CCSC1 Amb29863240 [0,1,0,1,0,0|2,0,0]=4 14811 B9R1.11 COC(=N)N1CCCC1 Amb27423270 [0,1,0,1,0,0|2,0,0]=4 14812 B9R1.11 COC(=O)C1=CCCC1 Amb8385478 [0,1,0,1,0,0|0,0,2]=4 14813 B9R1.11 COC(=O)C1=NCCC1 Amb21964254 [0,1,0,1,0,0|1,0,1]=4 14814 B9R1.11 COC(=O)C1C=CCC1 Amb23456135 [0,1,0,1,0,0|0,0,2]=4 14815 B9R1.11 COC(=O)C1CC=CC1 Amb2695401 [0,1,0,1,0,0|0,0,2]=4 14816 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [0,1,0,1,0,0|1,0,1]=4 14817 B9R1.11 COC(=O)C1CCCC1 Amb4021254 [0,1,0,1,0,0|0,0,0]=2 14818 B9R1.11 COC(=O)C1CCCN1 Amb33539333 [0,1,0,1,0,0|1,0,0]=3 14819 B9R1.11 COC(=O)C1CCCN1 Amb5492762 [0,1,0,1,0,0|1,0,0]=3 14820 B9R1.11 COC(=O)C1CCCO1 Amb8392933 [0,1,0,1,0,0|1,0,0]=3 14821 B9R1.11 COC(=O)C1CCCS1 Amb23590656 [0,1,0,1,0,0|1,0,0]=3 14822 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb22045239 [0,1,0,1,0,0|1,0,0]=3 14823 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb33513046 [0,1,0,1,0,0|1,0,0]=3 14824 B9R1.11 COC(=O)C1CCNC1 Amb2695367 [0,1,0,1,0,0|1,0,0]=3 14825 B9R1.11 COC(=O)C1CCNC1 Amb9721388 [0,1,0,1,0,0|1,0,0]=3 14826 B9R1.11 COC(=O)C1CCNN1 Amb27218833 [0,1,0,1,0,0|2,0,0]=4 14827 B9R1.11 COC(=O)C1CCNO1 Amb24607719 [0,1,0,1,0,0|2,0,0]=4 14828 B9R1.11 COC(=O)C1CCNO1 Amb32896053 [0,1,0,1,0,0|2,0,0]=4 14829 B9R1.11 COC(=O)C1CCOC1 Amb10610344 [0,1,0,1,0,0|1,0,0]=3 14830 B9R1.11 COC(=O)C1CCSC1 Amb24598032 [0,1,0,1,0,0|1,0,0]=3 14831 B9R1.11 COC(=O)C1CCSS1 Amb33483432 [0,1,0,1,0,0|2,0,0]=4 14832 B9R1.11 COC(=O)C1CNOC1 Amb24597324 [0,1,0,1,0,0|2,0,0]=4 14833 B9R1.11 COC(=O)C1CNOC1 Amb33339221 [0,1,0,1,0,0|2,0,0]=4 14834 B9R1.11 COC(=O)C1COCN1 Amb27754634 [0,1,0,1,0,0|2,0,0]=4 14835 B9R1.11 COC(=O)C1CSCN1 Amb1154599 [0,1,0,1,0,0|2,0,0]=4 14836 B9R1.11 COC(=O)C1CSCN1 Amb2967255 [0,1,0,1,0,0|2,0,0]=4 14837 B9R1.11 COC(=O)C1NCCS1 Amb3941401 [0,1,0,1,0,0|2,0,0]=4 14838 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb24113751 [0,1,0,1,0,0|2,0,0]=4 14839 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb6365986 [0,1,0,1,0,0|2,0,0]=4 14840 B9R1.11 COC(=O)N1CCCC1 Amb15693435 [0,1,0,1,0,0|1,0,0]=3 14841 B9R1.11 COC(=O)N1CCCO1 Amb27981531 [0,1,0,1,0,0|2,0,0]=4 14842 B9R1.11 COC(=O)[C@@H]1CCC=N1 Amb27249637 [0,1,0,1,0,0|1,0,1]=4 14843 B9R1.11 COC(=O)[C@@H]1CCCN1 Amb2700050 [0,1,0,1,0,0|1,0,0]=3 14844 B9R1.11 COC(=O)[C@@H]1CCCN1 Amb2720243 [0,1,0,1,0,0|1,0,0]=3 14845 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [0,1,0,1,0,0|1,0,0]=3 14846 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb20241764 [0,1,0,1,0,0|1,0,0]=3 14847 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb22225397 [0,1,0,1,0,0|1,0,0]=3 14848 B9R1.11 COC(=O)[C@@H]1CCNC1 Amb22405891 [0,1,0,1,0,0|1,0,0]=3 14849 B9R1.11 COC(=O)[C@@H]1CCOC1 Amb27167435 [0,1,0,1,0,0|1,0,0]=3 14850 B9R1.11 COC(=O)[C@@H]1CSCN1 Amb5759061 [0,1,0,1,0,0|2,0,0]=4 14851 B9R1.11 COC(=O)[C@@H]1CSCN1 Amb9860665 [0,1,0,1,0,0|2,0,0]=4 14852 B9R1.11 COC(=O)[C@H]1CCCN1 Amb10844896 [0,1,0,1,0,0|1,0,0]=3 14853 B9R1.11 COC(=O)[C@H]1CCCN1 Amb2700059 [0,1,0,1,0,0|1,0,0]=3 14854 B9R1.11 COC(=O)[C@H]1CCC[NH2+]1 Amb6366044 [0,1,0,1,0,0|1,0,0]=3 14855 B9R1.11 COC(=O)[C@H]1CCNC1 Amb22405890 [0,1,0,1,0,0|1,0,0]=3 14856 B9R1.11 COC(=O)[C@H]1CCNC1 Amb22744897 [0,1,0,1,0,0|1,0,0]=3 14857 B9R1.11 COC(=O)[C@H]1CCNC1 Amb28398077 [0,1,0,1,0,0|1,0,0]=3 14858 B9R1.11 COC(=O)[C@H]1CCOC1 Amb23439173 [0,1,0,1,0,0|1,0,0]=3 14859 B9R1.11 COC(=O)[C@H]1CSCN1 Amb25865131 [0,1,0,1,0,0|2,0,0]=4 14860 B9R1.11 CSC(=S)N1CCCC1 Amb28252844 [0,1,0,1,0,0|1,1,0]=4 14861 B9R1.11 CSC(C)C1CCCC1 Amb27854119 [0,1,0,1,0,0|0,1,1]=4 14862 B9R1.11 C[C@@H](CN)C1CCCC1 Amb33731705 [0,1,0,1,0,0|1,0,1]=4 14863 B9R1.11 C[C@@H](CO)C1CCCC1 Amb33741046 [0,1,0,1,0,0|0,0,2]=4 14864 B9R1.11 C[C@H](CN)C1CCCC1 Amb33736881 [0,1,0,1,0,0|1,0,1]=4 14865 B9R1.11 C[C@H](CO)C1CCCC1 Amb33748466 [0,1,0,1,0,0|0,0,2]=4 14866 B9R1.11 C\C(=N/N)C1CCCC1 Amb28065575 [0,1,0,1,0,0|1,0,0]=3 14867 B9R1.11 C\C(=N/O)C1CCCC1 Amb28064503 [0,1,0,1,0,0|0,0,1]=3 14868 B9R1.11 C\C(=N/O)C1CCOC1 Amb27243899 [0,1,0,1,0,0|1,0,1]=4 14869 B9R1.11 C\C=C(/C)C1CCNC1 Amb27838504 [0,1,0,1,0,0|2,0,0]=4 14870 B9R1.11 C\C=C(\C)C1CCCN1 Amb27851858 [0,1,0,1,0,0|2,0,0]=4 14871 B9R1.11 C\C=C(\C)C1CCNC1 Amb27629671 [0,1,0,1,0,0|2,0,0]=4 14872 B9R1.11 N=C(CCl)N1CCCC1 Amb29847978 [0,1,0,1,0,0|2,0,0]=4 14873 B9R1.11 N=C(NO)C1CCCC1 Amb22733339 [0,1,0,1,0,0|1,0,1]=4 14874 B9R1.11 NC(CCl)C1CCCC1 Amb28324505 [0,1,0,1,0,0|1,0,1]=4 14875 B9R1.11 NC(CF)C1CCCC1 Amb27182144 [0,1,0,1,0,0|1,0,1]=4 14876 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|1,0,1]=4 14877 B9R1.11 NCC(=O)C1CCCC1 Amb18832687 [0,1,0,1,0,0|0,0,0]=2 14878 B9R1.11 NCC(=O)C1CCCC1 Amb29083225 [0,1,0,1,0,0|0,0,0]=2 14879 B9R1.11 NCC(=O)C1CCCO1 Amb24398393 [0,1,0,1,0,0|1,0,0]=3 14880 B9R1.11 NCC(=O)C1CCCS1 Amb33416249 [0,1,0,1,0,0|1,0,0]=3 14881 B9R1.11 NCC(=O)C1CCNC1 Amb18832619 [0,1,0,1,0,0|1,0,0]=3 14882 B9R1.11 NCC(=O)C1CCOC1 Amb18832569 [0,1,0,1,0,0|1,0,0]=3 14883 B9R1.11 NCC(=O)C1CCSC1 Amb18201886 [0,1,0,1,0,0|1,0,0]=3 14884 B9R1.11 NCC(=O)N1CCCC1 Amb2694463 [0,1,0,1,0,0|1,0,0]=3 14885 B9R1.11 NCC(=O)N1CCCC1 Amb32409632 [0,1,0,1,0,0|1,0,0]=3 14886 B9R1.11 NCC(=O)N1CCCC1 Amb509781 [0,1,0,1,0,0|1,0,0]=3 14887 B9R1.11 NCC(=O)N1CCCO1 Amb24481678 [0,1,0,1,0,0|2,0,0]=4 14888 B9R1.11 NCC(=O)N1CCCO1 Amb28555387 [0,1,0,1,0,0|2,0,0]=4 14889 B9R1.11 NCC(=O)N1CCSC1 Amb28060306 [0,1,0,1,0,0|2,0,0]=4 14890 B9R1.11 NCC(F)C1CCCC1 Amb28120476 [0,1,0,1,0,0|1,0,1]=4 14891 B9R1.11 NCC(F)C1CCCC1 Amb31291557 [0,1,0,1,0,0|1,0,1]=4 14892 B9R1.11 NCC(N)C1CCCC1 Amb18284364 [0,1,0,1,0,0|1,0,1]=4 14893 B9R1.11 NCC(O)C1CCCC1 Amb18959867 [0,1,0,1,0,0|0,0,2]=4 14894 B9R1.11 NCC(O)C1CCCC1 Amb19515470 [0,1,0,1,0,0|0,0,2]=4 14895 B9R1.11 NC[C@@H](O)C1CCCC1 Amb25921175 [0,1,0,1,0,0|0,0,2]=4 14896 B9R1.11 NC[C@H](N)C1CCCC1 Amb27204572 [0,1,0,1,0,0|1,0,1]=4 14897 B9R1.11 NC[C@H](O)C1CCCC1 Amb25889800 [0,1,0,1,0,0|0,0,2]=4 14898 B9R1.11 NNC(=O)C1CCCC1 Amb6555160 [0,1,0,1,0,0|1,0,0]=3 14899 B9R1.11 NNC(=O)C1CCCN1 Amb18061830 [0,1,0,1,0,0|2,0,0]=4 14900 B9R1.11 NNC(=O)C1CCCO1 Amb34916470 [0,1,0,1,0,0|2,0,0]=4 14901 B9R1.11 NNC(=O)C1CCCO1 Amb9707217 [0,1,0,1,0,0|2,0,0]=4 14902 B9R1.11 NNC(=O)C1CCCS1 Amb25887207 [0,1,0,1,0,0|2,0,0]=4 14903 B9R1.11 NNC(=O)C1CCCS1 Amb32664150 [0,1,0,1,0,0|2,0,0]=4 14904 B9R1.11 NNC(=O)C1CCOC1 Amb19149119 [0,1,0,1,0,0|2,0,0]=4 14905 B9R1.11 NNC(=O)N1CCCC1 Amb8854020 [0,1,0,1,0,0|2,0,0]=4 14906 B9R1.11 NNC(=O)[C@@H]1CCCO1 Amb25796517 [0,1,0,1,0,0|2,0,0]=4 14907 B9R1.11 NNC(=O)[C@@H]1CCNC1 Amb27982799 [0,1,0,1,0,0|2,0,0]=4 14908 B9R1.11 NNC(=O)[C@@H]1CCNC1 Amb30017238 [0,1,0,1,0,0|2,0,0]=4 14909 B9R1.11 NNC(=O)[C@H]1CCCO1 Amb25221584 [0,1,0,1,0,0|2,0,0]=4 14910 B9R1.11 NNC(=O)[C@H]1CCNC1 Amb30017239 [0,1,0,1,0,0|2,0,0]=4 14911 B9R1.11 NNS(=O)C1CCCC1 Amb28324225 [0,1,0,1,0,0|2,0,0]=4 14912 B9R1.11 NOC(=O)C1CCOC1 Amb22170066 [0,1,0,1,0,0|2,0,0]=4 14913 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|1,0,1]=4 14914 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|1,0,1]=4 14915 B9R1.11 N[C@H](CO)C1CCCC1 Amb33872225 [0,1,0,1,0,0|1,0,1]=4 14916 B9R1.11 N\C(=N/O)C1CCCC1 Amb2695057 [0,1,0,1,0,0|1,0,1]=4 14917 B9R1.11 N\N=C(/N)C1CCCC1 Amb2696472 [0,1,0,1,0,0|2,0,0]=4 14918 B9R1.11 O=C(CBr)C1CCCC1 Amb19375225 [0,1,0,1,0,0|0,0,0]=2 14919 B9R1.11 O=C(CBr)C1CCCO1 Amb24104046 [0,1,0,1,0,0|1,0,0]=3 14920 B9R1.11 O=C(CBr)C1CCCS1 Amb27798466 [0,1,0,1,0,0|1,0,0]=3 14921 B9R1.11 O=C(CBr)C1CCOC1 Amb23455014 [0,1,0,1,0,0|1,0,0]=3 14922 B9R1.11 O=C(CBr)C1CCSC1 Amb28388771 [0,1,0,1,0,0|1,0,0]=3 14923 B9R1.11 O=C(CBr)N1CCCC1 Amb17327770 [0,1,0,1,0,0|1,0,0]=3 14924 B9R1.11 O=C(CBr)[C@@H]1CCCO1 Amb26860082 [0,1,0,1,0,0|1,0,0]=3 14925 B9R1.11 O=C(CCl)C1CCCC1 Amb8396061 [0,1,0,1,0,0|0,0,0]=2 14926 B9R1.11 O=C(CCl)C1CCCO1 Amb24751558 [0,1,0,1,0,0|1,0,0]=3 14927 B9R1.11 O=C(CCl)C1CCCS1 Amb25328071 [0,1,0,1,0,0|1,0,0]=3 14928 B9R1.11 O=C(CCl)C1CCOC1 Amb27153209 [0,1,0,1,0,0|1,0,0]=3 14929 B9R1.11 O=C(CCl)C1CCSC1 Amb27753331 [0,1,0,1,0,0|1,0,0]=3 14930 B9R1.11 O=C(CCl)N1CCCC1 Amb6335285 [0,1,0,1,0,0|1,0,0]=3 14931 B9R1.11 O=C(CCl)N1CCSC1 Amb28071671 [0,1,0,1,0,0|2,0,0]=4 14932 B9R1.11 O=C(CF)C1CCCC1 Amb23571962 [0,1,0,1,0,0|0,0,0]=2 14933 B9R1.11 O=C(CO)C1CCCC1 Amb28194788 [0,1,0,1,0,0|0,0,0]=2 14934 B9R1.11 O=C(CO)C1CCOC1 Amb27390723 [0,1,0,1,0,0|1,0,0]=3 14935 B9R1.11 O=C(CO)N1CCCC1 Amb5798098 [0,1,0,1,0,0|1,0,0]=3 14936 B9R1.11 O=C(NO)C1CCCC1 Amb6262531 [0,1,0,1,0,0|1,0,0]=3 14937 B9R1.11 O=C(NO)C1CCCN1 Amb25127054 [0,1,0,1,0,0|2,0,0]=4 14938 B9R1.11 O=C(NO)C1CCCN1 Amb33204459 [0,1,0,1,0,0|2,0,0]=4 14939 B9R1.11 O=C(NO)C1CCCO1 Amb6264210 [0,1,0,1,0,0|2,0,0]=4 14940 B9R1.11 O=C(NO)C1CCCS1 Amb27170986 [0,1,0,1,0,0|2,0,0]=4 14941 B9R1.11 O=C(NO)C1CCNC1 Amb27856778 [0,1,0,1,0,0|2,0,0]=4 14942 B9R1.11 O=C(NO)[C@@H]1CCCN1 Amb27410904 [0,1,0,1,0,0|2,0,0]=4 14943 B9R1.11 O=C(NO)[C@@H]1CCNC1 Amb35675145 [0,1,0,1,0,0|2,0,0]=4 14944 B9R1.11 O=C(NO)[C@H]1CCCO1 Amb27837680 [0,1,0,1,0,0|2,0,0]=4 14945 B9R1.11 O=C(NO)[C@H]1CCNC1 Amb35593664 [0,1,0,1,0,0|2,0,0]=4 14946 B9R1.11 O=CC(=O)C1CCCO1 Amb27817025 [0,1,0,1,0,0|1,0,1]=4 14947 B9R1.11 O=CC(=O)C1CCOC1 Amb27658678 [0,1,0,1,0,0|1,0,1]=4 14948 B9R1.11 OC(CBr)C1CCCC1 Amb25889801 [0,1,0,1,0,0|0,0,2]=4 14949 B9R1.11 OC(CCl)C1CCCC1 Amb28140979 [0,1,0,1,0,0|0,0,2]=4 14950 B9R1.11 OC(CF)C1CCCC1 Amb27872595 [0,1,0,1,0,0|0,0,2]=4 14951 B9R1.11 OCC(F)=C1CCCC1 Amb27852389 [0,1,0,1,0,0|1,0,1]=4 14952 B9R1.11 OCC(O)C1CCCC1 Amb26463836 [0,1,0,1,0,0|0,0,2]=4 14953 B9R1.11 OC[C@H](O)C1CCCC1 Amb28049189 [0,1,0,1,0,0|0,0,2]=4 14954 B9R1.11 O[C@@H](CCl)C1CCCC1 Amb28121560 [0,1,0,1,0,0|0,0,2]=4 14955 B9R1.11 [C-]#[N+]C(C)C1CCCC1 Amb3973459 [0,1,0,1,0,0|1,0,1]=4 14956 B9R1.16 CC1CC1CCCCN Amb33143911 [0,1,0,1,0,0|1,0,1]=4 14957 B9R1.16 CCCCCC1CC1Br Amb27408601 [0,1,0,1,0,0|1,0,1]=4 14958 B9R1.16 CCCCCC1CC1Cl Amb27477799 [0,1,0,1,0,0|1,0,1]=4 14959 B9R1.16 CCCCCC1CC1N Amb27872129 [0,1,0,1,0,0|1,0,1]=4 14960 B9R1.16 CCCCCC1OC1C Amb25888870 [0,1,0,1,0,0|0,0,2]=4 14961 B9R1.16 CCCCC[C@@H]1C[C@H]1F Amb27849384 [0,1,0,1,0,0|1,0,1]=4 14962 B9R1.16 CCCCC[C@H]1C[C@H]1O Amb28292777 [0,1,0,1,0,0|0,0,2]=4 14963 B9R1.16 CCCCNC1CC1C Amb19022375 [0,1,0,1,0,0|1,0,1]=4 14964 B9R1.16 CCCCO[C@@H]1C[C@@H]1Cl Amb27243377 [0,1,0,1,0,0|1,0,1]=4 14965 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,0,1]=4 14966 B9R1.16 CCCCO[C@H]1C[C@H]1Cl Amb28384496 [0,1,0,1,0,0|1,0,1]=4 14967 B9R1.16 CCCC\C=C1/CC1Br Amb27232659 [0,1,0,1,0,0|1,0,1]=4 14968 B9R1.16 CCCNCC1CC1C Amb8853760 [0,1,0,1,0,0|1,0,1]=4 14969 B9R1.17 CCCCCC1CCN1 Amb28387630 [0,1,0,1,0,0|1,0,1]=4 14970 B9R1.17 CCCCCC1CNC1 Amb27599832 [0,1,0,1,0,0|1,0,1]=4 14971 B9R1.17 CCCCCC1CNC1 Amb33141041 [0,1,0,1,0,0|1,0,1]=4 14972 B9R1.20 CCCCC1CC1CN Amb33428098 [0,1,0,1,0,0|1,0,1]=4 14973 B9R1.20 CCCCC1OC1C=O Amb26852359 [0,1,0,1,0,0|1,0,1]=4 14974 B9R1.20 CCCCC1OC1CBr Amb24480230 [0,1,0,1,0,0|0,0,2]=4 14975 B9R1.20 CCCCC1OC1CCl Amb27755023 [0,1,0,1,0,0|0,0,2]=4 14976 B9R1.20 CCCCC1OC1CO Amb28069435 [0,1,0,1,0,0|0,0,2]=4 14977 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [0,1,0,1,0,0|0,0,1]=3 14978 B9R1.20 CCCC[C@@H]1C[C@H]1CN Amb33428099 [0,1,0,1,0,0|1,0,1]=4 14979 B9R1.20 CCCC[C@@H]1C[C@H]1CO Amb27857307 [0,1,0,1,0,0|0,0,2]=4 14980 B9R1.20 CCCC[C@@H]1O[C@H]1CN Amb28428722 [0,1,0,1,0,0|0,0,2]=4 14981 B9R1.20 CCCC[C@H]1C[C@@H]1CO Amb27457988 [0,1,0,1,0,0|0,0,2]=4 14982 B9R1.20 CCCC[C@H]1O[C@@H]1CO Amb27446723 [0,1,0,1,0,0|0,0,2]=4 14983 B9R1.20 CCCC[C@H]1O[C@H]1CCl Amb27975821 [0,1,0,1,0,0|0,0,2]=4 14984 B9R1.20 O=C[C@H]1C[C@H]1CCCBr Amb27202574 [0,1,0,1,0,0|1,0,1]=4 14985 B9R1.21 CCC1=NC(CC)CS1 Amb25244083 [0,1,0,1,0,0|2,0,0]=4 14986 B9R1.21 CCC1=NCC(CC)S1 Amb27621120 [0,1,0,1,0,0|1,1,0]=4 14987 B9R1.21 CCC1CC(C=O)CO1 Amb29870829 [0,1,0,1,0,0|1,0,1]=4 14988 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [0,1,0,1,0,0|0,0,1]=3 14989 B9R1.21 CCC1CCC(CBr)C1 Amb26006974 [0,1,0,1,0,0|1,0,1]=4 14990 B9R1.21 CCC1CCC(CC)N1 Amb26430315 [0,1,0,1,0,0|1,0,1]=4 14991 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|0,0,2]=4 14992 B9R1.21 CCC1CCC(CN)C1 Amb27869330 [0,1,0,1,0,0|1,0,1]=4 14993 B9R1.21 CCC1CCC(CO)C1 Amb26929311 [0,1,0,1,0,0|0,0,2]=4 14994 B9R1.21 CCC1CCC(NN)C1 Amb27479809 [0,1,0,1,0,0|1,0,1]=4 14995 B9R1.21 CCC1CCN(C#N)C1 Amb27485615 [0,1,0,1,0,0|2,0,0]=4 14996 B9R1.21 CCC1CC\C(=N/N)C1 Amb28049533 [0,1,0,1,0,0|1,0,0]=3 14997 B9R1.21 CCC1CC\C(=N/O)C1 Amb27602116 [0,1,0,1,0,0|0,0,1]=3 14998 B9R1.21 CCC1C\C(=N\N)CO1 Amb35634236 [0,1,0,1,0,0|2,0,0]=4 14999 B9R1.21 CCC1C\C(=N\O)CO1 Amb30028904 [0,1,0,1,0,0|1,0,1]=4 15000 B9R1.21 CCN1CCC(C=O)C1 Amb23449544 [0,1,0,1,0,0|1,0,1]=4 15001 B9R1.21 CC[C@@H]1CC[C@@H](CCl)O1 Amb27879821 [0,1,0,1,0,0|0,0,2]=4 15002 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [0,1,0,1,0,0|1,0,1]=4 15003 B9R1.21 CC[C@@H]1COC(CCl)=N1 Amb27401855 [0,1,0,1,0,0|2,0,0]=4 15004 B9R1.21 COC1C=C(CO)CC1 Amb27956634 [0,1,0,1,0,0|2,0,0]=4 15005 B9R1.21 COC1CCN(C=O)C1 Amb28188409 [0,1,0,1,0,0|2,0,0]=4 15006 B9R1.21 COC1CCN(N=O)C1 Amb24102315 [0,1,0,1,0,0|2,0,0]=4 15007 B9R1.21 CSC1=N[C@H](CO)CC1 Amb27757240 [0,1,0,1,0,0|2,0,0]=4 15008 B9R1.21 CSC1CCN(C=O)C1 Amb27432869 [0,1,0,1,0,0|2,0,0]=4 15009 B9R1.21 O=CC1CCC(CO)C1 Amb26516032 [0,1,0,1,0,0|1,0,1]=4 15010 B9R1.21 O=NN1CCC(CO)C1 Amb25889760 [0,1,0,1,0,0|2,0,0]=4 15011 B9R1.39 C=CCCC1CNC1=O Amb28314166 [0,1,0,1,0,0|0,0,2]=4 15012 B9R1.39 CCCCC1CCC1N Amb27193785 [0,1,0,1,0,0|1,0,1]=4 15013 B9R1.39 CCCCC1CCC1O Amb32950020 [0,1,0,1,0,0|0,0,2]=4 15014 B9R1.39 CCC\C=C1/CNC1=O Amb27655996 [0,1,0,1,0,0|0,0,2]=4 15015 B9R1.39 NCCCN1CCC1=O Amb27209792 [0,1,0,1,0,0|2,0,0]=4 15016 B9R1.39 O=C1CCC1CCCCl Amb32684692 [0,1,0,1,0,0|1,0,0]=3 15017 B9R1.49 C=C1CCCC(=O)NC1 Amb27252961 [0,1,0,1,0,0|0,0,2]=4 15018 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,1,0,1,0,0|1,0,0]=3 15019 B9R1.49 CC1=CCC(=O)CCC1 Amb27838790 [0,1,0,1,0,0|0,0,1]=3 15020 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,1,0,1,0,0|0,0,2]=4 15021 B9R1.49 CC1=NCC(C)NCC1 Amb27596558 [0,1,0,1,0,0|2,0,0]=4 15022 B9R1.49 CC1=NCCN(C)CC1 Amb25046324 [0,1,0,1,0,0|2,0,0]=4 15023 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,1,0,1,0,0|0,0,2]=4 15024 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,1,0,0|0,0,0]=2 15025 B9R1.49 CC1CCCC(C)NC1 Amb19148123 [0,1,0,1,0,0|1,0,1]=4 15026 B9R1.49 CC1CCCC(Cl)CC1 Amb27860130 [0,1,0,1,0,0|1,0,1]=4 15027 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|1,0,1]=4 15028 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|0,0,2]=4 15029 B9R1.49 CC1CCCC(S)CC1 Amb26326403 [0,1,0,1,0,0|0,1,1]=4 15030 B9R1.49 CC1CCCN(C)CC1 Amb27837612 [0,1,0,1,0,0|2,0,0]=4 15031 B9R1.49 CC1CCCN(N)CC1 Amb27424632 [0,1,0,1,0,0|2,0,0]=4 15032 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,1,0,1,0,0|1,0,0]=3 15033 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|1,0,0]=3 15034 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,1,0,1,0,0|2,0,0]=4 15035 B9R1.49 CC1CCS(=O)CCN1 Amb28555361 [0,1,0,1,0,0|2,0,0]=4 15036 B9R1.49 CC1CNC(=O)CCN1 Amb10607813 [0,1,0,1,0,0|1,0,0]=3 15037 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,1,0,1,0,0|1,0,0]=3 15038 B9R1.49 CC1CNC(=S)CCS1 Amb27444108 [0,1,0,1,0,0|1,1,0]=4 15039 B9R1.49 CN1CCCC(=O)CC1 Amb8383587 [0,1,0,1,0,0|1,0,0]=3 15040 B9R1.49 CN1CCCC(=O)CC1 Amb8394679 [0,1,0,1,0,0|1,0,0]=3 15041 B9R1.49 CN1CCCC(Br)CC1 Amb27945185 [0,1,0,1,0,0|2,0,0]=4 15042 B9R1.49 CN1CCCC(Cl)CC1 Amb2610602 [0,1,0,1,0,0|2,0,0]=4 15043 B9R1.49 CN1CCCC(N)CC1 Amb18832600 [0,1,0,1,0,0|2,0,0]=4 15044 B9R1.49 CN1CCCC(N)CC1 Amb30585204 [0,1,0,1,0,0|2,0,0]=4 15045 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|2,0,0]=4 15046 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|2,0,0]=4 15047 B9R1.49 CN1CCCC(S)CC1 Amb26936316 [0,1,0,1,0,0|2,0,0]=4 15048 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,1,0,1,0,0|2,0,0]=4 15049 B9R1.49 CN1CCNC(=O)CC1 Amb8393772 [0,1,0,1,0,0|2,0,0]=4 15050 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,1,0,0|0,0,0]=2 15051 B9R1.49 C[C@@H]1CCCC(=O)NC1 Amb27814970 [0,1,0,1,0,0|0,0,0]=2 15052 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,1,0,0|0,0,0]=2 15053 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,1,0,1,0,0|0,0,2]=4 15054 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,1,0,1,0,0|0,0,2]=4 15055 B9R1.49 ClC1CCCC(Cl)CC1 Amb22364836 [0,1,0,1,0,0|1,0,1]=4 15056 B9R1.49 Cl[C@H]1CCC[C@H](Cl)CC1 Amb28399791 [0,1,0,1,0,0|1,0,1]=4 15057 B9R1.49 NC1CCCC(=O)NC1 Amb22230053 [0,1,0,1,0,0|1,0,0]=3 15058 B9R1.49 NC1CCCC(=O)NC1 Amb27867752 [0,1,0,1,0,0|1,0,0]=3 15059 B9R1.49 NC1CCCC(F)CC1 Amb28289169 [0,1,0,1,0,0|1,0,1]=4 15060 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,1,0,1,0,0|1,0,0]=3 15061 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,1,0,1,0,0|1,0,0]=3 15062 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,1,0,1,0,0|1,0,0]=3 15063 B9R1.49 N[C@@H]1CCC[C@@H](Cl)CC1 Amb27447260 [0,1,0,1,0,0|1,0,1]=4 15064 B9R1.49 N[C@@H]1CCC[C@H](O)CC1 Amb27221049 [0,1,0,1,0,0|0,0,2]=4 15065 B9R1.49 O=C1CCC(=O)COC1 Amb2707216 [0,1,0,1,0,0|1,0,1]=4 15066 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,1,0,1,0,0|1,0,0]=3 15067 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,1,0,1,0,0|1,0,0]=3 15068 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,1,0,1,0,0|1,0,0]=3 15069 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,1,0,1,0,0|1,0,0]=3 15070 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,1,0,1,0,0|1,0,0]=3 15071 B9R1.49 O=C1CCCS(=O)CC1 Amb26476534 [0,1,0,1,0,0|1,0,0]=3 15072 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,1,0,1,0,0|0,0,0]=2 15073 B9R1.49 O=C1CCNC(=O)CC1 Amb22490261 [0,1,0,1,0,0|1,0,1]=4 15074 B9R1.49 O=C1CCS(=O)CCN1 Amb26480169 [0,1,0,1,0,0|2,0,0]=4 15075 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,1,0,1,0,0|1,0,0]=3 15076 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,1,0,1,0,0|1,0,0]=3 15077 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,1,0,1,0,0|2,0,0]=4 15078 B9R1.49 O[C@@H]1CCC[C@@H](O)CC1 Amb27647850 [0,1,0,1,0,0|0,0,2]=4 15079 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [0,1,0,1,0,0|1,0,0]=3 15080 B9R1.50 BrC1CCCCCCC1 Amb6366088 [0,1,0,1,0,0|1,0,1]=4 15081 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|1,0,1]=4 15082 B9R1.50 CC1CCCCCCN1 Amb26579162 [0,1,0,1,0,0|1,0,1]=4 15083 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|1,0,1]=4 15084 B9R1.50 CC1CNCCCCN1 Amb28067733 [0,1,0,1,0,0|1,0,1]=4 15085 B9R1.50 CC1OCCCCCO1 Amb28367128 [0,1,0,1,0,0|0,0,2]=4 15086 B9R1.50 CN1CCCCCCC1 Amb26406289 [0,1,0,1,0,0|2,0,0]=4 15087 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 15088 B9R1.50 CN1CCCNCCC1 Amb33483191 [0,1,0,1,0,0|2,0,0]=4 15089 B9R1.50 ClC1CCCCCCC1 Amb4018627 [0,1,0,1,0,0|1,0,1]=4 15090 B9R1.50 ClC1CCCCOCC1 Amb27984820 [0,1,0,1,0,0|1,0,1]=4 15091 B9R1.50 NC1CCCCCCC1 Amb2720323 [0,1,0,1,0,0|1,0,1]=4 15092 B9R1.50 NC1CCCCCNC1 Amb24447204 [0,1,0,1,0,0|1,0,1]=4 15093 B9R1.50 NC1CCCCCNC1 Amb32686531 [0,1,0,1,0,0|1,0,1]=4 15094 B9R1.50 NN1CCCCCCC1 Amb27203446 [0,1,0,1,0,0|2,0,0]=4 15095 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [0,1,0,1,0,0|0,0,1]=3 15096 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [0,1,0,1,0,0|0,0,2]=4 15097 B9R1.50 O=C1C=CCCOCC1 Amb27838783 [0,1,0,1,0,0|0,0,2]=4 15098 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [0,1,0,1,0,0|0,0,2]=4 15099 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,1,0,1,0,0|0,0,0]=2 15100 B9R1.50 O=C1CCCCCCN1 Amb2780498 [0,1,0,1,0,0|0,0,0]=2 15101 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,1,0,1,0,0|0,0,0]=2 15102 B9R1.50 O=C1CCCNCCN1 Amb27165283 [0,1,0,1,0,0|1,0,0]=3 15103 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,1,0,1,0,0|0,0,0]=2 15104 B9R1.50 O=C1CCNCCCN1 Amb22263665 [0,1,0,1,0,0|1,0,0]=3 15105 B9R1.50 O=C1CCNCCCN1 Amb23403551 [0,1,0,1,0,0|1,0,0]=3 15106 B9R1.50 O=C1CNCCCNC1 Amb30867936 [0,1,0,1,0,0|1,0,0]=3 15107 B9R1.50 O=C1NCCCCCN1 Amb25146134 [0,1,0,1,0,0|1,0,0]=3 15108 B9R1.50 OC1CCCCCCC1 Amb6608643 [0,1,0,1,0,0|0,0,2]=4 15109 B9R1.50 OC1CCCCCCO1 Amb27970488 [0,1,0,1,0,0|0,0,2]=4 15110 B9R1.50 OC1CCCCCOC1 Amb22364795 [0,1,0,1,0,0|0,0,2]=4 15111 B9R1.50 OC1CCCCSCC1 Amb28315547 [0,1,0,1,0,0|0,0,2]=4 15112 B9R1.50 SC1CCCCCCC1 Amb7784772 [0,1,0,1,0,0|0,1,1]=4 15113 B9R1.58 CCCC1CC(CN)C1 Amb26537008 [0,1,0,1,0,0|1,0,1]=4 15114 B9R1.58 CCOC1CC(=CCl)C1 Amb27424720 [0,1,0,1,0,0|2,0,0]=4 15115 B9R1.58 CCOC1CC(C=O)C1 Amb24470388 [0,1,0,1,0,0|1,0,1]=4 15116 B9R1.60 CCCC1CC1(N)CC Amb27442943 [0,1,0,1,0,0|1,0,1]=4 15117 B9R1.78 C#CC(=O)NC1CC1C Amb27617055 [0,1,0,1,0,0|1,0,1]=4 15118 B9R1.78 CC1CC1CC(=O)CN Amb33132711 [0,1,0,1,0,0|0,0,0]=2 15119 B9R1.78 CC1CC1CC(=O)NO Amb27981204 [0,1,0,1,0,0|1,0,0]=3 15120 B9R1.78 CC1CC1CC(N)CO Amb33144903 [0,1,0,1,0,0|1,0,1]=4 15121 B9R1.78 CC1CC1CC(O)CN Amb33144859 [0,1,0,1,0,0|0,0,2]=4 15122 B9R1.78 CC1CC1NC(=O)CCl Amb27865793 [0,1,0,1,0,0|1,0,0]=3 15123 B9R1.78 CC1CC1NC(=O)NN Amb27874903 [0,1,0,1,0,0|2,0,0]=4 15124 B9R1.78 CCN(N)CC1CC1C Amb35601584 [0,1,0,1,0,0|2,0,0]=4 15125 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1C Amb27779304 [0,1,0,1,0,0|1,0,0]=3 15126 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CO Amb27944646 [0,1,0,1,0,0|1,0,0]=3 15127 B9R1.79 C#CC(=O)CC1CNC1 Amb25807932 [0,1,0,1,0,0|1,0,1]=4 15128 B9R1.79 C=CC(=O)CC1CNC1 Amb25774002 [0,1,0,1,0,0|1,0,1]=4 15129 B9R1.79 CC(C=O)CC1CCC1 Amb27600503 [0,1,0,1,0,0|0,0,1]=3 15130 B9R1.79 CC(C=O)OC1CCC1 Amb30020607 [0,1,0,1,0,0|1,0,1]=4 15131 B9R1.79 CC(CBr)CC1CCC1 Amb27867129 [0,1,0,1,0,0|1,0,1]=4 15132 B9R1.79 CC(CN)CC1CCC1 Amb26074727 [0,1,0,1,0,0|1,0,1]=4 15133 B9R1.79 CC(CO)CC1CCC1 Amb24402725 [0,1,0,1,0,0|0,0,2]=4 15134 B9R1.79 CCC(=N)NC1CCC1 Amb28049541 [0,1,0,1,0,0|2,0,0]=4 15135 B9R1.79 CCC(=O)CC1CCC1 Amb28145122 [0,1,0,1,0,0|0,0,0]=2 15136 B9R1.79 CCC(=O)CC1CNC1 Amb25060246 [0,1,0,1,0,0|1,0,0]=3 15137 B9R1.79 CCC(=O)NC1CNC1 Amb24478758 [0,1,0,1,0,0|2,0,0]=4 15138 B9R1.79 CCC(=O)NC1CNC1 Amb33292445 [0,1,0,1,0,0|2,0,0]=4 15139 B9R1.79 CCC(=O)NN1CCC1 Amb32657776 [0,1,0,1,0,0|2,0,0]=4 15140 B9R1.79 CCC(=O)OC1CNC1 Amb21956279 [0,1,0,1,0,0|2,0,0]=4 15141 B9R1.79 CCC(=O)OC1CNC1 Amb33295373 [0,1,0,1,0,0|2,0,0]=4 15142 B9R1.79 CCS(=O)CC1CNC1 Amb28136210 [0,1,0,1,0,0|2,0,0]=4 15143 B9R1.79 CNC(=N)CN1CCC1 Amb28189552 [0,1,0,1,0,0|2,0,0]=4 15144 B9R1.79 CNC(=N)NC1CCC1 Amb27844992 [0,1,0,1,0,0|2,0,0]=4 15145 B9R1.79 CNC(=O)CC1COC1 Amb28064140 [0,1,0,1,0,0|1,0,0]=3 15146 B9R1.79 CNC(=O)NC1CCC1 Amb25830627 [0,1,0,1,0,0|1,0,0]=3 15147 B9R1.79 CNC(=O)NC1CNC1 Amb25071828 [0,1,0,1,0,0|2,0,0]=4 15148 B9R1.79 CNC(=O)NC1CNC1 Amb33552157 [0,1,0,1,0,0|2,0,0]=4 15149 B9R1.79 CNC(=O)NC1COC1 Amb27980333 [0,1,0,1,0,0|2,0,0]=4 15150 B9R1.79 CNC(=O)OC1CNC1 Amb28256255 [0,1,0,1,0,0|2,0,0]=4 15151 B9R1.79 CNC(=O)OC1CNC1 Amb33534535 [0,1,0,1,0,0|2,0,0]=4 15152 B9R1.79 CNC(=S)NC1CCC1 Amb27816574 [0,1,0,1,0,0|1,1,0]=4 15153 B9R1.79 CNC(C)CC1CCC1 Amb27261514 [0,1,0,1,0,0|1,0,1]=4 15154 B9R1.79 COC(=O)C=C1CCC1 Amb22232619 [0,1,0,1,0,0|0,0,2]=4 15155 B9R1.79 COC(=O)CC1CCC1 Amb2697273 [0,1,0,1,0,0|0,0,0]=2 15156 B9R1.79 COC(=O)CC1CCN1 Amb27608136 [0,1,0,1,0,0|1,0,0]=3 15157 B9R1.79 COC(=O)CC1CNC1 Amb21960730 [0,1,0,1,0,0|1,0,0]=3 15158 B9R1.79 COC(=O)CC1CNC1 Amb21962978 [0,1,0,1,0,0|1,0,0]=3 15159 B9R1.79 COC(=O)CC1CNC1 Amb22057369 [0,1,0,1,0,0|1,0,0]=3 15160 B9R1.79 COC(=O)CC1COC1 Amb21960725 [0,1,0,1,0,0|1,0,0]=3 15161 B9R1.79 COC(=O)CN1CCC1 Amb24481984 [0,1,0,1,0,0|1,0,0]=3 15162 B9R1.79 COC(=O)C[C@H]1CCN1 Amb27811905 [0,1,0,1,0,0|1,0,0]=3 15163 B9R1.79 COC(=O)NC1CNC1 Amb26512094 [0,1,0,1,0,0|2,0,0]=4 15164 B9R1.79 COC(=O)NC1CNC1 Amb33038276 [0,1,0,1,0,0|2,0,0]=4 15165 B9R1.79 COC(=O)NC1COC1 Amb27982552 [0,1,0,1,0,0|2,0,0]=4 15166 B9R1.79 COC(=S)SC1CCC1 Amb27837693 [0,1,0,1,0,0|1,1,0]=4 15167 B9R1.79 CON(C)CC1CCC1 Amb27837669 [0,1,0,1,0,0|1,0,1]=4 15168 B9R1.79 C[C@@H](CN)CC1CCC1 Amb33728845 [0,1,0,1,0,0|1,0,1]=4 15169 B9R1.79 C[C@@H](CO)CC1CCC1 Amb33743097 [0,1,0,1,0,0|0,0,2]=4 15170 B9R1.79 C[C@H](CN)CC1CCC1 Amb33726997 [0,1,0,1,0,0|1,0,1]=4 15171 B9R1.79 C[C@H](CO)CC1CCC1 Amb33738446 [0,1,0,1,0,0|0,0,2]=4 15172 B9R1.79 C\C(=C/C1CCC1)CBr Amb28320107 [0,1,0,1,0,0|1,0,1]=4 15173 B9R1.79 C\C(=C/C1CCC1)CO Amb27838424 [0,1,0,1,0,0|0,0,2]=4 15174 B9R1.79 C\C(C=O)=C/C1CCC1 Amb27589239 [0,1,0,1,0,0|0,0,1]=3 15175 B9R1.79 C\C(CC1CCC1)=N/O Amb27845830 [0,1,0,1,0,0|0,0,1]=3 15176 B9R1.79 NC(CO)CC1CCC1 Amb32660961 [0,1,0,1,0,0|1,0,1]=4 15177 B9R1.79 NC(CO)CC1CCC1 Amb33548648 [0,1,0,1,0,0|1,0,1]=4 15178 B9R1.79 NCC(=O)CC1CCC1 Amb24680522 [0,1,0,1,0,0|0,0,0]=2 15179 B9R1.79 NCC(=O)NC1CCC1 Amb18961312 [0,1,0,1,0,0|1,0,0]=3 15180 B9R1.79 NCC(=O)NC1CCC1 Amb33465458 [0,1,0,1,0,0|1,0,0]=3 15181 B9R1.79 NCC(=O)NC1CNC1 Amb28049776 [0,1,0,1,0,0|2,0,0]=4 15182 B9R1.79 NCC(=O)OC1CCC1 Amb18295938 [0,1,0,1,0,0|1,0,0]=3 15183 B9R1.79 NCC(F)CC1CCC1 Amb31291552 [0,1,0,1,0,0|1,0,1]=4 15184 B9R1.79 NCC(O)CC1CCC1 Amb33195517 [0,1,0,1,0,0|0,0,2]=4 15185 B9R1.79 NNC(=O)CC1CNC1 Amb28119058 [0,1,0,1,0,0|2,0,0]=4 15186 B9R1.79 NNC(=O)CC1COC1 Amb27667145 [0,1,0,1,0,0|2,0,0]=4 15187 B9R1.79 NNC(=O)OC1CCC1 Amb35699045 [0,1,0,1,0,0|2,0,0]=4 15188 B9R1.79 N[C@@H](CO)CC1CCC1 Amb28199933 [0,1,0,1,0,0|1,0,1]=4 15189 B9R1.79 N[C@H](CO)CC1CCC1 Amb26547301 [0,1,0,1,0,0|1,0,1]=4 15190 B9R1.79 N\C(CC1CCC1)=N/O Amb24479922 [0,1,0,1,0,0|1,0,1]=4 15191 B9R1.79 O=C(CBr)CC1CCC1 Amb24392754 [0,1,0,1,0,0|0,0,0]=2 15192 B9R1.79 O=C(CBr)OC1CCC1 Amb28146076 [0,1,0,1,0,0|1,0,0]=3 15193 B9R1.79 O=C(CCl)OC1CNC1 Amb21956162 [0,1,0,1,0,0|2,0,0]=4 15194 B9R1.79 O=C(CCl)OC1CNC1 Amb33803853 [0,1,0,1,0,0|2,0,0]=4 15195 B9R1.79 O=C(CCl)OC1CSC1 Amb27494803 [0,1,0,1,0,0|2,0,0]=4 15196 B9R1.79 O=C(CN1CCC1)NO Amb28189204 [0,1,0,1,0,0|2,0,0]=4 15197 B9R1.79 O=C(CO)OC1CCC1 Amb25802506 [0,1,0,1,0,0|1,0,0]=3 15198 B9R1.79 O=C(CS)OC1CCC1 Amb28381311 [0,1,0,1,0,0|1,0,0]=3 15199 B9R1.80 C#CC(=O)CNC1CC1 Amb25930248 [0,1,0,1,0,0|1,0,1]=4 15200 B9R1.80 C=CC(=O)CCC1CC1 Amb28241113 [0,1,0,1,0,0|0,0,1]=3 15201 B9R1.80 C=CC(=O)CNC1CC1 Amb25369017 [0,1,0,1,0,0|1,0,1]=4 15202 B9R1.80 CC(CN)CCC1CC1 Amb24481956 [0,1,0,1,0,0|1,0,1]=4 15203 B9R1.80 CC(CO)CCC1CC1 Amb33749212 [0,1,0,1,0,0|0,0,2]=4 15204 B9R1.80 CCC(=O)C#CC1CC1 Amb27838687 [0,1,0,1,0,0|0,0,2]=4 15205 B9R1.80 CCC(=O)CNC1CC1 Amb25245788 [0,1,0,1,0,0|1,0,0]=3 15206 B9R1.80 CCC(=O)OCC1CO1 Amb28123280 [0,1,0,1,0,0|2,0,0]=4 15207 B9R1.80 CCC(Br)CCC1CC1 Amb27448483 [0,1,0,1,0,0|1,0,1]=4 15208 B9R1.80 CCC(Cl)CCC1CC1 Amb27807280 [0,1,0,1,0,0|1,0,1]=4 15209 B9R1.80 CCS(=O)CCC1CO1 Amb27956481 [0,1,0,1,0,0|2,0,0]=4 15210 B9R1.80 CC[C@H](O)CCC1CC1 Amb27192177 [0,1,0,1,0,0|0,0,2]=4 15211 B9R1.80 CN(C#N)CCC1CC1 Amb27604893 [0,1,0,1,0,0|2,0,0]=4 15212 B9R1.80 CN(C=O)CCC1CC1 Amb27772099 [0,1,0,1,0,0|1,0,0]=3 15213 B9R1.80 CNC(=N)NCC1CC1 Amb27199538 [0,1,0,1,0,0|2,0,0]=4 15214 B9R1.80 CNC(=O)CCC1CC1 Amb27197385 [0,1,0,1,0,0|0,0,0]=2 15215 B9R1.80 CNC(=O)\C=C\C1CC1 Amb27770566 [0,1,0,1,0,0|0,0,2]=4 15216 B9R1.80 COC(=O)C#CC1CC1 Amb1036567 [0,1,0,1,0,0|0,0,2]=4 15217 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [0,1,0,1,0,0|1,0,0]=3 15218 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,0]=3 15219 B9R1.80 COC(=O)CNC1CC1 Amb6706354 [0,1,0,1,0,0|1,0,0]=3 15220 B9R1.80 COC(=O)CSC1CC1 Amb6760569 [0,1,0,1,0,0|1,0,0]=3 15221 B9R1.80 COC(=O)\C=C\C1CC1 Amb33986066 [0,1,0,1,0,0|0,0,2]=4 15222 B9R1.80 COC(=S)SCC1CC1 Amb27262158 [0,1,0,1,0,0|1,1,0]=4 15223 B9R1.80 CON(C)CCC1CC1 Amb28064552 [0,1,0,1,0,0|1,0,1]=4 15224 B9R1.80 C[C@@H](CN)CCC1CC1 Amb33744963 [0,1,0,1,0,0|1,0,1]=4 15225 B9R1.80 C[C@@H](CO)CCC1CC1 Amb33747154 [0,1,0,1,0,0|0,0,2]=4 15226 B9R1.80 C[C@H](CN)CCC1CC1 Amb33748019 [0,1,0,1,0,0|1,0,1]=4 15227 B9R1.80 C[C@H](CO)CCC1CC1 Amb33748163 [0,1,0,1,0,0|0,0,2]=4 15228 B9R1.80 C\C=C(\C)CNC1CC1 Amb28398879 [0,1,0,1,0,0|2,0,0]=4 15229 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,1]=4 15230 B9R1.80 NCC(=O)CCC1CC1 Amb25245782 [0,1,0,1,0,0|0,0,0]=2 15231 B9R1.80 NCC(=O)CCC1CO1 Amb33307827 [0,1,0,1,0,0|1,0,0]=3 15232 B9R1.80 NCC(=O)CNC1CC1 Amb28130064 [0,1,0,1,0,0|1,0,0]=3 15233 B9R1.80 NCC(=O)NCC1CC1 Amb30585150 [0,1,0,1,0,0|1,0,0]=3 15234 B9R1.80 NCC(=O)NCC1CC1 Amb6271968 [0,1,0,1,0,0|1,0,0]=3 15235 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|1,0,0]=3 15236 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|1,0,0]=3 15237 B9R1.80 NCC(N)CCC1CC1 Amb27848173 [0,1,0,1,0,0|1,0,1]=4 15238 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|0,0,2]=4 15239 B9R1.80 NNC(=O)NCC1CC1 Amb8854046 [0,1,0,1,0,0|2,0,0]=4 15240 B9R1.80 N\C(CCC1CC1)=N/O Amb25848987 [0,1,0,1,0,0|1,0,1]=4 15241 B9R1.80 N\N=C(/N)CCC1CC1 Amb27192178 [0,1,0,1,0,0|2,0,0]=4 15242 B9R1.80 O=C(CBr)NCC1CC1 Amb22059289 [0,1,0,1,0,0|1,0,0]=3 15243 B9R1.80 O=C(CCC1CC1)NO Amb28248660 [0,1,0,1,0,0|1,0,0]=3 15244 B9R1.80 O=C(CCl)CCC1CC1 Amb27779850 [0,1,0,1,0,0|0,0,0]=2 15245 B9R1.80 O=C(CCl)NCC1CC1 Amb2785974 [0,1,0,1,0,0|1,0,0]=3 15246 B9R1.80 O=C(CCl)OCC1CC1 Amb32416286 [0,1,0,1,0,0|1,0,0]=3 15247 B9R1.80 O=C(CI)NCC1CC1 Amb24660173 [0,1,0,1,0,0|1,0,0]=3 15248 B9R1.80 O=C(CNC1CC1)NO Amb27395406 [0,1,0,1,0,0|2,0,0]=4 15249 B9R1.80 O=C(CO)OCC1CC1 Amb27806245 [0,1,0,1,0,0|1,0,0]=3 15250 B9R1.80 O=C(CS)OCC1CC1 Amb28457833 [0,1,0,1,0,0|1,0,0]=3 15251 B9R1.80 OCC(O)CCC1CC1 Amb27444259 [0,1,0,1,0,0|0,0,2]=4 15252 B9R1.80 O\N=C(/Cl)CCC1CC1 Amb27861367 [0,1,0,1,0,0|1,0,1]=4 15253 B9R1.81 CC1CCC1C(=O)CN Amb33512104 [0,1,0,1,0,0|0,0,0]=2 15254 B9R1.81 CC1CCC1C(O)CN Amb33512108 [0,1,0,1,0,0|0,0,2]=4 15255 B9R1.81 CCC(Cl)C1CCC1C Amb28201338 [0,1,0,1,0,0|1,0,1]=4 15256 B9R1.81 COC(=O)C1CCC1=O Amb26937068 [0,1,0,1,0,0|1,0,1]=4 15257 B9R1.81 COC(=O)C1CCC1C Amb25110041 [0,1,0,1,0,0|0,0,0]=2 15258 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,1,0,0|1,0,0]=3 15259 B9R1.81 COC(=O)C1CCC1N Amb32664922 [0,1,0,1,0,0|1,0,0]=3 15260 B9R1.81 COC(=O)C1CCN1C Amb26545071 [0,1,0,1,0,0|1,0,0]=3 15261 B9R1.81 COC(=O)C1CNC1C Amb30594216 [0,1,0,1,0,0|1,0,0]=3 15262 B9R1.81 COC(=O)C1NCC1C Amb28070582 [0,1,0,1,0,0|1,0,0]=3 15263 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,1,0,0|1,0,0]=3 15264 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,1,0,0|1,0,0]=3 15265 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb30633597 [0,1,0,1,0,0|1,0,0]=3 15266 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33714361 [0,1,0,1,0,0|1,0,0]=3 15267 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb33719044 [0,1,0,1,0,0|1,0,0]=3 15268 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb27617550 [0,1,0,1,0,0|1,0,0]=3 15269 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Amb33719045 [0,1,0,1,0,0|1,0,0]=3 15270 B9R1.81 COC(=O)[C@@H]1CN[C@H]1C Amb34913691 [0,1,0,1,0,0|1,0,0]=3 15271 B9R1.81 COC(=O)[C@H]1CC[C@H]1C Amb25919237 [0,1,0,1,0,0|0,0,0]=2 15272 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,1,0,0|1,0,0]=3 15273 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb34144031 [0,1,0,1,0,0|1,0,0]=3 15274 B9R1.88 C#CC(=O)C1CC1CN Amb33132448 [0,1,0,1,0,0|1,0,1]=4 15275 B9R1.88 C#CC(=O)C1CC1OC Amb35717361 [0,1,0,1,0,0|1,0,1]=4 15276 B9R1.88 C#CC(=O)[C@@H]1C[C@@H]1CN Amb33132470 [0,1,0,1,0,0|1,0,1]=4 15277 B9R1.88 C#CC(=O)[C@@H]1C[C@H]1CC Amb27860527 [0,1,0,1,0,0|0,0,1]=3 15278 B9R1.88 C#CC1CC1C(=O)OC Amb27613668 [0,1,0,1,0,0|0,0,2]=4 15279 B9R1.88 C#C[C@@H]1C[C@H]1C(=O)OC Amb26547720 [0,1,0,1,0,0|0,0,2]=4 15280 B9R1.88 C#C[C@H]1C[C@H]1C(=O)OC Amb25861951 [0,1,0,1,0,0|0,0,2]=4 15281 B9R1.88 C=CC(=O)C1CC1CN Amb33132449 [0,1,0,1,0,0|1,0,1]=4 15282 B9R1.88 C=CC(=O)C1CC1OC Amb35717362 [0,1,0,1,0,0|1,0,1]=4 15283 B9R1.88 C=CC(=O)[C@@H]1C[C@@H]1CN Amb33132471 [0,1,0,1,0,0|1,0,1]=4 15284 B9R1.88 C=C[C@@H]1C[C@H]1C(=O)OC Amb28435247 [0,1,0,1,0,0|0,0,2]=4 15285 B9R1.88 CCC(=O)C1CC1CN Amb33132450 [0,1,0,1,0,0|1,0,0]=3 15286 B9R1.88 CCC(=O)[C@@H]1C[C@@H]1CN Amb33132472 [0,1,0,1,0,0|1,0,0]=3 15287 B9R1.88 CCC(=O)[C@@H]1C[C@H]1CC Amb27261616 [0,1,0,1,0,0|0,0,0]=2 15288 B9R1.88 CCC1=NC1C(=O)OC Amb33803384 [0,1,0,1,0,0|1,0,1]=4 15289 B9R1.88 CCC1CC1C(=O)CBr Amb27250951 [0,1,0,1,0,0|0,0,0]=2 15290 B9R1.88 CCC1CC1C(=O)NO Amb28320567 [0,1,0,1,0,0|1,0,0]=3 15291 B9R1.88 CCC1CC1C(C)NC Amb28056518 [0,1,0,1,0,0|1,0,1]=4 15292 B9R1.88 CCC1CC1\C(N)=N\O Amb27205098 [0,1,0,1,0,0|1,0,1]=4 15293 B9R1.88 CC[C@@H]1C[C@H]1C(=O)OC Amb27228248 [0,1,0,1,0,0|0,0,0]=2 15294 B9R1.88 CC[C@@H]1C[C@H]1C(C)NC Amb27976291 [0,1,0,1,0,0|1,0,1]=4 15295 B9R1.88 CNC(=O)C1CC1OC Amb29849691 [0,1,0,1,0,0|1,0,0]=3 15296 B9R1.88 COC(=O)C1CC1C#N Amb27262472 [0,1,0,1,0,0|1,0,1]=4 15297 B9R1.88 COC(=O)C1CC1C=O Amb24480363 [0,1,0,1,0,0|1,0,1]=4 15298 B9R1.88 COC(=O)C1CC1CN Amb22011650 [0,1,0,1,0,0|1,0,0]=3 15299 B9R1.88 COC(=O)C1CC1CN Amb22546318 [0,1,0,1,0,0|1,0,0]=3 15300 B9R1.88 COC(=O)C1CC1CO Amb25185377 [0,1,0,1,0,0|1,0,0]=3 15301 B9R1.88 COC(=O)C1CC1OC Amb35717357 [0,1,0,1,0,0|1,0,0]=3 15302 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CBr Amb27489818 [0,1,0,1,0,0|1,0,0]=3 15303 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CN Amb22900923 [0,1,0,1,0,0|1,0,0]=3 15304 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CN Amb28468178 [0,1,0,1,0,0|1,0,0]=3 15305 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO Amb24575289 [0,1,0,1,0,0|1,0,0]=3 15306 B9R1.88 COC(=O)[C@@H]1C[C@H]1C=O Amb27489067 [0,1,0,1,0,0|1,0,1]=4 15307 B9R1.88 COC(=O)[C@@H]1C[C@H]1CBr Amb35789287 [0,1,0,1,0,0|1,0,0]=3 15308 B9R1.88 COC(=O)[C@@H]1C[C@H]1CN Amb24517267 [0,1,0,1,0,0|1,0,0]=3 15309 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO Amb26035468 [0,1,0,1,0,0|1,0,0]=3 15310 B9R1.88 COC(=O)[C@H]1C[C@@H]1CO Amb27451981 [0,1,0,1,0,0|1,0,0]=3 15311 B9R1.88 COC(=O)[C@H]1C[C@H]1C#N Amb28287469 [0,1,0,1,0,0|1,0,1]=4 15312 B9R1.88 COC(=O)[C@H]1C[C@H]1C=O Amb27265977 [0,1,0,1,0,0|1,0,1]=4 15313 B9R1.88 COC(=O)[C@H]1O[C@@H]1CO Amb8628624 [0,1,0,1,0,0|2,0,0]=4 15314 B9R1.88 COC1CC1C(=O)CBr Amb35717552 [0,1,0,1,0,0|1,0,0]=3 15315 B9R1.88 COC1CC1C(=O)CCl Amb35717551 [0,1,0,1,0,0|1,0,0]=3 15316 B9R1.88 COC1CC1C(=O)CN Amb29857500 [0,1,0,1,0,0|1,0,0]=3 15317 B9R1.88 COC1CC1C(=O)NN Amb35732137 [0,1,0,1,0,0|2,0,0]=4 15318 B9R1.88 COC1CC1C(=O)NO Amb35725289 [0,1,0,1,0,0|2,0,0]=4 15319 B9R1.88 NNC(=O)[C@@H]1C[C@@H]1CO Amb27207426 [0,1,0,1,0,0|2,0,0]=4 15320 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|1,0,1]=4 15321 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [0,1,0,1,0,0|1,0,1]=4 15322 B9R1.89 C#CC1CCCCCC1 Amb25277452 [0,1,0,1,0,0|1,0,1]=4 15323 B9R1.89 C=CC1=CCCCCC1 Amb28245546 [0,1,0,1,0,0|1,0,1]=4 15324 B9R1.89 C=CC1CCCCCC1 Amb25068667 [0,1,0,1,0,0|1,0,1]=4 15325 B9R1.89 C=NN1CCCCCC1 Amb27495411 [0,1,0,1,0,0|2,0,0]=4 15326 B9R1.89 CCC1=NCCCCN1 Amb27627181 [0,1,0,1,0,0|2,0,0]=4 15327 B9R1.89 CCC1CCCCCC1 Amb26390826 [0,1,0,1,0,0|1,0,1]=4 15328 B9R1.89 CCC1CCCCCN1 Amb3788103 [0,1,0,1,0,0|1,0,1]=4 15329 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|2,0,0]=4 15330 B9R1.89 CC[C@@H]1CCCCCN1 Amb28136573 [0,1,0,1,0,0|1,0,1]=4 15331 B9R1.89 CC[C@H]1CCCCCN1 Amb27459025 [0,1,0,1,0,0|1,0,1]=4 15332 B9R1.89 CNC1=NCCCCC1 Amb4136374 [0,1,0,1,0,0|1,0,0]=3 15333 B9R1.89 CNC1=NCCCCN1 Amb30035889 [0,1,0,1,0,0|2,0,0]=4 15334 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|1,0,1]=4 15335 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|1,0,1]=4 15336 B9R1.89 CNN1CCCCCC1 Amb27241215 [0,1,0,1,0,0|2,0,0]=4 15337 B9R1.89 COC1=CCCCCC1 Amb26014503 [0,1,0,1,0,0|1,0,0]=3 15338 B9R1.89 COC1=NCCCCC1 Amb2726213 [0,1,0,1,0,0|1,0,0]=3 15339 B9R1.89 COC1=NCCCNC1 Amb33218438 [0,1,0,1,0,0|2,0,0]=4 15340 B9R1.89 COC1=NCCNCC1 Amb33218466 [0,1,0,1,0,0|2,0,0]=4 15341 B9R1.89 COC1=NCCOCC1 Amb32666999 [0,1,0,1,0,0|2,0,0]=4 15342 B9R1.89 COC1CCCCCN1 Amb33128038 [0,1,0,1,0,0|1,0,1]=4 15343 B9R1.89 CSC1=CCCCCN1 Amb27395313 [0,1,0,1,0,0|1,0,1]=4 15344 B9R1.89 CSC1=NCCCCC1 Amb24514736 [0,1,0,1,0,0|1,0,0]=3 15345 B9R1.89 ClCC1=NCCCCN1 Amb27814740 [0,1,0,1,0,0|2,0,0]=4 15346 B9R1.89 ClCC1CCCCCC1 Amb26317790 [0,1,0,1,0,0|1,0,1]=4 15347 B9R1.89 ClCC1CCCCCN1 Amb26567233 [0,1,0,1,0,0|1,0,1]=4 15348 B9R1.89 ClCC1CCCCCN1 Amb32665018 [0,1,0,1,0,0|1,0,1]=4 15349 B9R1.89 Cl\N=C1/CCCCCN1 Amb26909444 [0,1,0,1,0,0|2,0,0]=4 15350 B9R1.89 FCC1CCCCCN1 Amb28129640 [0,1,0,1,0,0|1,0,1]=4 15351 B9R1.89 ICC1CCCCCC1 Amb27596090 [0,1,0,1,0,0|1,0,1]=4 15352 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|0,0,2]=4 15353 B9R1.89 N#CC1=CCCCCC1 Amb4016990 [0,1,0,1,0,0|1,0,1]=4 15354 B9R1.89 N#CC1CCCCCC1 Amb2721571 [0,1,0,1,0,0|1,0,1]=4 15355 B9R1.89 N#CN1CCCCCC1 Amb26484170 [0,1,0,1,0,0|2,0,0]=4 15356 B9R1.89 N=CN1CCCCCC1 Amb27491659 [0,1,0,1,0,0|2,0,0]=4 15357 B9R1.89 NCC1=CCCCCC1 Amb27403312 [0,1,0,1,0,0|1,0,0]=3 15358 B9R1.89 NCC1=NCCCCN1 Amb27216713 [0,1,0,1,0,0|2,0,0]=4 15359 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|1,0,1]=4 15360 B9R1.89 NCC1CCCCCC1 Amb8943673 [0,1,0,1,0,0|1,0,1]=4 15361 B9R1.89 NCC1CCCCCN1 Amb26045142 [0,1,0,1,0,0|1,0,1]=4 15362 B9R1.89 NN=C1CCCCCC1 Amb28193088 [0,1,0,1,0,0|1,0,0]=3 15363 B9R1.89 NNC1=NCCCCC1 Amb17593334 [0,1,0,1,0,0|2,0,0]=4 15364 B9R1.89 NNC1CCCCCC1 Amb19373178 [0,1,0,1,0,0|1,0,1]=4 15365 B9R1.89 NNC1CCCCCC1 Amb22227928 [0,1,0,1,0,0|1,0,1]=4 15366 B9R1.89 NNC1CCCCCC1 Amb6251286 [0,1,0,1,0,0|1,0,1]=4 15367 B9R1.89 N\N=C1/CCCOCC1 Amb27196684 [0,1,0,1,0,0|2,0,0]=4 15368 B9R1.89 N\N=C1/CCCSCC1 Amb35712537 [0,1,0,1,0,0|2,0,0]=4 15369 B9R1.89 O=CC1=CCCCCC1 Amb9790320 [0,1,0,1,0,0|0,0,1]=3 15370 B9R1.89 O=CC1CCCCCC1 Amb9786985 [0,1,0,1,0,0|0,0,1]=3 15371 B9R1.89 O=CC1CCCOCC1 Amb18832626 [0,1,0,1,0,0|1,0,1]=4 15372 B9R1.89 O=CC1CCCSCC1 Amb18202390 [0,1,0,1,0,0|1,0,1]=4 15373 B9R1.89 O=CN1CCCNCC1 Amb1155085 [0,1,0,1,0,0|2,0,0]=4 15374 B9R1.89 O=NN1CCCCCC1 Amb22230749 [0,1,0,1,0,0|1,0,0]=3 15375 B9R1.89 O=S=C1CCCCCN1 Amb28313706 [0,1,0,1,0,0|1,0,0]=3 15376 B9R1.89 OCC1=CCCCCC1 Amb27424682 [0,1,0,1,0,0|1,0,0]=3 15377 B9R1.89 OCC1=NCCCCN1 Amb27866719 [0,1,0,1,0,0|2,0,0]=4 15378 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|0,0,2]=4 15379 B9R1.89 OCC1CCCCCC1 Amb34916703 [0,1,0,1,0,0|0,0,2]=4 15380 B9R1.89 OCC1CCCCCN1 Amb33551226 [0,1,0,1,0,0|1,0,1]=4 15381 B9R1.89 OCC1CCCCCN1 Amb8009310 [0,1,0,1,0,0|1,0,1]=4 15382 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,2]=4 15383 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|1,0,1]=4 15384 B9R1.89 ON=C1CCCCCC1 Amb7969725 [0,1,0,1,0,0|0,0,1]=3 15385 B9R1.89 O\N=C1/CCCCCN1 Amb19894798 [0,1,0,1,0,0|1,0,1]=4 15386 B9R1.89 O\N=C1/CCCNCC1 Amb20243362 [0,1,0,1,0,0|1,0,1]=4 15387 B9R1.89 O\N=C1/CCCOCC1 Amb25147029 [0,1,0,1,0,0|1,0,1]=4 15388 B9R1.89 O\N=C1/CCCSCC1 Amb35692766 [0,1,0,1,0,0|1,0,1]=4 15389 B9R1.89 O\N=C1\CCCCCN1 Amb1107240 [0,1,0,1,0,0|1,0,1]=4 15390 B9R1.89 SCC1CCCCCC1 Amb25960657 [0,1,0,1,0,0|0,1,1]=4 15391 B9R1.89 SCN1CCCCCC1 Amb26499104 [0,1,0,1,0,0|1,1,0]=4 15392 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [0,1,0,1,0,0|1,0,1]=4 15393 B9R1.97 CCC1CCC1(C)CO Amb27947036 [0,1,0,1,0,0|0,0,2]=4 15394 B9R1.99 CCCCCC1(C)CO1 Amb27760064 [0,1,0,1,0,0|0,0,2]=4 15395 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|1,0,1]=4 15396 B9R1.99 CCCCCC1(O)CC1 Amb27218085 [0,1,0,1,0,0|0,0,2]=4 15397 B9R1.118 C#CC1(C)CCCCC1 Amb21963029 [0,1,0,1,0,0|1,0,1]=4 15398 B9R1.118 C=CC1(C)CCCCC1 Amb24376596 [0,1,0,1,0,0|1,0,1]=4 15399 B9R1.118 CC1(C#N)CCCCC1 Amb18642140 [0,1,0,1,0,0|1,0,1]=4 15400 B9R1.118 CC1(C=O)CCCCC1 Amb10070781 [0,1,0,1,0,0|0,0,1]=3 15401 B9R1.118 CC1(C=O)CCCCO1 Amb24627620 [0,1,0,1,0,0|1,0,1]=4 15402 B9R1.118 CC1(C=O)CCCOC1 Amb25082506 [0,1,0,1,0,0|1,0,1]=4 15403 B9R1.118 CC1(C=O)CCOCC1 Amb19516695 [0,1,0,1,0,0|1,0,1]=4 15404 B9R1.118 CC1(C=O)CCSCC1 Amb25108539 [0,1,0,1,0,0|1,0,1]=4 15405 B9R1.118 CC1(CBr)CCCCC1 Amb8630706 [0,1,0,1,0,0|1,0,1]=4 15406 B9R1.118 CC1(CCl)CCCCC1 Amb8630740 [0,1,0,1,0,0|1,0,1]=4 15407 B9R1.118 CC1(CN)CCCCC1 Amb20632204 [0,1,0,1,0,0|1,0,1]=4 15408 B9R1.118 CC1(CN)CCCCC1 Amb8630346 [0,1,0,1,0,0|1,0,1]=4 15409 B9R1.118 CC1(CO)CCCCC1 Amb2694689 [0,1,0,1,0,0|0,0,2]=4 15410 B9R1.118 CC1(CS)CCCCC1 Amb24572456 [0,1,0,1,0,0|0,1,1]=4 15411 B9R1.118 CC1(NN)CCCCC1 Amb25068508 [0,1,0,1,0,0|1,0,1]=4 15412 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|1,0,1]=4 15413 B9R1.118 CCC1(Cl)CCCCC1 Amb4017937 [0,1,0,1,0,0|1,0,1]=4 15414 B9R1.118 CCC1(N)CCCCC1 Amb33552085 [0,1,0,1,0,0|1,0,1]=4 15415 B9R1.118 CCC1(N)CCCCC1 Amb9676113 [0,1,0,1,0,0|1,0,1]=4 15416 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|0,0,2]=4 15417 B9R1.118 CCP1(=O)CCNCC1 Amb27461017 [0,1,0,1,0,0|2,0,0]=4 15418 B9R1.118 CCP1(=O)CCNCC1 Amb32992768 [0,1,0,1,0,0|2,0,0]=4 15419 B9R1.118 CC[N+]1(C)CCCCC1 Amb22353723 [0,1,0,1,0,0|2,0,0]=4 15420 B9R1.118 CNC1(C)CCCCC1 Amb18946302 [0,1,0,1,0,0|1,0,1]=4 15421 B9R1.118 C[N+]1(CCl)CCCCC1 Amb2611883 [0,1,0,1,0,0|2,0,0]=4 15422 B9R1.118 FC1(CBr)CCCCC1 Amb26022122 [0,1,0,1,0,0|1,0,1]=4 15423 B9R1.118 NC1(CF)CCCCC1 Amb25951307 [0,1,0,1,0,0|1,0,1]=4 15424 B9R1.118 NC1(CO)CCCCC1 Amb10608249 [0,1,0,1,0,0|1,0,1]=4 15425 B9R1.118 NC1(CO)CCCCC1 Amb8631827 [0,1,0,1,0,0|1,0,1]=4 15426 B9R1.118 NCC1(Br)CCCCC1 Amb26994516 [0,1,0,1,0,0|1,0,1]=4 15427 B9R1.118 NCC1(Br)CCCCC1 Amb31217494 [0,1,0,1,0,0|1,0,1]=4 15428 B9R1.118 NCC1(Cl)CCCCC1 Amb26892840 [0,1,0,1,0,0|1,0,1]=4 15429 B9R1.118 NCC1(Cl)CCCCC1 Amb32651842 [0,1,0,1,0,0|1,0,1]=4 15430 B9R1.118 NCC1(F)CCCCC1 Amb22174148 [0,1,0,1,0,0|1,0,1]=4 15431 B9R1.118 NCC1(F)CCCCC1 Amb22887010 [0,1,0,1,0,0|1,0,1]=4 15432 B9R1.118 NCC1(N)CCCCC1 Amb2371826 [0,1,0,1,0,0|1,0,1]=4 15433 B9R1.118 NCC1(N)CCCCC1 Amb520873 [0,1,0,1,0,0|1,0,1]=4 15434 B9R1.118 NCC1(O)CCCCC1 Amb1108364 [0,1,0,1,0,0|0,0,2]=4 15435 B9R1.118 NCC1(O)CCCCC1 Amb2720241 [0,1,0,1,0,0|0,0,2]=4 15436 B9R1.118 NCC1(O)CCCCC1 Amb33513047 [0,1,0,1,0,0|0,0,2]=4 15437 B9R1.118 NCC1(S)CCCCC1 Amb27842428 [0,1,0,1,0,0|0,1,1]=4 15438 B9R1.118 O=CC1(Br)CCCCC1 Amb17594982 [0,1,0,1,0,0|1,0,1]=4 15439 B9R1.118 O=CC1(Cl)CCCCC1 Amb17593665 [0,1,0,1,0,0|1,0,1]=4 15440 B9R1.118 O=NC1(Cl)CCCCC1 Amb26047709 [0,1,0,1,0,0|1,0,1]=4 15441 B9R1.118 OC1(CBr)CCCCC1 Amb23597825 [0,1,0,1,0,0|0,0,2]=4 15442 B9R1.118 OC1(CI)CCCCC1 Amb27628298 [0,1,0,1,0,0|0,0,2]=4 15443 B9R1.118 OCC1(Cl)CCCCC1 Amb27804982 [0,1,0,1,0,0|1,0,1]=4 15444 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|1,0,1]=4 15445 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|0,0,2]=4 15446 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|0,1,1]=4 15447 B9R1.118 [C-]#[N+]C1(C)CCCCC1 Amb33318912 [0,1,0,1,0,0|1,0,1]=4 15448 B9R1.132 C=C1CCN(CC)C1=O Amb27645161 [0,1,0,1,0,0|1,0,1]=4 15449 B9R1.132 C=CC1CCC(=O)C1C Amb28253911 [0,1,0,1,0,0|0,0,2]=4 15450 B9R1.132 C=CC1CCC(=O)C1Cl Amb28245225 [0,1,0,1,0,0|0,0,2]=4 15451 B9R1.132 C=CC1CCC(=O)C1O Amb28285294 [0,1,0,1,0,0|0,0,2]=4 15452 B9R1.132 C=CC1CCC(=O)N1C Amb25146894 [0,1,0,1,0,0|0,0,2]=4 15453 B9R1.132 C=C[C@@H]1CCC(=O)[C@H]1C Amb27880593 [0,1,0,1,0,0|0,0,2]=4 15454 B9R1.132 C=C[C@H]1CCC(=O)N1C Amb27862427 [0,1,0,1,0,0|0,0,2]=4 15455 B9R1.132 CC1C(=O)CNC1CO Amb27629033 [0,1,0,1,0,0|2,0,0]=4 15456 B9R1.132 CC1C(=O)OCC1CO Amb27853141 [0,1,0,1,0,0|2,0,0]=4 15457 B9R1.132 CC1CCC(CO)C1=O Amb27486136 [0,1,0,1,0,0|1,0,1]=4 15458 B9R1.132 CCC1=C(C)C(=O)NC1 Amb27442204 [0,1,0,1,0,0|1,0,1]=4 15459 B9R1.132 CCC1=C(O)C(=O)CC1 Amb2695590 [0,1,0,1,0,0|0,0,2]=4 15460 B9R1.132 CCC1CCC(C)N1C Amb27604766 [0,1,0,1,0,0|1,0,1]=4 15461 B9R1.132 CCC1CCC(Cl)C1C Amb27656345 [0,1,0,1,0,0|1,0,1]=4 15462 B9R1.132 CCC1CCC(N)C1C Amb27654008 [0,1,0,1,0,0|1,0,1]=4 15463 B9R1.132 CCC1CNC(=O)N1C Amb25834141 [0,1,0,1,0,0|1,0,0]=3 15464 B9R1.132 CCC1COC(=O)C1N Amb28285145 [0,1,0,1,0,0|1,0,0]=3 15465 B9R1.132 CCC1NNC(=O)C1C Amb35686093 [0,1,0,1,0,0|2,0,0]=4 15466 B9R1.132 CC[C@@H]1CCC(=O)[C@@H]1Br Amb28141200 [0,1,0,1,0,0|0,0,0]=2 15467 B9R1.132 CC[C@@H]1CCC(=O)[C@H]1Br Amb27865613 [0,1,0,1,0,0|0,0,0]=2 15468 B9R1.132 CC[C@@H]1CC[C@H](C)C1=O Amb28052450 [0,1,0,1,0,0|0,0,1]=3 15469 B9R1.132 CC[C@@H]1COC(=O)N1C Amb25736752 [0,1,0,1,0,0|1,0,0]=3 15470 B9R1.132 CC[C@@H]1COC(=O)[C@H]1N Amb28345688 [0,1,0,1,0,0|1,0,0]=3 15471 B9R1.132 CN1C(=O)CCC1C#N Amb28291467 [0,1,0,1,0,0|1,0,1]=4 15472 B9R1.132 CN1C(=O)CCC1C=O Amb24725330 [0,1,0,1,0,0|1,0,1]=4 15473 B9R1.132 CN1C(=O)CCC1CBr Amb23597461 [0,1,0,1,0,0|1,0,0]=3 15474 B9R1.132 CN1C(=O)CCC1CCl Amb25757771 [0,1,0,1,0,0|1,0,0]=3 15475 B9R1.132 CN1C(=O)CCC1CN Amb22587696 [0,1,0,1,0,0|1,0,0]=3 15476 B9R1.132 CN1C(=O)CCC1CN Amb8010546 [0,1,0,1,0,0|1,0,0]=3 15477 B9R1.132 CN1C(=O)CCC1CO Amb26447781 [0,1,0,1,0,0|1,0,0]=3 15478 B9R1.132 CN1C(=O)CC[C@@H]1CN Amb26516005 [0,1,0,1,0,0|1,0,0]=3 15479 B9R1.132 CN1C(=O)CC[C@@H]1CO Amb25032258 [0,1,0,1,0,0|1,0,0]=3 15480 B9R1.132 CN1C(=O)CC[C@H]1CN Amb31291429 [0,1,0,1,0,0|1,0,0]=3 15481 B9R1.132 CN1C(=O)OCC1CN Amb26030449 [0,1,0,1,0,0|2,0,0]=4 15482 B9R1.132 CN1C(=O)OCC1CO Amb22504497 [0,1,0,1,0,0|2,0,0]=4 15483 B9R1.132 CN1CCC(CBr)C1=O Amb28318638 [0,1,0,1,0,0|2,0,0]=4 15484 B9R1.132 CN1CCC(CI)C1=O Amb35723927 [0,1,0,1,0,0|2,0,0]=4 15485 B9R1.132 CN1CCC(CN)C1=O Amb30982588 [0,1,0,1,0,0|2,0,0]=4 15486 B9R1.132 CN1CCC(CN)C1=O Amb33550142 [0,1,0,1,0,0|2,0,0]=4 15487 B9R1.132 CN1CCC(CO)C1=O Amb22236004 [0,1,0,1,0,0|2,0,0]=4 15488 B9R1.132 CN1CCC(CS)C1=O Amb35686181 [0,1,0,1,0,0|2,0,0]=4 15489 B9R1.132 CNC1=C(C)C(=O)CC1 Amb25146177 [0,1,0,1,0,0|1,0,1]=4 15490 B9R1.132 CNC1CCN(C)C1=O Amb18945539 [0,1,0,1,0,0|2,0,0]=4 15491 B9R1.132 CNC1CCN(C)C1=O Amb33550373 [0,1,0,1,0,0|2,0,0]=4 15492 B9R1.132 COC1CCC(=O)N1C Amb32668362 [0,1,0,1,0,0|1,0,0]=3 15493 B9R1.132 COC1CCC(C)=C1Br Amb25147063 [0,1,0,1,0,0|2,0,0]=4 15494 B9R1.132 CO[C@H]1COC(=O)[C@@H]1O Amb27432154 [0,1,0,1,0,0|2,0,0]=4 15495 B9R1.132 C[C@@H]1C(=O)OC[C@H]1CO Amb28065887 [0,1,0,1,0,0|2,0,0]=4 15496 B9R1.132 C[C@H]1C(=O)NC[C@@H]1CO Amb27805447 [0,1,0,1,0,0|2,0,0]=4 15497 B9R1.132 NC1C(=O)NCC1CF Amb27663222 [0,1,0,1,0,0|2,0,0]=4 15498 B9R1.132 NC1C(=O)NCC1CO Amb28125787 [0,1,0,1,0,0|2,0,0]=4 15499 B9R1.132 NC1C(=O)OCC1CO Amb27804109 [0,1,0,1,0,0|2,0,0]=4 15500 B9R1.132 NC1C(=O)OCC1CS Amb27637863 [0,1,0,1,0,0|2,0,0]=4 15501 B9R1.132 NN1C(=O)CCC1CO Amb27983528 [0,1,0,1,0,0|2,0,0]=4 15502 B9R1.132 O=C1OCC(CO)C1O Amb27197070 [0,1,0,1,0,0|2,0,0]=4 15503 B9R1.135 C=CCC1CC(=O)N1C Amb27392633 [0,1,0,1,0,0|0,0,2]=4 15504 B9R1.135 CCCC1NC(=O)C1C Amb27193222 [0,1,0,1,0,0|1,0,0]=3 15505 B9R1.135 CCC[C@@H]1NC(=O)[C@@H]1C Amb28320522 [0,1,0,1,0,0|1,0,0]=3 15506 B9R1.135 CCC[C@@H]1NC(=O)[C@H]1C Amb27229291 [0,1,0,1,0,0|1,0,0]=3 15507 B9R1.135 CCOC1=C(C)C(=O)C1 Amb28253635 [0,1,0,1,0,0|1,0,1]=4 15508 B9R1.135 CCOC1CC(=O)C1C Amb25257374 [0,1,0,1,0,0|1,0,0]=3 15509 B9R1.135 CCOC1CC(=O)C1Cl Amb25221976 [0,1,0,1,0,0|1,0,0]=3 15510 B9R1.135 CCOC1CC(=O)N1C Amb25346887 [0,1,0,1,0,0|1,0,0]=3 15511 B9R1.135 CCO[C@@H]1CC(=O)[C@H]1C Amb28198608 [0,1,0,1,0,0|1,0,0]=3 15512 B9R1.135 COC[C@@H]1NC(=O)[C@@H]1O Amb27451137 [0,1,0,1,0,0|2,0,0]=4 15513 B9R1.202 CC1CCCC1(C)C=O Amb25860085 [0,1,0,1,0,0|0,0,1]=3 15514 B9R1.202 CC1CCCC1(C)CN Amb24615536 [0,1,0,1,0,0|1,0,1]=4 15515 B9R1.202 CC1CCCC1(O)CN Amb25146157 [0,1,0,1,0,0|0,0,2]=4 15516 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|0,0,2]=4 15517 B9R1.202 CN[C@]1(C)CCC[C@@H]1C Amb27779229 [0,1,0,1,0,0|1,0,1]=4 15518 B9R1.202 C[C@@H]1CCC[C@]1(O)CO Amb27630888 [0,1,0,1,0,0|0,0,2]=4 15519 B9R1.6 C=C(Br)C1CCCCC1 Amb27812306 [0,1,0,1,0,0|1,0,1]=4 15520 B9R1.6 C=C(C)C1CCCCC1 Amb24478631 [0,1,0,1,0,0|1,0,0]=3 15521 B9R1.6 C=C(C)C1CCCCN1 Amb23536631 [0,1,0,1,0,0|1,0,0]=3 15522 B9R1.6 C=C(C)C1CCCNC1 Amb23536695 [0,1,0,1,0,0|1,0,0]=3 15523 B9R1.6 C=C(C)C1CCNCC1 Amb23536711 [0,1,0,1,0,0|1,0,0]=3 15524 B9R1.6 C=C(C)C1CNCCO1 Amb30036474 [0,1,0,1,0,0|2,0,0]=4 15525 B9R1.6 C=C(C)C1COCCN1 Amb33199954 [0,1,0,1,0,0|2,0,0]=4 15526 B9R1.6 C=C(C)C1OCCCO1 Amb17334098 [0,1,0,1,0,0|2,0,0]=4 15527 B9R1.6 CC(=N)N1CCCCC1 Amb27985971 [0,1,0,1,0,0|1,0,0]=3 15528 B9R1.6 CC(=N)N1CCNCC1 Amb27867831 [0,1,0,1,0,0|2,0,0]=4 15529 B9R1.6 CC(=N)N1CCOCC1 Amb27667150 [0,1,0,1,0,0|2,0,0]=4 15530 B9R1.6 CC(=N)N1CCSCC1 Amb28049758 [0,1,0,1,0,0|2,0,0]=4 15531 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [0,1,0,1,0,0|0,0,1]=3 15532 B9R1.6 CC(=O)C1=CCCCN1 Amb27234616 [0,1,0,1,0,0|0,0,2]=4 15533 B9R1.6 CC(=O)C1=CCNCC1 Amb28188537 [0,1,0,1,0,0|0,0,2]=4 15534 B9R1.6 CC(=O)C1=CCOCC1 Amb26054193 [0,1,0,1,0,0|0,0,2]=4 15535 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [0,1,0,1,0,0|0,0,2]=4 15536 B9R1.6 CC(=O)C1=COCCC1 Amb26337589 [0,1,0,1,0,0|0,0,2]=4 15537 B9R1.6 CC(=O)C1=CSCCC1 Amb27803691 [0,1,0,1,0,0|0,0,2]=4 15538 B9R1.6 CC(=O)C1=NCCSC1 Amb24620482 [0,1,0,1,0,0|1,0,1]=4 15539 B9R1.6 CC(=O)C1C=CCCC1 Amb17593287 [0,1,0,1,0,0|0,0,1]=3 15540 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [0,1,0,1,0,0|0,0,1]=3 15541 B9R1.6 CC(=O)C1CCC=CN1 Amb25094747 [0,1,0,1,0,0|0,0,2]=4 15542 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [0,1,0,1,0,0|0,0,2]=4 15543 B9R1.6 CC(=O)C1CCC=NC1 Amb25073951 [0,1,0,1,0,0|0,0,1]=3 15544 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [0,1,0,1,0,0|0,0,0]=2 15545 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,1,0,1,0,0|0,0,0]=2 15546 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [0,1,0,1,0,0|0,0,0]=2 15547 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,1,0,1,0,0|0,0,0]=2 15548 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [0,1,0,1,0,0|0,0,0]=2 15549 B9R1.6 CC(=O)C1CCCNC1 Amb22496258 [0,1,0,1,0,0|0,0,0]=2 15550 B9R1.6 CC(=O)C1CCCNC1 Amb3941186 [0,1,0,1,0,0|0,0,0]=2 15551 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [0,1,0,1,0,0|0,0,0]=2 15552 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [0,1,0,1,0,0|0,0,0]=2 15553 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [0,1,0,1,0,0|0,0,0]=2 15554 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [0,1,0,1,0,0|0,0,0]=2 15555 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [0,1,0,1,0,0|0,0,0]=2 15556 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [0,1,0,1,0,0|1,0,0]=3 15557 B9R1.6 CC(=O)C1CNCCS1 Amb24105963 [0,1,0,1,0,0|1,0,0]=3 15558 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,1,0,1,0,0|1,0,0]=3 15559 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,1,0,1,0,0|1,0,0]=3 15560 B9R1.6 CC(=O)C1COCOC1 Amb27838787 [0,1,0,1,0,0|1,0,0]=3 15561 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,1,0,1,0,0|1,0,0]=3 15562 B9R1.6 CC(=O)C1OCCCS1 Amb28350938 [0,1,0,1,0,0|1,0,0]=3 15563 B9R1.6 CC(=O)C1SCCCS1 Amb17594050 [0,1,0,1,0,0|1,0,0]=3 15564 B9R1.6 CC(=O)N1CC=NCC1 Amb25188901 [0,1,0,1,0,0|1,0,1]=4 15565 B9R1.6 CC(=O)N1CCCCC1 Amb2694530 [0,1,0,1,0,0|0,0,0]=2 15566 B9R1.6 CC(=O)N1CCNCC1 Amb4424006 [0,1,0,1,0,0|1,0,0]=3 15567 B9R1.6 CC(=O)N1CCNCC1 Amb535516 [0,1,0,1,0,0|1,0,0]=3 15568 B9R1.6 CC(=O)N1CCOCC1 Amb3886545 [0,1,0,1,0,0|1,0,0]=3 15569 B9R1.6 CC(=O)[C@@H]1C=CCCC1 Amb25683968 [0,1,0,1,0,0|0,0,1]=3 15570 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [0,1,0,1,0,0|0,0,1]=3 15571 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [0,1,0,1,0,0|0,0,0]=2 15572 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [0,1,0,1,0,0|0,0,0]=2 15573 B9R1.6 CC(=O)[C@@H]1CCCNC1 Amb33131879 [0,1,0,1,0,0|0,0,0]=2 15574 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [0,1,0,1,0,0|0,0,2]=4 15575 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,1,0,1,0,0|0,0,0]=2 15576 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [0,1,0,1,0,0|0,0,0]=2 15577 B9R1.6 CC(=O)[C@H]1CCCNC1 Amb33131684 [0,1,0,1,0,0|0,0,0]=2 15578 B9R1.6 CC(=S)N1CCNCC1 Amb27458534 [0,1,0,1,0,0|1,1,0]=4 15579 B9R1.6 CC(=S)N1CCOCC1 Amb28190410 [0,1,0,1,0,0|1,1,0]=4 15580 B9R1.6 CC(Br)C1CCCCC1 Amb9672122 [0,1,0,1,0,0|1,0,1]=4 15581 B9R1.6 CC(Br)C1CCOCC1 Amb26349859 [0,1,0,1,0,0|1,0,1]=4 15582 B9R1.6 CC(C)=C1CCNCC1 Amb16187021 [0,1,0,1,0,0|1,0,1]=4 15583 B9R1.6 CC(C)=C1CCOCC1 Amb33715159 [0,1,0,1,0,0|1,0,1]=4 15584 B9R1.6 CC(C)C1CCCCN1 Amb2235858 [0,1,0,1,0,0|1,0,1]=4 15585 B9R1.6 CC(C)C1CCCCN1 Amb2237211 [0,1,0,1,0,0|1,0,1]=4 15586 B9R1.6 CC(C)C1CCCNC1 Amb10607741 [0,1,0,1,0,0|1,0,1]=4 15587 B9R1.6 CC(C)C1CCCNC1 Amb29083221 [0,1,0,1,0,0|1,0,1]=4 15588 B9R1.6 CC(C)C1CCNCC1 Amb10607748 [0,1,0,1,0,0|1,0,1]=4 15589 B9R1.6 CC(C)C1CCNCC1 Amb19148785 [0,1,0,1,0,0|1,0,1]=4 15590 B9R1.6 CC(Cl)C1CCOCC1 Amb28056771 [0,1,0,1,0,0|1,0,1]=4 15591 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|1,0,1]=4 15592 B9R1.6 CC(N)C1CCCCC1 Amb9283568 [0,1,0,1,0,0|1,0,1]=4 15593 B9R1.6 CC(N)C1CCCCN1 Amb9901744 [0,1,0,1,0,0|1,0,1]=4 15594 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [0,1,0,1,0,0|1,0,1]=4 15595 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [0,1,0,1,0,0|1,0,1]=4 15596 B9R1.6 CC(N)C1CCCCS1 Amb27880783 [0,1,0,1,0,0|1,0,1]=4 15597 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|1,0,1]=4 15598 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|1,0,1]=4 15599 B9R1.6 CC(N)C1CCCOC1 Amb32789650 [0,1,0,1,0,0|1,0,1]=4 15600 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|1,0,1]=4 15601 B9R1.6 CC(N)C1CCNCC1 Amb18203242 [0,1,0,1,0,0|1,0,1]=4 15602 B9R1.6 CC(N)C1CCOCC1 Amb18832548 [0,1,0,1,0,0|1,0,1]=4 15603 B9R1.6 CC(N)C1CCOCC1 Amb23399781 [0,1,0,1,0,0|1,0,1]=4 15604 B9R1.6 CC(N)C1CCSCC1 Amb18199073 [0,1,0,1,0,0|1,0,1]=4 15605 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [0,1,0,1,0,0|0,0,2]=4 15606 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|0,0,2]=4 15607 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,2]=4 15608 B9R1.6 CC(O)C1CCCNC1 Amb17593363 [0,1,0,1,0,0|0,0,2]=4 15609 B9R1.6 CC(O)C1CCCNC1 Amb32412170 [0,1,0,1,0,0|0,0,2]=4 15610 B9R1.6 CC(O)C1CCNCC1 Amb21955698 [0,1,0,1,0,0|0,0,2]=4 15611 B9R1.6 CC(O)C1CCNCC1 Amb22587101 [0,1,0,1,0,0|0,0,2]=4 15612 B9R1.6 CC(O)C1CCNCC1 Amb22899459 [0,1,0,1,0,0|0,0,2]=4 15613 B9R1.6 CC(O)C1CCNCC1 Amb9173665 [0,1,0,1,0,0|0,0,2]=4 15614 B9R1.6 CC(O)C1CCOCC1 Amb20667854 [0,1,0,1,0,0|0,0,2]=4 15615 B9R1.6 CC(O)C1CCSCC1 Amb35698333 [0,1,0,1,0,0|0,0,2]=4 15616 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [0,1,0,1,0,0|0,0,2]=4 15617 B9R1.6 CC(O)[C@@H]1CCCNC1 Amb35588431 [0,1,0,1,0,0|0,0,2]=4 15618 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [0,1,0,1,0,0|0,0,2]=4 15619 B9R1.6 CC(O)[C@H]1CCCNC1 Amb35617453 [0,1,0,1,0,0|0,0,2]=4 15620 B9R1.6 CC(S)C1CCCCC1 Amb9672127 [0,1,0,1,0,0|0,1,1]=4 15621 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|0,1,1]=4 15622 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [0,1,0,1,0,0|0,1,1]=4 15623 B9R1.6 CC(S)C1CCCNC1 Amb32788620 [0,1,0,1,0,0|0,1,1]=4 15624 B9R1.6 CC(S)C1CCCSC1 Amb32788181 [0,1,0,1,0,0|0,1,1]=4 15625 B9R1.6 CC(S)C1CCNCC1 Amb24427532 [0,1,0,1,0,0|0,1,1]=4 15626 B9R1.6 CC(S)C1CCOCC1 Amb32788473 [0,1,0,1,0,0|0,1,1]=4 15627 B9R1.6 CC(S)C1CCSCC1 Amb32788556 [0,1,0,1,0,0|0,1,1]=4 15628 B9R1.6 CN(C)C1CCCCC1 Amb8516598 [0,1,0,1,0,0|2,0,0]=4 15629 B9R1.6 CN(C)C1CCCCN1 Amb24644194 [0,1,0,1,0,0|2,0,0]=4 15630 B9R1.6 CN(C)C1CCCCO1 Amb22523025 [0,1,0,1,0,0|2,0,0]=4 15631 B9R1.6 CN(C)C1CCCNC1 Amb33528308 [0,1,0,1,0,0|2,0,0]=4 15632 B9R1.6 CN(C)C1CCCNC1 Amb8503434 [0,1,0,1,0,0|2,0,0]=4 15633 B9R1.6 CN(C)C1CCNCC1 Amb2687459 [0,1,0,1,0,0|2,0,0]=4 15634 B9R1.6 CN(C)C1CCNCC1 Amb4006359 [0,1,0,1,0,0|2,0,0]=4 15635 B9R1.6 CN(C)C1CCNCC1 Amb8503433 [0,1,0,1,0,0|2,0,0]=4 15636 B9R1.6 CN(C)C1CCOCC1 Amb21858035 [0,1,0,1,0,0|2,0,0]=4 15637 B9R1.6 CN(C)[C@@H]1CCCNC1 Amb22230576 [0,1,0,1,0,0|2,0,0]=4 15638 B9R1.6 CN(C)[C@H]1CCCNC1 Amb22230579 [0,1,0,1,0,0|2,0,0]=4 15639 B9R1.6 CN(N)C1CCCCC1 Amb27979124 [0,1,0,1,0,0|2,0,0]=4 15640 B9R1.6 CN(N)C1CCCOC1 Amb35713974 [0,1,0,1,0,0|2,0,0]=4 15641 B9R1.6 CS(=O)C1CCCNC1 Amb27750943 [0,1,0,1,0,0|1,0,0]=3 15642 B9R1.6 CS(=O)N1CCNCC1 Amb27168819 [0,1,0,1,0,0|2,0,0]=4 15643 B9R1.6 C[C@@H](N)C1CCCCC1 Amb3940038 [0,1,0,1,0,0|1,0,1]=4 15644 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [0,1,0,1,0,0|1,0,1]=4 15645 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [0,1,0,1,0,0|1,0,1]=4 15646 B9R1.6 C[C@@H](N)C1CCCCS1 Amb27174884 [0,1,0,1,0,0|1,0,1]=4 15647 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|1,0,1]=4 15648 B9R1.6 C[C@@H](N)C1CCCSC1 Amb32726293 [0,1,0,1,0,0|1,0,1]=4 15649 B9R1.6 C[C@@H](N)C1CCOCC1 Amb23399761 [0,1,0,1,0,0|1,0,1]=4 15650 B9R1.6 C[C@@H](N)C1CCOCC1 Amb33292442 [0,1,0,1,0,0|1,0,1]=4 15651 B9R1.6 C[C@@H](N)C1CCSCC1 Amb35714071 [0,1,0,1,0,0|1,0,1]=4 15652 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [0,1,0,1,0,0|0,0,2]=4 15653 B9R1.6 C[C@@H](O)C1CCCOC1 Amb26634197 [0,1,0,1,0,0|0,0,2]=4 15654 B9R1.6 C[C@@H](O)C1CCCSC1 Amb32726246 [0,1,0,1,0,0|0,0,2]=4 15655 B9R1.6 C[C@@H](O)C1CCNCC1 Amb27392755 [0,1,0,1,0,0|0,0,2]=4 15656 B9R1.6 C[C@@H](O)C1CCNCC1 Amb32671192 [0,1,0,1,0,0|0,0,2]=4 15657 B9R1.6 C[C@@H](O)C1CCOCC1 Amb25121022 [0,1,0,1,0,0|0,0,2]=4 15658 B9R1.6 C[C@H](N)C1CCCCC1 Amb3939178 [0,1,0,1,0,0|1,0,1]=4 15659 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [0,1,0,1,0,0|1,0,1]=4 15660 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|1,0,1]=4 15661 B9R1.6 C[C@H](N)C1CCCSC1 Amb32726275 [0,1,0,1,0,0|1,0,1]=4 15662 B9R1.6 C[C@H](N)C1CCOCC1 Amb26078988 [0,1,0,1,0,0|1,0,1]=4 15663 B9R1.6 C[C@H](N)C1CCOCC1 Amb33292446 [0,1,0,1,0,0|1,0,1]=4 15664 B9R1.6 C[C@H](N)C1CCSCC1 Amb35714070 [0,1,0,1,0,0|1,0,1]=4 15665 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [0,1,0,1,0,0|0,0,2]=4 15666 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [0,1,0,1,0,0|0,0,2]=4 15667 B9R1.6 C[C@H](O)C1CCCOC1 Amb26324174 [0,1,0,1,0,0|0,0,2]=4 15668 B9R1.6 C[C@H](O)C1CCCSC1 Amb32726302 [0,1,0,1,0,0|0,0,2]=4 15669 B9R1.6 C[C@H](O)C1CCNCC1 Amb25951129 [0,1,0,1,0,0|0,0,2]=4 15670 B9R1.6 C[C@H](O)C1CCNCC1 Amb32671190 [0,1,0,1,0,0|0,0,2]=4 15671 B9R1.6 C[C@H](O)C1CCOCC1 Amb25077475 [0,1,0,1,0,0|0,0,2]=4 15672 B9R1.6 C[SiH](C)C1CCCCC1 Amb22336516 [0,1,0,1,0,0|1,1,0]=4 15673 B9R1.6 FC(Br)=C1CCCCC1 Amb32993478 [0,1,0,1,0,0|2,0,0]=4 15674 B9R1.6 N=C(N)C1CCCCC1 Amb2695062 [0,1,0,1,0,0|2,0,0]=4 15675 B9R1.6 N=C(N)C1CCCCC1 Amb8630087 [0,1,0,1,0,0|2,0,0]=4 15676 B9R1.6 N=C(N)C1CCCCN1 Amb24659758 [0,1,0,1,0,0|2,0,0]=4 15677 B9R1.6 N=C(N)C1CCCCN1 Amb8630661 [0,1,0,1,0,0|2,0,0]=4 15678 B9R1.6 N=C(N)C1CCCCO1 Amb25212338 [0,1,0,1,0,0|2,0,0]=4 15679 B9R1.6 N=C(N)C1CCCSC1 Amb32726091 [0,1,0,1,0,0|2,0,0]=4 15680 B9R1.6 N=C(N)C1CCNCC1 Amb2700045 [0,1,0,1,0,0|2,0,0]=4 15681 B9R1.6 N=C(N)C1CCOCC1 Amb22059100 [0,1,0,1,0,0|2,0,0]=4 15682 B9R1.6 N=C(N)C1CCOCC1 Amb7990054 [0,1,0,1,0,0|2,0,0]=4 15683 B9R1.6 N=C(N)C1CCSCC1 Amb25992613 [0,1,0,1,0,0|2,0,0]=4 15684 B9R1.6 N=C(N)N1CCCCC1 Amb10066939 [0,1,0,1,0,0|2,0,0]=4 15685 B9R1.6 N=C(N)N1CCCCC1 Amb16231331 [0,1,0,1,0,0|2,0,0]=4 15686 B9R1.6 N=C(N)N1CCCCC1 Amb1885874 [0,1,0,1,0,0|2,0,0]=4 15687 B9R1.6 N=C(N)N1CCCCC1 Amb2724255 [0,1,0,1,0,0|2,0,0]=4 15688 B9R1.6 N=C(N)N1CCCCC1 Amb2724396 [0,1,0,1,0,0|2,0,0]=4 15689 B9R1.6 N=C(N)N1CCCCC1 Amb33551652 [0,1,0,1,0,0|2,0,0]=4 15690 B9R1.6 NC(=O)C1=CCCCC1 Amb27878423 [0,1,0,1,0,0|1,0,1]=4 15691 B9R1.6 NC(=O)C1CC=CCC1 Amb16231370 [0,1,0,1,0,0|1,0,1]=4 15692 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [0,1,0,1,0,0|1,0,0]=3 15693 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,1,0,1,0,0|1,0,0]=3 15694 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [0,1,0,1,0,0|1,0,0]=3 15695 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [0,1,0,1,0,0|1,0,0]=3 15696 B9R1.6 NC(=O)C1CCCNC1 Amb33527502 [0,1,0,1,0,0|1,0,0]=3 15697 B9R1.6 NC(=O)C1CCCNC1 Amb9702850 [0,1,0,1,0,0|1,0,0]=3 15698 B9R1.6 NC(=O)C1CCCOC1 Amb9173672 [0,1,0,1,0,0|1,0,0]=3 15699 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [0,1,0,1,0,0|1,0,0]=3 15700 B9R1.6 NC(=O)C1CCNCC1 Amb2720321 [0,1,0,1,0,0|1,0,0]=3 15701 B9R1.6 NC(=O)C1CCOCC1 Amb7990052 [0,1,0,1,0,0|1,0,0]=3 15702 B9R1.6 NC(=O)C1CCSCC1 Amb27252383 [0,1,0,1,0,0|1,0,0]=3 15703 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,1,0,1,0,0|2,0,0]=4 15704 B9R1.6 NC(=O)C1CNCCO1 Amb13951857 [0,1,0,1,0,0|2,0,0]=4 15705 B9R1.6 NC(=O)C1CNCCO1 Amb22587273 [0,1,0,1,0,0|2,0,0]=4 15706 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,1,0,1,0,0|2,0,0]=4 15707 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [0,1,0,1,0,0|2,0,0]=4 15708 B9R1.6 NC(=O)C1CSCCN1 Amb4004499 [0,1,0,1,0,0|2,0,0]=4 15709 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [0,1,0,1,0,0|1,0,0]=3 15710 B9R1.6 NC(=O)N1CCCOC1 Amb27428822 [0,1,0,1,0,0|2,0,0]=4 15711 B9R1.6 NC(=O)N1CCNCC1 Amb1118360 [0,1,0,1,0,0|2,0,0]=4 15712 B9R1.6 NC(=O)N1CCNCC1 Amb33550497 [0,1,0,1,0,0|2,0,0]=4 15713 B9R1.6 NC(=O)N1CCOCC1 Amb6373065 [0,1,0,1,0,0|2,0,0]=4 15714 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [0,1,0,1,0,0|1,0,1]=4 15715 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,1,0,1,0,0|1,0,0]=3 15716 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb25757310 [0,1,0,1,0,0|1,0,0]=3 15717 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb31204722 [0,1,0,1,0,0|1,0,0]=3 15718 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,1,0,1,0,0|2,0,0]=4 15719 B9R1.6 NC(=O)[C@@H]1CNCCO1 Amb28049786 [0,1,0,1,0,0|2,0,0]=4 15720 B9R1.6 NC(=O)[C@@H]1CSCCN1 Amb27950510 [0,1,0,1,0,0|2,0,0]=4 15721 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [0,1,0,1,0,0|1,0,0]=3 15722 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23401436 [0,1,0,1,0,0|1,0,0]=3 15723 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23439159 [0,1,0,1,0,0|1,0,0]=3 15724 B9R1.6 NC(=O)[C@H]1CCSCN1 Amb27613173 [0,1,0,1,0,0|2,0,0]=4 15725 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb27355135 [0,1,0,1,0,0|2,0,0]=4 15726 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb8420820 [0,1,0,1,0,0|2,0,0]=4 15727 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb27758345 [0,1,0,1,0,0|2,0,0]=4 15728 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb28555661 [0,1,0,1,0,0|2,0,0]=4 15729 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [0,1,0,1,0,0|2,0,0]=4 15730 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [0,1,0,1,0,0|2,0,0]=4 15731 B9R1.6 NC(=S)C1CCCCC1 Amb6373985 [0,1,0,1,0,0|1,1,0]=4 15732 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [0,1,0,1,0,0|1,1,0]=4 15733 B9R1.6 NC(=S)C1CCCCO1 Amb33377342 [0,1,0,1,0,0|1,1,0]=4 15734 B9R1.6 NC(=S)C1CCCCS1 Amb28185396 [0,1,0,1,0,0|1,1,0]=4 15735 B9R1.6 NC(=S)C1CCCNC1 Amb27423220 [0,1,0,1,0,0|1,1,0]=4 15736 B9R1.6 NC(=S)C1CCCOC1 Amb20668228 [0,1,0,1,0,0|1,1,0]=4 15737 B9R1.6 NC(=S)C1CCCSC1 Amb33224504 [0,1,0,1,0,0|1,1,0]=4 15738 B9R1.6 NC(=S)C1CCNCC1 Amb10607493 [0,1,0,1,0,0|1,1,0]=4 15739 B9R1.6 NC(=S)C1CCOCC1 Amb33530376 [0,1,0,1,0,0|1,1,0]=4 15740 B9R1.6 NC(=S)N1CCCCC1 Amb6358189 [0,1,0,1,0,0|1,1,0]=4 15741 B9R1.6 NC(=[NH2+])N1CCCCC1 Amb22269904 [0,1,0,1,0,0|2,0,0]=4 15742 B9R1.6 NS(=O)C1CCCCC1 Amb26389954 [0,1,0,1,0,0|2,0,0]=4 15743 B9R1.6 NS(=O)C1CCCOC1 Amb32720486 [0,1,0,1,0,0|2,0,0]=4 15744 B9R1.6 NS(=O)C1CCOCC1 Amb32720339 [0,1,0,1,0,0|2,0,0]=4 15745 B9R1.6 O=C(Cl)C1=CCCCC1 Amb21961756 [0,1,0,1,0,0|1,0,1]=4 15746 B9R1.6 O=C(Cl)C1CC=CCC1 Amb10844648 [0,1,0,1,0,0|1,0,1]=4 15747 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [0,1,0,1,0,0|1,0,0]=3 15748 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [0,1,0,1,0,0|1,0,0]=3 15749 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [0,1,0,1,0,0|1,0,0]=3 15750 B9R1.6 O=C(Cl)C1CCCOC1 Amb18280558 [0,1,0,1,0,0|1,0,0]=3 15751 B9R1.6 O=C(Cl)C1CCOCC1 Amb2723452 [0,1,0,1,0,0|1,0,0]=3 15752 B9R1.6 O=C(Cl)C1CCSCC1 Amb6572254 [0,1,0,1,0,0|1,0,0]=3 15753 B9R1.6 O=C(Cl)N1CCCCC1 Amb17563099 [0,1,0,1,0,0|1,0,0]=3 15754 B9R1.6 O=C(Cl)N1CCOCC1 Amb6608771 [0,1,0,1,0,0|2,0,0]=4 15755 B9R1.6 O=C(Cl)N1CCSCC1 Amb25328755 [0,1,0,1,0,0|2,0,0]=4 15756 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,1,0,1,0,0|1,0,0]=3 15757 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [0,1,0,1,0,0|1,0,1]=4 15758 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [0,1,0,1,0,0|1,0,1]=4 15759 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [0,1,0,1,0,0|1,0,1]=4 15760 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [0,1,0,1,0,0|1,0,1]=4 15761 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [0,1,0,1,0,0|1,0,0]=3 15762 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [0,1,0,1,0,0|1,0,0]=3 15763 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,1,0,1,0,0|1,0,0]=3 15764 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [0,1,0,1,0,0|1,0,0]=3 15765 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [0,1,0,1,0,0|1,0,0]=3 15766 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [0,1,0,1,0,0|1,0,0]=3 15767 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [0,1,0,1,0,0|1,0,0]=3 15768 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [0,1,0,1,0,0|1,0,0]=3 15769 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [0,1,0,1,0,0|1,0,0]=3 15770 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [0,1,0,1,0,0|2,0,0]=4 15771 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [0,1,0,1,0,0|1,0,0]=3 15772 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [0,1,0,1,0,0|1,0,0]=3 15773 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [0,1,0,1,0,0|1,0,0]=3 15774 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [0,1,0,1,0,0|2,0,0]=4 15775 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [0,1,0,1,0,0|1,0,0]=3 15776 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [0,1,0,1,0,0|2,0,0]=4 15777 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [0,1,0,1,0,0|2,0,0]=4 15778 B9R1.6 O=C(O)C1CCSSC1 Amb26422767 [0,1,0,1,0,0|2,0,0]=4 15779 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [0,1,0,1,0,0|2,0,0]=4 15780 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [0,1,0,1,0,0|2,0,0]=4 15781 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [0,1,0,1,0,0|2,0,0]=4 15782 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [0,1,0,1,0,0|2,0,0]=4 15783 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [0,1,0,1,0,0|2,0,0]=4 15784 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [0,1,0,1,0,0|2,0,0]=4 15785 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [0,1,0,1,0,0|2,0,0]=4 15786 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [0,1,0,1,0,0|2,0,0]=4 15787 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [0,1,0,1,0,0|2,0,0]=4 15788 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [0,1,0,1,0,0|2,0,0]=4 15789 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [0,1,0,1,0,0|2,0,0]=4 15790 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [0,1,0,1,0,0|2,0,0]=4 15791 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [0,1,0,1,0,0|2,0,0]=4 15792 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [0,1,0,1,0,0|2,0,0]=4 15793 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [0,1,0,1,0,0|2,0,0]=4 15794 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [0,1,0,1,0,0|2,0,0]=4 15795 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [0,1,0,1,0,0|2,0,0]=4 15796 B9R1.6 O=C(O)C1SCCCS1 Amb22167283 [0,1,0,1,0,0|2,0,0]=4 15797 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [0,1,0,1,0,0|1,0,0]=3 15798 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [0,1,0,1,0,0|1,0,0]=3 15799 B9R1.6 O=C(O)N1CCSCC1 Amb24099831 [0,1,0,1,0,0|2,0,0]=4 15800 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [0,1,0,1,0,0|1,0,1]=4 15801 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [0,1,0,1,0,0|1,0,0]=3 15802 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [0,1,0,1,0,0|1,0,0]=3 15803 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [0,1,0,1,0,0|1,0,0]=3 15804 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [0,1,0,1,0,0|1,0,0]=3 15805 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [0,1,0,1,0,0|1,0,0]=3 15806 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [0,1,0,1,0,0|2,0,0]=4 15807 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [0,1,0,1,0,0|1,0,0]=3 15808 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [0,1,0,1,0,0|1,0,0]=3 15809 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [0,1,0,1,0,0|2,0,0]=4 15810 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [0,1,0,1,0,0|2,0,0]=4 15811 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [0,1,0,1,0,0|2,0,0]=4 15812 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [0,1,0,1,0,0|2,0,0]=4 15813 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [0,1,0,1,0,0|2,0,0]=4 15814 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [0,1,0,1,0,0|2,0,0]=4 15815 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [0,1,0,1,0,0|2,0,0]=4 15816 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [0,1,0,1,0,0|2,0,0]=4 15817 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [0,1,0,1,0,0|2,0,0]=4 15818 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [0,1,0,1,0,0|1,0,1]=4 15819 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [0,1,0,1,0,0|1,0,0]=3 15820 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [0,1,0,1,0,0|1,0,0]=3 15821 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [0,1,0,1,0,0|1,0,0]=3 15822 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [0,1,0,1,0,0|1,0,0]=3 15823 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [0,1,0,1,0,0|1,0,0]=3 15824 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [0,1,0,1,0,0|2,0,0]=4 15825 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [0,1,0,1,0,0|1,0,0]=3 15826 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [0,1,0,1,0,0|2,0,0]=4 15827 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [0,1,0,1,0,0|2,0,0]=4 15828 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [0,1,0,1,0,0|2,0,0]=4 15829 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [0,1,0,1,0,0|2,0,0]=4 15830 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [0,1,0,1,0,0|2,0,0]=4 15831 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [0,1,0,1,0,0|2,0,0]=4 15832 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [0,1,0,1,0,0|2,0,0]=4 15833 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [0,1,0,1,0,0|2,0,0]=4 15834 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [0,1,0,1,0,0|2,0,0]=4 15835 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [0,1,0,1,0,0|2,0,0]=4 15836 B9R1.6 O=S(Cl)C1CCCCC1 Amb25305792 [0,1,0,1,0,0|2,0,0]=4 15837 B9R1.6 O=S(Cl)C1CCCOC1 Amb32720485 [0,1,0,1,0,0|2,0,0]=4 15838 B9R1.6 O=S(Cl)C1CCOCC1 Amb25993855 [0,1,0,1,0,0|2,0,0]=4 15839 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [0,1,0,1,0,0|2,0,0]=4 15840 B9R1.6 O=S([O-])C1CCCCC1 Amb19893330 [0,1,0,1,0,0|2,0,0]=4 15841 B9R1.6 O=S([O-])C1CCCNC1 Amb32755644 [0,1,0,1,0,0|2,0,0]=4 15842 B9R1.6 O=S([O-])C1CCCOC1 Amb28281775 [0,1,0,1,0,0|2,0,0]=4 15843 B9R1.6 O=S([O-])C1CCOCC1 Amb33549506 [0,1,0,1,0,0|2,0,0]=4 15844 B9R1.6 O=[N+]([O-])C1CCCCC1 Amb10604036 [0,1,0,1,0,0|2,0,0]=4 15845 B9R1.6 O=[N+]([O-])C1CCCOC1 Amb33298985 [0,1,0,1,0,0|2,0,0]=4 15846 B9R1.6 O=[N+]([O-])C1CCCSC1 Amb33299017 [0,1,0,1,0,0|2,0,0]=4 15847 B9R1.6 O=[N+]([O-])C1CCNCC1 Amb22330560 [0,1,0,1,0,0|2,0,0]=4 15848 B9R1.6 O=[N+]([O-])C1CCOCC1 Amb21960815 [0,1,0,1,0,0|2,0,0]=4 15849 B9R1.6 O=[N+]([O-])C1CCSCC1 Amb33299033 [0,1,0,1,0,0|2,0,0]=4 15850 B9R1.6 O=[N+]([O-])N1CCCCC1 Amb28283539 [0,1,0,1,0,0|2,0,0]=4 15851 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [0,1,0,1,0,0|2,0,0]=4 15852 B9R1.6 S=C([S-])N1CCCCC1 Amb19748283 [0,1,0,1,0,0|1,1,0]=4 15853 B9R1.6 S=C([S-])N1CCCCC1 Amb4263090 [0,1,0,1,0,0|1,1,0]=4 15854 B9R1.6 S=C([S-])N1CCCCC1 Amb534229 [0,1,0,1,0,0|1,1,0]=4 15855 B9R1.6 [O-]C(=S)C1CCCCO1 Amb27262534 [0,1,0,1,0,0|1,0,1]=4 15856 B9R1.9 C=C1CN(CCCN)C1 Amb35605393 [0,1,0,1,0,0|2,0,0]=4 15857 B9R1.9 C=C1CN(CCNC)C1 Amb29879475 [0,1,0,1,0,0|2,0,0]=4 15858 B9R1.9 C=CCCC1CC(=O)N1 Amb24524165 [0,1,0,1,0,0|0,0,2]=4 15859 B9R1.9 CC#CCC1CC(=O)N1 Amb27461472 [0,1,0,1,0,0|0,0,2]=4 15860 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|1,0,1]=4 15861 B9R1.9 CCCCC1=CC(=O)C1 Amb28199849 [0,1,0,1,0,0|0,0,1]=3 15862 B9R1.9 CCCCC1CC(O)C1 Amb27956599 [0,1,0,1,0,0|0,0,2]=4 15863 B9R1.9 CCCCN1CC(O)C1 Amb27837475 [0,1,0,1,0,0|0,0,2]=4 15864 B9R1.9 CCCC[C@H]1CC(=O)N1 Amb27627588 [0,1,0,1,0,0|0,0,0]=2 15865 B9R1.9 CCCC[C@H]1C[C@H](Br)C1 Amb28121167 [0,1,0,1,0,0|1,0,1]=4 15866 B9R1.9 CCCNC1CN(C)C1 Amb25868226 [0,1,0,1,0,0|2,0,0]=4 15867 B9R1.9 CCCSC1CC(O)C1 Amb32753276 [0,1,0,1,0,0|0,0,2]=4 15868 B9R1.9 CCCS[C@H]1C[C@@H](O)C1 Amb32674541 [0,1,0,1,0,0|0,0,2]=4 15869 B9R1.9 CCNCC1CC(N)C1 Amb30039916 [0,1,0,1,0,0|1,0,1]=4 15870 B9R1.9 CCNCC1CC(O)C1 Amb27423766 [0,1,0,1,0,0|0,0,2]=4 15871 B9R1.9 CCNC[C@H]1C[C@@H](N)C1 Amb30032552 [0,1,0,1,0,0|1,0,1]=4 15872 B9R1.9 CCNC[C@H]1C[C@H](N)C1 Amb30027852 [0,1,0,1,0,0|1,0,1]=4 15873 B9R1.9 CCOCC1CC(=O)C1 Amb27830550 [0,1,0,1,0,0|0,0,0]=2 15874 B9R1.9 CCOCC1CC(N)C1 Amb35662641 [0,1,0,1,0,0|1,0,1]=4 15875 B9R1.9 CCSCC1CC(N)C1 Amb29892536 [0,1,0,1,0,0|1,0,1]=4 15876 B9R1.9 CNCCC1CC(C)C1 Amb27963211 [0,1,0,1,0,0|1,0,1]=4 15877 B9R1.9 COCCC1CC(=O)C1 Amb33457929 [0,1,0,1,0,0|0,0,0]=2 15878 B9R1.9 NCCCN1CC(=O)C1 Amb28313692 [0,1,0,1,0,0|1,0,0]=3 15879 B9R1.9 O=C1CC(OCCBr)N1 Amb27645730 [0,1,0,1,0,0|2,0,0]=4 15880 B9R1.9 O=C1CC(OCCCl)C1 Amb27632300 [0,1,0,1,0,0|1,0,0]=3 15881 B9R1.9 [N-]=[N+]=NCC1CC(=O)C1 Amb33309595 [0,1,0,1,0,0|2,0,0]=4 15882 B9R1.24 CC1(C)CCCC1CBr Amb28347469 [0,1,0,1,0,0|1,0,1]=4 15883 B9R1.24 CC1(C)CCCC1CCl Amb25934181 [0,1,0,1,0,0|1,0,1]=4 15884 B9R1.24 CC1(C)CCCC1CN Amb8496596 [0,1,0,1,0,0|1,0,1]=4 15885 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|1,0,1]=4 15886 B9R1.24 CC1(F)CCCC1CN Amb28326209 [0,1,0,1,0,0|1,0,1]=4 15887 B9R1.24 CC1(O)CCCC1CO Amb28315472 [0,1,0,1,0,0|0,0,2]=4 15888 B9R1.24 CCC1CCCC1(C)N Amb32654937 [0,1,0,1,0,0|1,0,1]=4 15889 B9R1.24 CCC1CCCC1(C)N Amb32676685 [0,1,0,1,0,0|1,0,1]=4 15890 B9R1.24 CCC1CCNS1(=O)=O Amb33298957 [0,1,0,1,0,0|2,0,0]=4 15891 B9R1.24 CCC1CCOS1(=O)=O Amb27246498 [0,1,0,1,0,0|2,0,0]=4 15892 B9R1.24 CCC1CNCC1(C)O Amb18642714 [0,1,0,1,0,0|0,0,2]=4 15893 B9R1.24 CCC1COCC1(C)O Amb35612446 [0,1,0,1,0,0|0,0,2]=4 15894 B9R1.24 CCN1CCCS1(=O)=O Amb20075620 [0,1,0,1,0,0|2,0,0]=4 15895 B9R1.24 CO[C@@H]1CCC[C@@]1(C)Br Amb27624708 [0,1,0,1,0,0|1,0,1]=4 15896 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|1,0,1]=4 15897 B9R1.24 C[C@@]1(N)CCC[C@H]1CO Amb28055666 [0,1,0,1,0,0|1,0,1]=4 15898 B9R1.24 C[C@]1(N)CCC[C@H]1CO Amb1993801 [0,1,0,1,0,0|1,0,1]=4 15899 B9R1.24 NCC1CCCS1(=O)=O Amb17063302 [0,1,0,1,0,0|2,0,0]=4 15900 B9R1.24 NCC1CCCS1(=O)=O Amb32662917 [0,1,0,1,0,0|2,0,0]=4 15901 B9R1.24 O=S1(=O)CCCC1CCl Amb25808547 [0,1,0,1,0,0|2,0,0]=4 15902 B9R1.24 O=S1(=O)CCCC1CI Amb35732753 [0,1,0,1,0,0|2,0,0]=4 15903 B9R1.24 O=S1(=O)CCCC1CO Amb26400526 [0,1,0,1,0,0|2,0,0]=4 15904 B9R1.24 O=S1(=O)CCCC1CS Amb35673162 [0,1,0,1,0,0|2,0,0]=4 15905 B9R1.40 CC1(Br)CCCCC1O Amb28064001 [0,1,0,1,0,0|1,0,1]=4 15906 B9R1.40 CC1(C)CCCCC1N Amb18642545 [0,1,0,1,0,0|1,0,1]=4 15907 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|1,0,1]=4 15908 B9R1.40 CC1(C)CCCCC1S Amb27447161 [0,1,0,1,0,0|1,0,1]=4 15909 B9R1.40 CC1(C)CCCC[C@@H]1N Amb27242528 [0,1,0,1,0,0|1,0,1]=4 15910 B9R1.40 CC1(C)CCCC[C@@H]1O Amb28318455 [0,1,0,1,0,0|1,0,1]=4 15911 B9R1.40 CC1(C)CCCC[C@H]1O Amb28256801 [0,1,0,1,0,0|1,0,1]=4 15912 B9R1.40 CC1(Cl)CCCCC1O Amb28315439 [0,1,0,1,0,0|1,0,1]=4 15913 B9R1.40 CC1(N)CCCCC1F Amb28434786 [0,1,0,1,0,0|1,0,1]=4 15914 B9R1.40 CC1(N)CCCCC1I Amb27260255 [0,1,0,1,0,0|1,0,1]=4 15915 B9R1.40 CC1(N)CCCCC1O Amb28436950 [0,1,0,1,0,0|1,0,1]=4 15916 B9R1.40 CC1(O)CCCCC1Br Amb24480133 [0,1,0,1,0,0|0,0,2]=4 15917 B9R1.40 CC1(O)CCCCC1I Amb35665704 [0,1,0,1,0,0|0,0,2]=4 15918 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,1,0,1,0,0|0,0,2]=4 15919 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|1,0,1]=4 15920 B9R1.40 CC1CCCCC1(C)Cl Amb27789616 [0,1,0,1,0,0|1,0,1]=4 15921 B9R1.40 CC1CCCCC1(C)N Amb9676158 [0,1,0,1,0,0|1,0,1]=4 15922 B9R1.40 CC1CCCCC1(C)O Amb9675954 [0,1,0,1,0,0|0,0,2]=4 15923 B9R1.40 CC1CCCNS1(=O)=O Amb33164009 [0,1,0,1,0,0|2,0,0]=4 15924 B9R1.40 CC1CCCOS1(=O)=O Amb33742471 [0,1,0,1,0,0|2,0,0]=4 15925 B9R1.40 CC1CCNCC1(C)C Amb25091675 [0,1,0,1,0,0|1,0,1]=4 15926 B9R1.40 CC1CCNCC1(C)O Amb27618808 [0,1,0,1,0,0|0,0,2]=4 15927 B9R1.40 CC1CNCCC1(C)F Amb27761977 [0,1,0,1,0,0|1,0,1]=4 15928 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|0,0,2]=4 15929 B9R1.40 CC1CNCCS1(=O)=O Amb19374621 [0,1,0,1,0,0|2,0,0]=4 15930 B9R1.40 CC1CNCCS1(=O)=O Amb28895934 [0,1,0,1,0,0|2,0,0]=4 15931 B9R1.40 CC1NCCCC1(C)C Amb26414637 [0,1,0,1,0,0|1,0,1]=4 15932 B9R1.40 CC1OCCCC1(C)N Amb27951596 [0,1,0,1,0,0|1,0,1]=4 15933 B9R1.40 CC1SCCCC1(C)O Amb27978912 [0,1,0,1,0,0|0,0,2]=4 15934 B9R1.40 CN1CCCCS1(=O)=O Amb31217495 [0,1,0,1,0,0|2,0,0]=4 15935 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [0,1,0,1,0,0|0,0,2]=4 15936 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O Amb22886386 [0,1,0,1,0,0|0,0,2]=4 15937 B9R1.40 C[C@@H]1CNCCS1(=O)=O Amb32660291 [0,1,0,1,0,0|2,0,0]=4 15938 B9R1.40 C[C@@H]1CNCCS1(=O)=O Amb32660508 [0,1,0,1,0,0|2,0,0]=4 15939 B9R1.40 C[C@@]1(Br)CCCC[C@@H]1O Amb27978301 [0,1,0,1,0,0|1,0,1]=4 15940 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1Cl Amb27845490 [0,1,0,1,0,0|1,0,1]=4 15941 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|1,0,1]=4 15942 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1O Amb27463688 [0,1,0,1,0,0|1,0,1]=4 15943 B9R1.40 C[C@@]1(F)CCCC[C@H]1Br Amb27631449 [0,1,0,1,0,0|1,0,1]=4 15944 B9R1.40 C[C@@]1(F)CCCC[C@H]1O Amb28205454 [0,1,0,1,0,0|1,0,1]=4 15945 B9R1.40 C[C@@]1(N)CCCC[C@H]1I Amb27212307 [0,1,0,1,0,0|1,0,1]=4 15946 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|1,0,1]=4 15947 B9R1.40 C[C@@]1(O)CCCC[C@@H]1Br Amb27848102 [0,1,0,1,0,0|0,0,2]=4 15948 B9R1.40 C[C@@]1(O)CCCC[C@@H]1N Amb28134269 [0,1,0,1,0,0|0,0,2]=4 15949 B9R1.40 C[C@@]1(O)CCCC[C@H]1Br Amb26027155 [0,1,0,1,0,0|0,0,2]=4 15950 B9R1.40 C[C@@]1(O)CCCC[C@H]1I Amb35665703 [0,1,0,1,0,0|0,0,2]=4 15951 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,1,0,1,0,0|0,0,2]=4 15952 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|0,0,2]=4 15953 B9R1.40 C[C@H]1CNCCS1(=O)=O Amb32655856 [0,1,0,1,0,0|2,0,0]=4 15954 B9R1.40 C[C@H]1CNCCS1(=O)=O Amb32655857 [0,1,0,1,0,0|2,0,0]=4 15955 B9R1.40 C[C@]1(N)CCCC[C@H]1O Amb28061920 [0,1,0,1,0,0|1,0,1]=4 15956 B9R1.40 C[C@]1(O)CCCC[C@@H]1Cl Amb27966527 [0,1,0,1,0,0|0,0,2]=4 15957 B9R1.40 C[C@]1(O)CCCC[C@@H]1O Amb27427705 [0,1,0,1,0,0|0,0,2]=4 15958 B9R1.40 C[Si]1(C)CCCCC1Cl Amb27657096 [0,1,0,1,0,0|1,1,0]=4 15959 B9R1.40 C[Si]1(C)CCCCC1O Amb27981646 [0,1,0,1,0,0|1,1,0]=4 15960 B9R1.40 O=S1(=O)CCCCC1Cl Amb6382933 [0,1,0,1,0,0|2,0,0]=4 15961 B9R1.46 CC(=O)CCC1CC1C Amb25873753 [0,1,0,1,0,0|0,0,0]=2 15962 B9R1.46 CC(=O)CCC1OC1C Amb28194562 [0,1,0,1,0,0|0,0,0]=2 15963 B9R1.46 CC(=O)OCC1CC1C Amb27836351 [0,1,0,1,0,0|0,0,0]=2 15964 B9R1.46 CC(=O)SCC1CC1C Amb27965313 [0,1,0,1,0,0|0,0,0]=2 15965 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [0,1,0,1,0,0|0,0,1]=3 15966 B9R1.46 CC(=O)\C=C\[C@@H]1O[C@H]1C Amb26924328 [0,1,0,1,0,0|0,0,2]=4 15967 B9R1.46 CC(C)CN[C@@H]1C[C@H]1C Amb28349879 [0,1,0,1,0,0|1,0,1]=4 15968 B9R1.46 CC(C)NCC1CC1C Amb33549943 [0,1,0,1,0,0|1,0,1]=4 15969 B9R1.46 CC(C)NCC1CC1C Amb8853800 [0,1,0,1,0,0|1,0,1]=4 15970 B9R1.46 CC(Cl)OCC1CC1C Amb32716001 [0,1,0,1,0,0|1,0,1]=4 15971 B9R1.46 CC(N)CCC1CC1C Amb33448587 [0,1,0,1,0,0|1,0,1]=4 15972 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,1,0,1,0,0|0,0,2]=4 15973 B9R1.46 CC1CC1C#CC(=O)O Amb24390173 [0,1,0,1,0,0|1,0,1]=4 15974 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,1,0,1,0,0|1,0,0]=3 15975 B9R1.46 CC1CC1CC[C@@H](C)N Amb33144244 [0,1,0,1,0,0|1,0,1]=4 15976 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,1,0,1,0,0|0,0,2]=4 15977 B9R1.46 CC1CC1CC[C@H](C)N Amb33144243 [0,1,0,1,0,0|1,0,1]=4 15978 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,1,0,1,0,0|0,0,2]=4 15979 B9R1.46 CC1CC1CC[N+](=O)[O-] Amb33144228 [0,1,0,1,0,0|2,0,0]=4 15980 B9R1.46 CC1CC1CNC(=O)Cl Amb35625728 [0,1,0,1,0,0|1,0,0]=3 15981 B9R1.46 CC1CC1COC(=O)Cl Amb33296958 [0,1,0,1,0,0|1,0,0]=3 15982 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,1,0,1,0,0|1,0,0]=3 15983 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,1,0,1,0,0|1,0,0]=3 15984 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [0,1,0,1,0,0|1,0,1]=4 15985 B9R1.46 CN(C)CCC1CC1N Amb33272291 [0,1,0,1,0,0|2,0,0]=4 15986 B9R1.46 CN(C)CC[C@@H]1C[C@H]1N Amb33272292 [0,1,0,1,0,0|2,0,0]=4 15987 B9R1.56 CC1(C)CCC1CCO Amb27953782 [0,1,0,1,0,0|1,0,1]=4 15988 B9R1.67 C=C(C)CC1CCC1O Amb32945786 [0,1,0,1,0,0|1,0,0]=3 15989 B9R1.67 C=C(C)C[C@H]1SC[C@@H]1O Amb27207731 [0,1,0,1,0,0|2,0,0]=4 15990 B9R1.67 C=C(Cl)CC1CCC1O Amb32945357 [0,1,0,1,0,0|1,0,1]=4 15991 B9R1.67 CC(=N)NC1CCC1C Amb27599537 [0,1,0,1,0,0|1,0,0]=3 15992 B9R1.67 CC(=O)CC1CCC1F Amb27597070 [0,1,0,1,0,0|0,0,0]=2 15993 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,1,0,1,0,0|1,0,0]=3 15994 B9R1.67 CC(=O)O[C@@H]1CC[C@H]1Br Amb33328971 [0,1,0,1,0,0|1,0,0]=3 15995 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [0,1,0,1,0,0|0,0,1]=3 15996 B9R1.67 CC(C)=CC1CCC1O Amb32944793 [0,1,0,1,0,0|1,0,1]=4 15997 B9R1.67 CC(C)CC1CCC1O Amb33213816 [0,1,0,1,0,0|1,0,1]=4 15998 B9R1.67 CC(O)CN1CCC1C Amb27406013 [0,1,0,1,0,0|0,0,2]=4 15999 B9R1.67 CC1CCC1NC(=O)Cl Amb35633330 [0,1,0,1,0,0|1,0,0]=3 16000 B9R1.67 CC1CCC1NN(C)C Amb28323981 [0,1,0,1,0,0|2,0,0]=4 16001 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,0]=3 16002 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,0]=3 16003 B9R1.67 CC1CC\C1=N/S(C)=O Amb35718536 [0,1,0,1,0,0|1,0,1]=4 16004 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,1,0,1,0,0|1,0,0]=3 16005 B9R1.77 CC1(C)CC1CCCBr Amb27174355 [0,1,0,1,0,0|1,0,1]=4 16006 B9R1.77 CC1(C)CC1CCCCl Amb33228609 [0,1,0,1,0,0|1,0,1]=4 16007 B9R1.77 CC1(C)CC1CCCN Amb32992297 [0,1,0,1,0,0|1,0,1]=4 16008 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|1,0,1]=4 16009 B9R1.77 CCNCC1CC1(C)C Amb18300529 [0,1,0,1,0,0|1,0,1]=4 16010 B9R1.77 CCNC[C@H]1CC1(C)C Amb32650349 [0,1,0,1,0,0|1,0,1]=4 16011 B9R1.83 BrCCCCC=C1CC1 Amb28141873 [0,1,0,1,0,0|1,0,1]=4 16012 B9R1.83 BrCCCCCC1CC1 Amb32992758 [0,1,0,1,0,0|1,0,1]=4 16013 B9R1.83 CCCCCCC1=CC1 Amb27793496 [0,1,0,1,0,0|1,0,0]=3 16014 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|0,0,2]=4 16015 B9R1.83 CCCCCCC1CS1 Amb27873363 [0,1,0,1,0,0|0,1,1]=4 16016 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|0,0,2]=4 16017 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|0,0,2]=4 16018 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|0,1,1]=4 16019 B9R1.83 CCCCCNC1CC1 Amb6248403 [0,1,0,1,0,0|1,0,1]=4 16020 B9R1.83 CCCCNCC1CC1 Amb6686876 [0,1,0,1,0,0|1,0,1]=4 16021 B9R1.83 CCCCNCC1CO1 Amb27950731 [0,1,0,1,0,0|0,0,2]=4 16022 B9R1.83 CCCCOCC1CO1 Amb534220 [0,1,0,1,0,0|0,0,2]=4 16023 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,2]=4 16024 B9R1.83 CCCCOC[C@H]1CO1 Amb26926784 [0,1,0,1,0,0|0,0,2]=4 16025 B9R1.83 CCCCSC[C@H]1CO1 Amb27753323 [0,1,0,1,0,0|0,0,2]=4 16026 B9R1.83 CCCNCCC1CC1 Amb25921074 [0,1,0,1,0,0|1,0,1]=4 16027 B9R1.83 CCCSCCC1CC1 Amb28349579 [0,1,0,1,0,0|1,0,1]=4 16028 B9R1.83 CCCSCCC1CO1 Amb27256622 [0,1,0,1,0,0|0,0,2]=4 16029 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|1,0,1]=4 16030 B9R1.83 NCCCCCC1CC1 Amb18832667 [0,1,0,1,0,0|1,0,1]=4 16031 B9R1.83 NCCCCCN1CC1 Amb24078338 [0,1,0,1,0,0|2,0,0]=4 16032 B9R1.83 OCCCCC=C1CC1 Amb25889566 [0,1,0,1,0,0|1,0,1]=4 16033 B9R1.83 OCCCCCC1CO1 Amb28189365 [0,1,0,1,0,0|0,0,2]=4 16034 B9R1.84 C=C(C)CNC1CCC1 Amb18298086 [0,1,0,1,0,0|1,0,0]=3 16035 B9R1.84 C=C(C)CNC1COC1 Amb27481664 [0,1,0,1,0,0|2,0,0]=4 16036 B9R1.84 C=C(C)COC1CNC1 Amb22011761 [0,1,0,1,0,0|2,0,0]=4 16037 B9R1.84 CC(=N)NCC1CSC1 Amb30033048 [0,1,0,1,0,0|2,0,0]=4 16038 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,1,0,1,0,0|0,0,0]=2 16039 B9R1.84 CC(=O)CCC1CNC1 Amb33307594 [0,1,0,1,0,0|0,0,0]=2 16040 B9R1.84 CC(=O)CCC1COC1 Amb27670151 [0,1,0,1,0,0|0,0,0]=2 16041 B9R1.84 CC(=O)COC1CNC1 Amb27634342 [0,1,0,1,0,0|1,0,0]=3 16042 B9R1.84 CC(=O)NCC1CNC1 Amb28289479 [0,1,0,1,0,0|1,0,0]=3 16043 B9R1.84 CC(=O)NCC1CNC1 Amb33839583 [0,1,0,1,0,0|1,0,0]=3 16044 B9R1.84 CC(=O)NCC1CSC1 Amb35635237 [0,1,0,1,0,0|1,0,0]=3 16045 B9R1.84 CC(=O)NOC1CCC1 Amb27211499 [0,1,0,1,0,0|1,0,0]=3 16046 B9R1.84 CC(=O)OCC1CCC1 Amb27980327 [0,1,0,1,0,0|0,0,0]=2 16047 B9R1.84 CC(=O)\C=C\C1CCC1 Amb33448508 [0,1,0,1,0,0|0,0,1]=3 16048 B9R1.84 CC(Br)CCC1CCC1 Amb28143174 [0,1,0,1,0,0|1,0,1]=4 16049 B9R1.84 CC(C)CCC1CCN1 Amb27965282 [0,1,0,1,0,0|1,0,1]=4 16050 B9R1.84 CC(C)CCC1CNC1 Amb25115363 [0,1,0,1,0,0|1,0,1]=4 16051 B9R1.84 CC(C)CCN1CCC1 Amb27805290 [0,1,0,1,0,0|1,0,1]=4 16052 B9R1.84 CC(C)CSC1CCC1 Amb27837695 [0,1,0,1,0,0|1,0,1]=4 16053 B9R1.84 CC(C)NCC1CCC1 Amb32882526 [0,1,0,1,0,0|1,0,1]=4 16054 B9R1.84 CC(C)NCC1CCC1 Amb8853799 [0,1,0,1,0,0|1,0,1]=4 16055 B9R1.84 CC(Cl)OCC1CCC1 Amb32715996 [0,1,0,1,0,0|1,0,1]=4 16056 B9R1.84 CC(F)CNC1CCC1 Amb28133092 [0,1,0,1,0,0|1,0,1]=4 16057 B9R1.84 CC(N)CCC1CCC1 Amb25888957 [0,1,0,1,0,0|1,0,1]=4 16058 B9R1.84 CC(N)CCC1CCN1 Amb28195406 [0,1,0,1,0,0|1,0,1]=4 16059 B9R1.84 CC(N)CCN1CCC1 Amb27404116 [0,1,0,1,0,0|1,0,1]=4 16060 B9R1.84 CC(N)CNC1CCC1 Amb18990486 [0,1,0,1,0,0|1,0,1]=4 16061 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|0,0,2]=4 16062 B9R1.84 CC(O)CCC1COC1 Amb27795130 [0,1,0,1,0,0|0,0,2]=4 16063 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,1,0,1,0,0|0,0,2]=4 16064 B9R1.84 CN(C)CCC1CCN1 Amb27239994 [0,1,0,1,0,0|2,0,0]=4 16065 B9R1.84 CN(C)CCC1CNC1 Amb25789636 [0,1,0,1,0,0|2,0,0]=4 16066 B9R1.84 CN(N)CCC1CCC1 Amb35625937 [0,1,0,1,0,0|2,0,0]=4 16067 B9R1.84 CS(=O)NCC1CNC1 Amb27644826 [0,1,0,1,0,0|2,0,0]=4 16068 B9R1.84 CS(=O)\N=C\C1CCC1 Amb35693139 [0,1,0,1,0,0|1,0,1]=4 16069 B9R1.84 C[C@@H](N)CCC1CCC1 Amb33314113 [0,1,0,1,0,0|1,0,1]=4 16070 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|0,0,2]=4 16071 B9R1.84 C[C@@H](O)COC1CCC1 Amb27607585 [0,1,0,1,0,0|0,0,2]=4 16072 B9R1.84 C[C@H](N)CCC1CCC1 Amb33314112 [0,1,0,1,0,0|1,0,1]=4 16073 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|0,0,2]=4 16074 B9R1.84 NC(=O)C#CC1CCC1 Amb27783420 [0,1,0,1,0,0|1,0,1]=4 16075 B9R1.84 NC(=O)CCC1CCC1 Amb27196680 [0,1,0,1,0,0|1,0,0]=3 16076 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,1,0,1,0,0|1,0,0]=3 16077 B9R1.84 NC(=O)CNC1CNC1 Amb27394146 [0,1,0,1,0,0|2,0,0]=4 16078 B9R1.84 NC(=O)CNC1COC1 Amb27837511 [0,1,0,1,0,0|2,0,0]=4 16079 B9R1.84 NC(=O)CNC1CSC1 Amb27837658 [0,1,0,1,0,0|2,0,0]=4 16080 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,1,0,1,0,0|2,0,0]=4 16081 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,1,0,1,0,0|2,0,0]=4 16082 B9R1.84 NC(=O)COC1CNC1 Amb30585161 [0,1,0,1,0,0|2,0,0]=4 16083 B9R1.84 NC(=O)NCC1CCN1 Amb28052840 [0,1,0,1,0,0|2,0,0]=4 16084 B9R1.84 NC(=O)NCC1CSC1 Amb30037012 [0,1,0,1,0,0|2,0,0]=4 16085 B9R1.84 NC(=O)\C=C\C1CCC1 Amb27615014 [0,1,0,1,0,0|1,0,1]=4 16086 B9R1.84 NC(=S)NCC1CCC1 Amb8929531 [0,1,0,1,0,0|1,1,0]=4 16087 B9R1.84 NS(=O)CCC1CCC1 Amb32720704 [0,1,0,1,0,0|2,0,0]=4 16088 B9R1.84 O=C(Cl)NCC1CCC1 Amb35625731 [0,1,0,1,0,0|1,0,0]=3 16089 B9R1.84 O=C(Cl)NCC1CSC1 Amb35633440 [0,1,0,1,0,0|2,0,0]=4 16090 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,1,0,1,0,0|1,0,0]=3 16091 B9R1.84 O=C(Cl)OCC1COC1 Amb33297065 [0,1,0,1,0,0|2,0,0]=4 16092 B9R1.84 O=C(O)C#CC1CCC1 Amb26413119 [0,1,0,1,0,0|1,0,1]=4 16093 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|1,0,0]=3 16094 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,1,0,1,0,0|1,0,0]=3 16095 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,0]=3 16096 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,1,0,1,0,0|1,0,0]=3 16097 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,1,0,1,0,0|1,0,1]=4 16098 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,0]=3 16099 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|2,0,0]=4 16100 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|2,0,0]=4 16101 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,0]=3 16102 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|2,0,0]=4 16103 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|2,0,0]=4 16104 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|2,0,0]=4 16105 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|2,0,0]=4 16106 B9R1.84 O=C(O)CSC1COC1 Amb27589904 [0,1,0,1,0,0|2,0,0]=4 16107 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [0,1,0,1,0,0|1,0,1]=4 16108 B9R1.84 O=C([O-])CCC1CCO1 Amb32663662 [0,1,0,1,0,0|1,0,0]=3 16109 B9R1.84 O=C([O-])COC1COC1 Amb33744117 [0,1,0,1,0,0|2,0,0]=4 16110 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,1,0,1,0,0|2,0,0]=4 16111 B9R1.84 O=S([O-])CCC1CCC1 Amb26425804 [0,1,0,1,0,0|2,0,0]=4 16112 B9R1.84 O=[N+]([O-])CCC1CCC1 Amb15692934 [0,1,0,1,0,0|2,0,0]=4 16113 B9R1.85 C=C(C)CSCC1CC1 Amb28133272 [0,1,0,1,0,0|1,0,0]=3 16114 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [0,1,0,1,0,0|0,0,0]=2 16115 B9R1.85 CC(=O)CCNC1CC1 Amb24377194 [0,1,0,1,0,0|0,0,0]=2 16116 B9R1.85 CC(=O)CNCC1CC1 Amb27251858 [0,1,0,1,0,0|0,0,0]=2 16117 B9R1.85 CC(=O)C\C=C\C1CO1 Amb32938577 [0,1,0,1,0,0|0,0,2]=4 16118 B9R1.85 CC(=O)N\N=C\C1CC1 Amb28429930 [0,1,0,1,0,0|1,0,1]=4 16119 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [0,1,0,1,0,0|0,0,1]=3 16120 B9R1.85 CC(Br)CCCC1CC1 Amb33167096 [0,1,0,1,0,0|1,0,1]=4 16121 B9R1.85 CC(C)=CCCC1CC1 Amb30023883 [0,1,0,1,0,0|1,0,0]=3 16122 B9R1.85 CC(C)=CCCC1CO1 Amb28207204 [0,1,0,1,0,0|1,0,1]=4 16123 B9R1.85 CC(C)=CCNC1CC1 Amb24568220 [0,1,0,1,0,0|1,0,1]=4 16124 B9R1.85 CC(C)=NOCC1CC1 Amb27774647 [0,1,0,1,0,0|2,0,0]=4 16125 B9R1.85 CC(C)CCCC1CO1 Amb27232305 [0,1,0,1,0,0|0,0,2]=4 16126 B9R1.85 CC(C)CCNC1CC1 Amb1113142 [0,1,0,1,0,0|1,0,1]=4 16127 B9R1.85 CC(C)CCNC1CC1 Amb6239358 [0,1,0,1,0,0|1,0,1]=4 16128 B9R1.85 CC(C)CNCC1CC1 Amb6686738 [0,1,0,1,0,0|1,0,1]=4 16129 B9R1.85 CC(C)CSCC1CC1 Amb28319700 [0,1,0,1,0,0|1,0,1]=4 16130 B9R1.85 CC(C)NCCC1CC1 Amb19018994 [0,1,0,1,0,0|1,0,1]=4 16131 B9R1.85 CC(C)SCCC1CC1 Amb27218451 [0,1,0,1,0,0|1,0,1]=4 16132 B9R1.85 CC(Cl)OCCC1CC1 Amb32715999 [0,1,0,1,0,0|1,0,1]=4 16133 B9R1.85 CC(F)CCNC1CC1 Amb27200076 [0,1,0,1,0,0|1,0,1]=4 16134 B9R1.85 CC(N)CCCC1CC1 Amb32675321 [0,1,0,1,0,0|1,0,1]=4 16135 B9R1.85 CC(N)CCNC1CC1 Amb19007235 [0,1,0,1,0,0|1,0,1]=4 16136 B9R1.85 CC(N)CCSC1CC1 Amb28125928 [0,1,0,1,0,0|1,0,1]=4 16137 B9R1.85 CC(N)CNCC1CC1 Amb19009744 [0,1,0,1,0,0|1,0,1]=4 16138 B9R1.85 CC(N)COCC1CC1 Amb6749895 [0,1,0,1,0,0|1,0,1]=4 16139 B9R1.85 CC(N)CSCC1CC1 Amb28204055 [0,1,0,1,0,0|1,0,1]=4 16140 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,1,0,1,0,0|0,0,2]=4 16141 B9R1.85 CC(O)CNCC1CC1 Amb9423143 [0,1,0,1,0,0|0,0,2]=4 16142 B9R1.85 CC(O)COCC1CC1 Amb27835307 [0,1,0,1,0,0|0,0,2]=4 16143 B9R1.85 CN(C)CCCC1CO1 Amb26858852 [0,1,0,1,0,0|2,0,0]=4 16144 B9R1.85 CN(C)CCNC1CC1 Amb33552934 [0,1,0,1,0,0|2,0,0]=4 16145 B9R1.85 CN(C)CCNC1CC1 Amb6662201 [0,1,0,1,0,0|2,0,0]=4 16146 B9R1.85 C[C@@H](N)CCCC1CC1 Amb33361296 [0,1,0,1,0,0|1,0,1]=4 16147 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,1,0,1,0,0|0,0,2]=4 16148 B9R1.85 C[C@@H](O)CNCC1CC1 Amb28285299 [0,1,0,1,0,0|0,0,2]=4 16149 B9R1.85 C[C@H](N)CCCC1CC1 Amb33361291 [0,1,0,1,0,0|1,0,1]=4 16150 B9R1.85 C[C@H](N)CNCC1CC1 Amb27956499 [0,1,0,1,0,0|1,0,1]=4 16151 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,1,0,1,0,0|0,0,2]=4 16152 B9R1.85 C[C@H](O)COCC1CC1 Amb28397570 [0,1,0,1,0,0|0,0,2]=4 16153 B9R1.85 N=C(N)CCNC1CC1 Amb28289053 [0,1,0,1,0,0|2,0,0]=4 16154 B9R1.85 N=C(N)SCCC1CC1 Amb27180708 [0,1,0,1,0,0|2,0,0]=4 16155 B9R1.85 NC(=O)CCCC1CC1 Amb28193047 [0,1,0,1,0,0|1,0,0]=3 16156 B9R1.85 NC(=O)CCNC1CC1 Amb8841117 [0,1,0,1,0,0|1,0,0]=3 16157 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,1,0,1,0,0|1,0,0]=3 16158 B9R1.85 NC(=S)COCC1CC1 Amb6681251 [0,1,0,1,0,0|1,1,0]=4 16159 B9R1.85 NC(=S)NCCC1CC1 Amb24495275 [0,1,0,1,0,0|1,1,0]=4 16160 B9R1.85 NS(=O)CCCC1CC1 Amb32720967 [0,1,0,1,0,0|2,0,0]=4 16161 B9R1.85 O=C(Cl)NCCC1CC1 Amb35633396 [0,1,0,1,0,0|1,0,0]=3 16162 B9R1.85 O=C(Cl)OCCC1CC1 Amb27162058 [0,1,0,1,0,0|1,0,0]=3 16163 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,1,0,1,0,0|1,0,0]=3 16164 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [0,1,0,1,0,0|1,0,0]=3 16165 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [0,1,0,1,0,0|1,0,0]=3 16166 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,1,0,1,0,0|1,0,0]=3 16167 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,1,0,1,0,0|1,0,0]=3 16168 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [0,1,0,1,0,0|1,0,0]=3 16169 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,1,0,1,0,0|1,0,0]=3 16170 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,1,0,1,0,0|1,0,0]=3 16171 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,1,0,1,0,0|1,0,0]=3 16172 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,1,0,1,0,0|1,0,0]=3 16173 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [0,1,0,1,0,0|1,0,1]=4 16174 B9R1.85 O=S(Cl)CCCC1CC1 Amb32720966 [0,1,0,1,0,0|2,0,0]=4 16175 B9R1.85 O=S([O-])CCCC1CC1 Amb32755669 [0,1,0,1,0,0|2,0,0]=4 16176 B9R1.85 O=[N+]([O-])CCCC1CC1 Amb33361218 [0,1,0,1,0,0|2,0,0]=4 16177 B9R1.96 CC(=O)N1CCC1CN Amb27963054 [0,1,0,1,0,0|1,0,0]=3 16178 B9R1.96 CC(=O)N1CCC1CO Amb32685105 [0,1,0,1,0,0|1,0,0]=3 16179 B9R1.96 CC(=O)N1CC[C@@H]1CO Amb34138406 [0,1,0,1,0,0|1,0,0]=3 16180 B9R1.96 CC(=O)N1CC[C@H]1CO Amb34144357 [0,1,0,1,0,0|1,0,0]=3 16181 B9R1.96 CC(=O)[C@@H]1C=C[C@@H]1CO Amb26012593 [0,1,0,1,0,0|0,0,2]=4 16182 B9R1.96 CC(=O)[C@H]1C=C[C@H]1CO Amb27419915 [0,1,0,1,0,0|0,0,2]=4 16183 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,1,0,0|1,0,0]=3 16184 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,1,0,0|1,0,0]=3 16185 B9R1.96 CCC1NCC1C(C)C Amb27249802 [0,1,0,1,0,0|1,0,1]=4 16186 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [0,1,0,1,0,0|1,0,0]=3 16187 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [0,1,0,1,0,0|1,0,0]=3 16188 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [0,1,0,1,0,0|1,0,0]=3 16189 B9R1.96 CN(C)C1CCC1CO Amb25783398 [0,1,0,1,0,0|2,0,0]=4 16190 B9R1.96 CN(C)[C@@H]1CC[C@@H]1CO Amb26970256 [0,1,0,1,0,0|2,0,0]=4 16191 B9R1.96 CN(C)[C@@H]1CC[C@H]1CO Amb27856834 [0,1,0,1,0,0|2,0,0]=4 16192 B9R1.96 CN(C)[C@H]1CC[C@H]1CO Amb34912849 [0,1,0,1,0,0|2,0,0]=4 16193 B9R1.96 CN[C@H]1CC[C@@H]1N(C)C Amb27881691 [0,1,0,1,0,0|2,0,0]=4 16194 B9R1.96 COC1CCC1C(=O)O Amb26516125 [0,1,0,1,0,0|1,0,0]=3 16195 B9R1.96 COC1CCC1C(N)=O Amb27645560 [0,1,0,1,0,0|1,0,0]=3 16196 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [0,1,0,1,0,0|1,0,0]=3 16197 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [0,1,0,1,0,0|1,0,0]=3 16198 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [0,1,0,1,0,0|1,0,1]=4 16199 B9R1.96 N#CC1CCC1C(N)=O Amb28285146 [0,1,0,1,0,0|1,0,1]=4 16200 B9R1.96 NC(=O)N1CCC1CO Amb27463478 [0,1,0,1,0,0|2,0,0]=4 16201 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [0,1,0,1,0,0|1,0,0]=3 16202 B9R1.96 NC[C@H]1CC[C@@H]1C(N)=O Amb27966233 [0,1,0,1,0,0|1,0,0]=3 16203 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|1,0,0]=3 16204 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [0,1,0,1,0,0|1,0,0]=3 16205 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [0,1,0,1,0,0|2,0,0]=4 16206 B9R1.148 CC1(C)CCCCCN1 Amb18832660 [0,1,0,1,0,0|1,0,1]=4 16207 B9R1.148 CC1(C)CCCCNC1 Amb24611736 [0,1,0,1,0,0|1,0,1]=4 16208 B9R1.148 CC1(C)CCCNCC1 Amb18832664 [0,1,0,1,0,0|1,0,1]=4 16209 B9R1.148 CC1(C)CCCNCC1 Amb33715839 [0,1,0,1,0,0|1,0,1]=4 16210 B9R1.148 CC1(F)CCCCNC1 Amb22886308 [0,1,0,1,0,0|1,0,1]=4 16211 B9R1.148 CC1(F)CCCCNC1 Amb24672176 [0,1,0,1,0,0|1,0,1]=4 16212 B9R1.148 CC1(F)CCCNCC1 Amb22886292 [0,1,0,1,0,0|1,0,1]=4 16213 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|1,0,1]=4 16214 B9R1.148 CC1(N)CCCCCC1 Amb9676104 [0,1,0,1,0,0|1,0,1]=4 16215 B9R1.148 CC1(O)CCCCCC1 Amb4017691 [0,1,0,1,0,0|0,0,2]=4 16216 B9R1.148 CC1(O)CCCCNC1 Amb22886278 [0,1,0,1,0,0|0,0,2]=4 16217 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|0,0,2]=4 16218 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|0,0,2]=4 16219 B9R1.148 CC1(O)CCCNCC1 Amb32409389 [0,1,0,1,0,0|0,0,2]=4 16220 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|0,0,2]=4 16221 B9R1.148 CC1(O)CCCSCC1 Amb35692681 [0,1,0,1,0,0|0,0,2]=4 16222 B9R1.148 FC1(F)CCCCCC1 Amb26917791 [0,1,0,1,0,0|1,0,1]=4 16223 B9R1.148 N=S1(=O)CCCCCC1 Amb33210095 [0,1,0,1,0,0|1,0,0]=3 16224 B9R1.148 N=S1(=O)CCCCCC1 Amb33483926 [0,1,0,1,0,0|1,0,0]=3 16225 B9R1.148 N=S1(=O)CCCNCC1 Amb32757512 [0,1,0,1,0,0|2,0,0]=4 16226 B9R1.148 O=S1(=O)CCCCCN1 Amb35789267 [0,1,0,1,0,0|2,0,0]=4 16227 B9R1.148 O=S1(=O)CCCNCC1 Amb10610583 [0,1,0,1,0,0|2,0,0]=4 16228 B9R1.148 O=S1(=O)CCCNCC1 Amb19299932 [0,1,0,1,0,0|2,0,0]=4 16229 B9R1.148 O=S1(=O)CCCNCC1 Amb21960984 [0,1,0,1,0,0|2,0,0]=4 16230 B9R1.23 C=C1CC(CC)OC1=O Amb8389609 [0,1,0,1,0,0|1,0,1]=4 16231 B9R1.23 CC1CC(CO)CC1=O Amb27222031 [0,1,0,1,0,0|1,0,0]=3 16232 B9R1.23 CC1CC(CO)NC1=O Amb2695752 [0,1,0,1,0,0|2,0,0]=4 16233 B9R1.23 CC1OC(CI)CC1=O Amb27842117 [0,1,0,1,0,0|2,0,0]=4 16234 B9R1.23 CC1OC(CO)CC1=O Amb28122421 [0,1,0,1,0,0|2,0,0]=4 16235 B9R1.23 CCC1CC(=O)C(=O)O1 Amb27838789 [0,1,0,1,0,0|1,0,1]=4 16236 B9R1.23 CCC1CC(C)C(=N)N1 Amb27952045 [0,1,0,1,0,0|2,0,0]=4 16237 B9R1.23 CCC1CC(C)C(=O)N1 Amb20623299 [0,1,0,1,0,0|1,0,0]=3 16238 B9R1.23 CCC1CC(N)C(=O)O1 Amb27647519 [0,1,0,1,0,0|1,0,0]=3 16239 B9R1.23 CCC1CC(O)C(=O)O1 Amb28049114 [0,1,0,1,0,0|1,0,0]=3 16240 B9R1.23 CCC1CC(O)C(C)N1 Amb23453816 [0,1,0,1,0,0|1,0,1]=4 16241 B9R1.23 CCC1N=C(C)C(C)S1 Amb15691844 [0,1,0,1,0,0|2,0,0]=4 16242 B9R1.23 CCC1NC(=O)C(C)O1 Amb27598696 [0,1,0,1,0,0|2,0,0]=4 16243 B9R1.23 CCC1OC(=O)C(F)S1 Amb27232508 [0,1,0,1,0,0|2,0,0]=4 16244 B9R1.23 CCN1CC(=O)C(C)C1 Amb20667767 [0,1,0,1,0,0|1,0,0]=3 16245 B9R1.23 CCN1CC(=O)N(C)C1 Amb27447020 [0,1,0,1,0,0|2,0,0]=4 16246 B9R1.23 CC[C@@H]1C[C@@H](O)C(=O)O1 Amb27472678 [0,1,0,1,0,0|1,0,0]=3 16247 B9R1.23 CC[C@@H]1C[C@H](O)C(=O)O1 Amb27184446 [0,1,0,1,0,0|1,0,0]=3 16248 B9R1.23 CC[C@@H]1NC(=O)[C@@H](C)O1 Amb27422034 [0,1,0,1,0,0|2,0,0]=4 16249 B9R1.23 CC[C@@H]1NC(=O)[C@H](C)O1 Amb27436685 [0,1,0,1,0,0|2,0,0]=4 16250 B9R1.23 CC[C@@H]1OC(=O)[C@@H](F)S1 Amb28123499 [0,1,0,1,0,0|2,0,0]=4 16251 B9R1.23 CC[C@H]1C[C@@H](O)C(=O)O1 Amb27428268 [0,1,0,1,0,0|1,0,0]=3 16252 B9R1.23 CC[C@H]1OC(=O)[C@@H](F)S1 Amb24514953 [0,1,0,1,0,0|2,0,0]=4 16253 B9R1.23 CN1CC(CBr)CC1=O Amb27838585 [0,1,0,1,0,0|2,0,0]=4 16254 B9R1.23 CN1CC(CCl)CC1=O Amb35781907 [0,1,0,1,0,0|2,0,0]=4 16255 B9R1.23 CN1CC(CN)CC1=O Amb22587624 [0,1,0,1,0,0|2,0,0]=4 16256 B9R1.23 CN1CC(CN)CC1=O Amb28991376 [0,1,0,1,0,0|2,0,0]=4 16257 B9R1.23 CN1CC(CN)CC1=O Amb33542734 [0,1,0,1,0,0|2,0,0]=4 16258 B9R1.23 CN1CC(CO)CC1=O Amb10607401 [0,1,0,1,0,0|2,0,0]=4 16259 B9R1.23 CNC1CC(=O)N(C)C1 Amb25142512 [0,1,0,1,0,0|2,0,0]=4 16260 B9R1.23 COC1CC(=O)C(=O)C1 Amb9782775 [0,1,0,1,0,0|1,0,1]=4 16261 B9R1.23 C[C@@H]1C[C@@H](CN)OC1=O Amb27440489 [0,1,0,1,0,0|2,0,0]=4 16262 B9R1.23 C[C@@H]1O[C@@H](CI)CC1=O Amb27857507 [0,1,0,1,0,0|2,0,0]=4 16263 B9R1.23 C[C@@H]1O[C@H](CI)CC1=O Amb27486233 [0,1,0,1,0,0|2,0,0]=4 16264 B9R1.23 C[C@H]1C[C@@H](CBr)SC1=O Amb27439099 [0,1,0,1,0,0|2,0,0]=4 16265 B9R1.23 C[C@H]1C[C@@H](CO)OC1=O Amb28429767 [0,1,0,1,0,0|2,0,0]=4 16266 B9R1.23 C[C@H]1C[C@H](CO)NC1=O Amb27422040 [0,1,0,1,0,0|2,0,0]=4 16267 B9R1.23 C[C@H]1O[C@H](CI)CC1=O Amb28053405 [0,1,0,1,0,0|2,0,0]=4 16268 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [0,1,0,1,0,0|2,0,0]=4 16269 B9R1.23 NC[C@@H]1C[C@H](N)C(=O)O1 Amb27851651 [0,1,0,1,0,0|2,0,0]=4 16270 B9R1.23 N[C@H]1C[C@@H](CO)OC1=O Amb28059280 [0,1,0,1,0,0|2,0,0]=4 16271 B9R1.23 N[C@H]1C[C@H](CBr)OC1=O Amb27233512 [0,1,0,1,0,0|2,0,0]=4 16272 B9R1.23 O=C1NC(CO)CC1F Amb27394226 [0,1,0,1,0,0|2,0,0]=4 16273 B9R1.23 O=C1OC(CBr)CC1O Amb27760415 [0,1,0,1,0,0|2,0,0]=4 16274 B9R1.23 O=C1OC(CCl)CC1O Amb27841626 [0,1,0,1,0,0|2,0,0]=4 16275 B9R1.23 O=C1O[C@@H](CO)C[C@@H]1O Amb27783829 [0,1,0,1,0,0|2,0,0]=4 16276 B9R1.35 C=C(C)C1CCC(=O)N1 Amb27196085 [0,1,0,1,0,0|1,0,1]=4 16277 B9R1.35 C=C(C)C1CCC(O)C1 Amb27807267 [0,1,0,1,0,0|1,0,0]=3 16278 B9R1.35 C=C(C)C1CNC(=O)C1 Amb25921040 [0,1,0,1,0,0|1,0,1]=4 16279 B9R1.35 C=C(C)[C@@H]1CC[C@H](O)C1 Amb27857420 [0,1,0,1,0,0|1,0,0]=3 16280 B9R1.35 C=C(C)[C@H]1COC(O)C1 Amb27956635 [0,1,0,1,0,0|2,0,0]=4 16281 B9R1.35 C=C(C)[C@H]1C[C@H](O)CO1 Amb28401070 [0,1,0,1,0,0|2,0,0]=4 16282 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,1,0,1,0,0|1,0,1]=4 16283 B9R1.35 C=C1CCC(C(C)=O)C1 Amb27476121 [0,1,0,1,0,0|0,0,1]=3 16284 B9R1.35 C=C1CCC(C(C)C)C1 Amb28342758 [0,1,0,1,0,0|1,0,0]=3 16285 B9R1.35 C=C1CCN(C(C)=O)C1 Amb29879291 [0,1,0,1,0,0|1,0,1]=4 16286 B9R1.35 C=C1COC(C(C)C)C1 Amb35584917 [0,1,0,1,0,0|2,0,0]=4 16287 B9R1.35 CC(=N)N1CCC(F)C1 Amb35626212 [0,1,0,1,0,0|2,0,0]=4 16288 B9R1.35 CC(=O)C1=CCC(N)C1 Amb35741226 [0,1,0,1,0,0|0,0,2]=4 16289 B9R1.35 CC(=O)C1C=C(C)CC1 Amb28137737 [0,1,0,1,0,0|0,0,1]=3 16290 B9R1.35 CC(=O)C1C=CC(N)C1 Amb25889700 [0,1,0,1,0,0|0,0,2]=4 16291 B9R1.35 CC(=O)C1CC(C)CO1 Amb27780018 [0,1,0,1,0,0|1,0,0]=3 16292 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [0,1,0,1,0,0|0,0,2]=4 16293 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [0,1,0,1,0,0|0,0,1]=3 16294 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [0,1,0,1,0,0|1,0,1]=4 16295 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [0,1,0,1,0,0|0,0,0]=2 16296 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [0,1,0,1,0,0|0,0,0]=2 16297 B9R1.35 CC(=O)C1CCC(O)O1 Amb27838664 [0,1,0,1,0,0|1,0,0]=3 16298 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [0,1,0,1,0,0|1,0,0]=3 16299 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [0,1,0,1,0,0|0,0,0]=2 16300 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [0,1,0,1,0,0|0,0,0]=2 16301 B9R1.35 CC(=O)C1CN=C(C)O1 Amb26529070 [0,1,0,1,0,0|1,0,1]=4 16302 B9R1.35 CC(=O)C1CNC(=O)C1 Amb27488585 [0,1,0,1,0,0|1,0,1]=4 16303 B9R1.35 CC(=O)C1SCC(C)S1 Amb24676738 [0,1,0,1,0,0|1,0,0]=3 16304 B9R1.35 CC(=O)N1CCC(=O)C1 Amb18832698 [0,1,0,1,0,0|1,0,1]=4 16305 B9R1.35 CC(=O)N1CCC(F)C1 Amb35614292 [0,1,0,1,0,0|1,0,0]=3 16306 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,1,0,1,0,0|1,0,0]=3 16307 B9R1.35 CC(=O)N1CCC(N)C1 Amb33549525 [0,1,0,1,0,0|1,0,0]=3 16308 B9R1.35 CC(=O)N1CCC(O)C1 Amb20622704 [0,1,0,1,0,0|1,0,0]=3 16309 B9R1.35 CC(=O)N1CC[C@@H](Br)C1 Amb22227483 [0,1,0,1,0,0|1,0,0]=3 16310 B9R1.35 CC(=O)N1CC[C@@H](Cl)C1 Amb22227481 [0,1,0,1,0,0|1,0,0]=3 16311 B9R1.35 CC(=O)N1CC[C@@H](I)C1 Amb22227495 [0,1,0,1,0,0|1,0,0]=3 16312 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb19891343 [0,1,0,1,0,0|1,0,0]=3 16313 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb22227487 [0,1,0,1,0,0|1,0,0]=3 16314 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,1,0,1,0,0|1,0,0]=3 16315 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 Amb22227524 [0,1,0,1,0,0|1,0,0]=3 16316 B9R1.35 CC(=O)N1CC[C@H](I)C1 Amb22227531 [0,1,0,1,0,0|1,0,0]=3 16317 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb19890016 [0,1,0,1,0,0|1,0,0]=3 16318 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb22227520 [0,1,0,1,0,0|1,0,0]=3 16319 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,1,0,1,0,0|1,0,0]=3 16320 B9R1.35 CC(=O)N1C[C@@H](O)CO1 Amb27956502 [0,1,0,1,0,0|2,0,0]=4 16321 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [0,1,0,1,0,0|0,0,1]=3 16322 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [0,1,0,1,0,0|1,0,1]=4 16323 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,1,0,1,0,0|1,0,1]=4 16324 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [0,1,0,1,0,0|0,0,0]=2 16325 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [0,1,0,1,0,0|0,0,0]=2 16326 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [0,1,0,1,0,0|0,0,0]=2 16327 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [0,1,0,1,0,0|0,0,1]=3 16328 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [0,1,0,1,0,0|1,0,1]=4 16329 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [0,1,0,1,0,0|1,0,1]=4 16330 B9R1.35 CC(Br)C1CNC(=O)O1 Amb27424630 [0,1,0,1,0,0|2,0,0]=4 16331 B9R1.35 CC(C)=C1CCC(C)N1 Amb27164314 [0,1,0,1,0,0|1,0,1]=4 16332 B9R1.35 CC(C)=C1CCC(N)C1 Amb28347423 [0,1,0,1,0,0|1,0,1]=4 16333 B9R1.35 CC(C)=C1CCC(O)C1 Amb27956597 [0,1,0,1,0,0|1,0,1]=4 16334 B9R1.35 CC(C)C1=CC(=O)CC1 Amb26866593 [0,1,0,1,0,0|0,0,2]=4 16335 B9R1.35 CC(C)C1C=CC(=O)C1 Amb27838734 [0,1,0,1,0,0|0,0,2]=4 16336 B9R1.35 CC(C)C1CC(=O)CS1 Amb25263073 [0,1,0,1,0,0|1,0,0]=3 16337 B9R1.35 CC(C)C1CCC(=O)C1 Amb25147190 [0,1,0,1,0,0|0,0,0]=2 16338 B9R1.35 CC(C)C1CCC(=O)N1 Amb24120594 [0,1,0,1,0,0|1,0,0]=3 16339 B9R1.35 CC(C)C1CCC(N)C1 Amb28134103 [0,1,0,1,0,0|1,0,1]=4 16340 B9R1.35 CC(C)C1CCN(N)C1 Amb25334150 [0,1,0,1,0,0|2,0,0]=4 16341 B9R1.35 CC(C)C1CN=C(N)C1 Amb26848193 [0,1,0,1,0,0|2,0,0]=4 16342 B9R1.35 CC(C)C1CNC(=O)C1 Amb19305356 [0,1,0,1,0,0|1,0,0]=3 16343 B9R1.35 CC(C)C1CNC(=O)N1 Amb17506854 [0,1,0,1,0,0|2,0,0]=4 16344 B9R1.35 CC(C)C1CNC(=O)O1 Amb27494066 [0,1,0,1,0,0|2,0,0]=4 16345 B9R1.35 CC(C)C1COC(=O)N1 Amb10071773 [0,1,0,1,0,0|2,0,0]=4 16346 B9R1.35 CC(C)C1CSC(=O)N1 Amb27784925 [0,1,0,1,0,0|2,0,0]=4 16347 B9R1.35 CC(C)C1NCC(=O)N1 Amb27948988 [0,1,0,1,0,0|2,0,0]=4 16348 B9R1.35 CC(C)N1CCC(=O)C1 Amb22587607 [0,1,0,1,0,0|1,0,0]=3 16349 B9R1.35 CC(C)N1CCC(=O)C1 Amb33528255 [0,1,0,1,0,0|1,0,0]=3 16350 B9R1.35 CC(C)[C@@H]1CCC(=O)C1 Amb27255871 [0,1,0,1,0,0|0,0,0]=2 16351 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 Amb24476688 [0,1,0,1,0,0|1,0,0]=3 16352 B9R1.35 CC(C)[C@@H]1CC[C@H](N)C1 Amb27968993 [0,1,0,1,0,0|1,0,1]=4 16353 B9R1.35 CC(C)[C@@H]1CNC(=O)C1 Amb24446919 [0,1,0,1,0,0|1,0,0]=3 16354 B9R1.35 CC(C)[C@@H]1CNC(=O)N1 Amb27816928 [0,1,0,1,0,0|2,0,0]=4 16355 B9R1.35 CC(C)[C@@H]1COC(=O)N1 Amb8515206 [0,1,0,1,0,0|2,0,0]=4 16356 B9R1.35 CC(C)[C@H]1CCC(=O)C1 Amb27589313 [0,1,0,1,0,0|0,0,0]=2 16357 B9R1.35 CC(C)[C@H]1CCC(=O)N1 Amb27253005 [0,1,0,1,0,0|1,0,0]=3 16358 B9R1.35 CC(C)[C@H]1CC[C@H](O)C1 Amb28292198 [0,1,0,1,0,0|0,0,2]=4 16359 B9R1.35 CC(C)[C@H]1CNC(=O)C1 Amb28248188 [0,1,0,1,0,0|1,0,0]=3 16360 B9R1.35 CC(C)[C@H]1COC(=O)C1 Amb27242562 [0,1,0,1,0,0|1,0,0]=3 16361 B9R1.35 CC(C)[C@H]1COC(=O)N1 Amb8385596 [0,1,0,1,0,0|2,0,0]=4 16362 B9R1.35 CC(Cl)C1CCC(=O)C1 Amb27983825 [0,1,0,1,0,0|0,0,0]=2 16363 B9R1.35 CC(F)C1CCC(N)C1 Amb27792295 [0,1,0,1,0,0|1,0,1]=4 16364 B9R1.35 CC(N)C1CCN(C)C1 Amb18832585 [0,1,0,1,0,0|2,0,0]=4 16365 B9R1.35 CC(N)C1CCN(C)C1 Amb33743884 [0,1,0,1,0,0|2,0,0]=4 16366 B9R1.35 CC(N)C1CC[C@@H](C)O1 Amb33423876 [0,1,0,1,0,0|0,0,2]=4 16367 B9R1.35 CC(O)C1=CC(=O)CC1 Amb28146470 [0,1,0,1,0,0|0,0,2]=4 16368 B9R1.35 CC(O)C1CC(=O)NN1 Amb28285281 [0,1,0,1,0,0|2,0,0]=4 16369 B9R1.35 CC(O)C1CCC(=O)O1 Amb25998293 [0,1,0,1,0,0|1,0,0]=3 16370 B9R1.35 CC(O)C1CCC(N)C1 Amb35582009 [0,1,0,1,0,0|0,0,2]=4 16371 B9R1.35 CC(O)C1CNC(=O)C1 Amb27258070 [0,1,0,1,0,0|1,0,0]=3 16372 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,1,0,1,0,0|1,0,1]=4 16373 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,1,0,1,0,0|1,0,1]=4 16374 B9R1.35 CC1=NC(C(C)C)CN1 Amb35737149 [0,1,0,1,0,0|2,0,0]=4 16375 B9R1.35 CC1=NC(C(C)C)CS1 Amb27946060 [0,1,0,1,0,0|2,0,0]=4 16376 B9R1.35 CC1=NC(C(C)O)CN1 Amb29877862 [0,1,0,1,0,0|2,0,0]=4 16377 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,1,0,1,0,0|1,0,1]=4 16378 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,1,0,1,0,0|1,0,1]=4 16379 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,1,0,1,0,0|2,0,0]=4 16380 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,1,0,1,0,0|2,0,0]=4 16381 B9R1.35 CC1CC(C(N)=O)CN1 Amb27665690 [0,1,0,1,0,0|2,0,0]=4 16382 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [0,1,0,1,0,0|1,0,0]=3 16383 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,1,0,1,0,0|1,0,0]=3 16384 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,1,0,1,0,0|1,0,0]=3 16385 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,1,0,1,0,0|1,0,0]=3 16386 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,1,0,1,0,0|1,0,0]=3 16387 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,1,0,1,0,0|1,0,0]=3 16388 B9R1.35 CC1CCC(C(C)C)N1 Amb24376459 [0,1,0,1,0,0|1,0,1]=4 16389 B9R1.35 CC1CCC(C(C)N)C1 Amb25742195 [0,1,0,1,0,0|1,0,1]=4 16390 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [0,1,0,1,0,0|1,0,0]=3 16391 B9R1.35 CC1CCC(C(N)=S)O1 Amb27858136 [0,1,0,1,0,0|1,1,0]=4 16392 B9R1.35 CC1CCC(S(=O)Cl)C1 Amb32720564 [0,1,0,1,0,0|2,0,0]=4 16393 B9R1.35 CC1CCC(S(=O)[O-])C1 Amb32755283 [0,1,0,1,0,0|2,0,0]=4 16394 B9R1.35 CC1CCC(S(N)=O)C1 Amb32720565 [0,1,0,1,0,0|2,0,0]=4 16395 B9R1.35 CC1CCC([C@@H](C)N)C1 Amb25147002 [0,1,0,1,0,0|1,0,1]=4 16396 B9R1.35 CC1CCC([C@H](C)N)C1 Amb27628570 [0,1,0,1,0,0|1,0,1]=4 16397 B9R1.35 CC1CCC([C@H](C)N)O1 Amb28072103 [0,1,0,1,0,0|0,0,2]=4 16398 B9R1.35 CC1CCC([C@H](C)O)O1 Amb27959437 [0,1,0,1,0,0|0,0,2]=4 16399 B9R1.35 CC1CCN(C(=O)Cl)C1 Amb27391470 [0,1,0,1,0,0|2,0,0]=4 16400 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,1,0,1,0,0|1,0,0]=3 16401 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [0,1,0,1,0,0|2,0,0]=4 16402 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,1,0,1,0,0|2,0,0]=4 16403 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,1,0,1,0,0|2,0,0]=4 16404 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,1,0,1,0,0|2,0,0]=4 16405 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [0,1,0,1,0,0|2,0,0]=4 16406 B9R1.35 CC1NC(C(N)=O)CS1 Amb28194888 [0,1,0,1,0,0|2,0,0]=4 16407 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [0,1,0,1,0,0|2,0,0]=4 16408 B9R1.35 CN(C)C1CCC(N)C1 Amb18063142 [0,1,0,1,0,0|2,0,0]=4 16409 B9R1.35 CN(C)C1CCC(O)C1 Amb25311037 [0,1,0,1,0,0|2,0,0]=4 16410 B9R1.35 CN(C)[C@@H]1CC[C@@H](N)C1 Amb26641975 [0,1,0,1,0,0|2,0,0]=4 16411 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb25338336 [0,1,0,1,0,0|2,0,0]=4 16412 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb33620308 [0,1,0,1,0,0|2,0,0]=4 16413 B9R1.35 CN(C)[C@@H]1CC[C@H](N)C1 Amb27152509 [0,1,0,1,0,0|2,0,0]=4 16414 B9R1.35 CN(C)[C@@H]1CC[C@H](N)C1 Amb33734643 [0,1,0,1,0,0|2,0,0]=4 16415 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb24516012 [0,1,0,1,0,0|2,0,0]=4 16416 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb33620307 [0,1,0,1,0,0|2,0,0]=4 16417 B9R1.35 CN(C)[C@H]1CC[C@@H](N)C1 Amb27488380 [0,1,0,1,0,0|2,0,0]=4 16418 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,1,0,1,0,0|2,0,0]=4 16419 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,1,0,1,0,0|2,0,0]=4 16420 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,1,0,1,0,0|2,0,0]=4 16421 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,1,0,1,0,0|2,0,0]=4 16422 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,1,0,1,0,0|2,0,0]=4 16423 B9R1.35 CS(=O)C1CCC(N)C1 Amb27229434 [0,1,0,1,0,0|1,0,0]=3 16424 B9R1.35 CS(=O)C1CCC(O)C1 Amb33620330 [0,1,0,1,0,0|1,0,0]=3 16425 B9R1.35 CS(=O)N1CCC(N)C1 Amb28324201 [0,1,0,1,0,0|2,0,0]=4 16426 B9R1.35 CS(=O)N1CC[C@H](O)C1 Amb28254372 [0,1,0,1,0,0|2,0,0]=4 16427 B9R1.35 C[C@@H](F)[C@@H]1COC(=O)N1 Amb33715177 [0,1,0,1,0,0|2,0,0]=4 16428 B9R1.35 C[C@@H](N)C1CCN(C)C1 Amb35642875 [0,1,0,1,0,0|2,0,0]=4 16429 B9R1.35 C[C@@H](N)[C@H]1CCC(=O)O1 Amb28456584 [0,1,0,1,0,0|1,0,0]=3 16430 B9R1.35 C[C@@H](O)C1CNC(=O)C1 Amb27390672 [0,1,0,1,0,0|1,0,0]=3 16431 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NN1 Amb27632305 [0,1,0,1,0,0|2,0,0]=4 16432 B9R1.35 C[C@@H](O)[C@H]1CC(=O)NN1 Amb27422060 [0,1,0,1,0,0|2,0,0]=4 16433 B9R1.35 C[C@@H](O)[C@H]1CCN(C)C1 Amb27981809 [0,1,0,1,0,0|2,0,0]=4 16434 B9R1.35 C[C@@H]1CCC(C(=N)N)O1 Amb32730393 [0,1,0,1,0,0|2,0,0]=4 16435 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,1,0,1,0,0|1,0,0]=3 16436 B9R1.35 C[C@@H]1CCC(C(N)=S)O1 Amb32730369 [0,1,0,1,0,0|1,1,0]=4 16437 B9R1.35 C[C@@H]1CCC([C@@H](C)N)O1 Amb33423296 [0,1,0,1,0,0|0,0,2]=4 16438 B9R1.35 C[C@@H]1CCC([C@@H](C)O)O1 Amb33423376 [0,1,0,1,0,0|0,0,2]=4 16439 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,1,0,1,0,0|1,0,0]=3 16440 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,1,0,1,0,0|1,0,0]=3 16441 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [0,1,0,1,0,0|1,0,0]=3 16442 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,1,0,1,0,0|1,0,0]=3 16443 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,1,0,1,0,0|1,0,0]=3 16444 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,1,0,1,0,0|1,0,0]=3 16445 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,1,0,1,0,0|1,0,0]=3 16446 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,1,0,1,0,0|2,0,0]=4 16447 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,1,0,1,0,0|2,0,0]=4 16448 B9R1.35 C[C@@H]1CS[C@@H](C(=O)Cl)S1 Amb25110654 [0,1,0,1,0,0|2,0,0]=4 16449 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,1,0,1,0,0|2,0,0]=4 16450 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [0,1,0,1,0,0|2,0,0]=4 16451 B9R1.35 C[C@H](N)C1CCN(C)C1 Amb35637602 [0,1,0,1,0,0|2,0,0]=4 16452 B9R1.35 C[C@H](N)C1CC[C@@H](C)O1 Amb33423377 [0,1,0,1,0,0|0,0,2]=4 16453 B9R1.35 C[C@H](N)[C@H]1CCC(=O)O1 Amb27850574 [0,1,0,1,0,0|1,0,0]=3 16454 B9R1.35 C[C@H](O)C1CC[C@@H](C)O1 Amb33423345 [0,1,0,1,0,0|0,0,2]=4 16455 B9R1.35 C[C@H](O)C1CNC(=O)C1 Amb27838586 [0,1,0,1,0,0|1,0,0]=3 16456 B9R1.35 C[C@H](O)[C@@H]1COC(=O)O1 Amb27197946 [0,1,0,1,0,0|2,0,0]=4 16457 B9R1.35 C[C@H](O)[C@H]1CC(=O)NN1 Amb27789842 [0,1,0,1,0,0|2,0,0]=4 16458 B9R1.35 C[C@H](O)[C@H]1CNC(=O)C1 Amb27968562 [0,1,0,1,0,0|1,0,0]=3 16459 B9R1.35 C[C@H](O)[C@H]1COC(=O)C1 Amb27980502 [0,1,0,1,0,0|1,0,0]=3 16460 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,1,0,1,0,0|1,0,0]=3 16461 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,1,0,1,0,0|1,0,0]=3 16462 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,1,0,1,0,0|1,0,0]=3 16463 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [0,1,0,1,0,0|1,0,0]=3 16464 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [0,1,0,1,0,0|1,0,0]=3 16465 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [0,1,0,1,0,0|1,0,0]=3 16466 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,1,0,1,0,0|1,0,0]=3 16467 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [0,1,0,1,0,0|1,0,0]=3 16468 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,1,0,1,0,0|2,0,0]=4 16469 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,1,0,1,0,0|2,0,0]=4 16470 B9R1.35 C[C@H]1CS[C@H](C(=O)Cl)S1 Amb28320678 [0,1,0,1,0,0|2,0,0]=4 16471 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [0,1,0,1,0,0|2,0,0]=4 16472 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [0,1,0,1,0,0|2,0,0]=4 16473 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,1,0,1,0,0|2,0,0]=4 16474 B9R1.35 NC(=O)C1CC(F)CN1 Amb32666337 [0,1,0,1,0,0|2,0,0]=4 16475 B9R1.35 NC(=O)C1CC(O)CN1 Amb1152420 [0,1,0,1,0,0|2,0,0]=4 16476 B9R1.35 NC(=O)C1CC(O)CN1 Amb32668520 [0,1,0,1,0,0|2,0,0]=4 16477 B9R1.35 NC(=O)C1CCC(Cl)C1 Amb27253059 [0,1,0,1,0,0|1,0,0]=3 16478 B9R1.35 NC(=O)C1CCC(F)C1 Amb27155322 [0,1,0,1,0,0|1,0,0]=3 16479 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [0,1,0,1,0,0|1,0,0]=3 16480 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [0,1,0,1,0,0|1,0,0]=3 16481 B9R1.35 NC(=O)N1CCC(F)C1 Amb35591996 [0,1,0,1,0,0|2,0,0]=4 16482 B9R1.35 NC(=O)N1CCC(N)C1 Amb18943828 [0,1,0,1,0,0|2,0,0]=4 16483 B9R1.35 NC(=O)N1CCC(N)C1 Amb19373727 [0,1,0,1,0,0|2,0,0]=4 16484 B9R1.35 NC(=O)N1CCC(O)C1 Amb24635585 [0,1,0,1,0,0|2,0,0]=4 16485 B9R1.35 NC(=O)N1CC[C@@H](O)C1 Amb27763323 [0,1,0,1,0,0|2,0,0]=4 16486 B9R1.35 NC(=O)N1CC[C@H](S)C1 Amb27602032 [0,1,0,1,0,0|2,0,0]=4 16487 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,1,0,1,0,0|2,0,0]=4 16488 B9R1.35 NC(=O)[C@@H]1CC(O)CN1 Amb28054059 [0,1,0,1,0,0|2,0,0]=4 16489 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,1,0,1,0,0|1,0,0]=3 16490 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,1,0,1,0,0|2,0,0]=4 16491 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,1,0,1,0,0|2,0,0]=4 16492 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,1,0,1,0,0|2,0,0]=4 16493 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb28985696 [0,1,0,1,0,0|2,0,0]=4 16494 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb10808100 [0,1,0,1,0,0|2,0,0]=4 16495 B9R1.35 NC(=O)[C@@H]1C[C@H](O)CN1 Amb27476480 [0,1,0,1,0,0|2,0,0]=4 16496 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [0,1,0,1,0,0|1,0,0]=3 16497 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [0,1,0,1,0,0|1,0,0]=3 16498 B9R1.35 NC(=O)[C@H]1C[C@@H](O)CN1 Amb27628841 [0,1,0,1,0,0|2,0,0]=4 16499 B9R1.35 NC(=O)[C@H]1C[C@H](F)CN1 Amb27205380 [0,1,0,1,0,0|2,0,0]=4 16500 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,1,0,1,0,0|2,0,0]=4 16501 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,1,0,1,0,0|1,0,0]=3 16502 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,1,0,1,0,0|1,0,0]=3 16503 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,1,0,1,0,0|2,0,0]=4 16504 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,1,0,1,0,0|2,0,0]=4 16505 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [0,1,0,1,0,0|2,0,0]=4 16506 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,1,0,1,0,0|1,0,0]=3 16507 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,1,0,1,0,0|1,0,0]=3 16508 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,1,0,1,0,0|1,0,0]=3 16509 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,1,0,1,0,0|1,0,0]=3 16510 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,1,0,1,0,0|1,0,0]=3 16511 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,1,0,1,0,0|2,0,0]=4 16512 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,1,0,1,0,0|2,0,0]=4 16513 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,1,0,1,0,0|2,0,0]=4 16514 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,1,0,1,0,0|2,0,0]=4 16515 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,1,0,1,0,0|2,0,0]=4 16516 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,1,0,1,0,0|1,0,0]=3 16517 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,1,0,1,0,0|1,0,0]=3 16518 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,1,0,1,0,0|1,0,0]=3 16519 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,1,0,1,0,0|1,0,0]=3 16520 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,1,0,1,0,0|2,0,0]=4 16521 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,1,0,1,0,0|2,0,0]=4 16522 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,1,0,1,0,0|2,0,0]=4 16523 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,1,0,1,0,0|2,0,0]=4 16524 B9R1.35 O=C(Cl)C1CCC(Cl)C1 Amb24707520 [0,1,0,1,0,0|1,0,0]=3 16525 B9R1.35 O=C(Cl)N1CCC(F)C1 Amb29869318 [0,1,0,1,0,0|2,0,0]=4 16526 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,1,0,1,0,0|2,0,0]=4 16527 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,1,0,1,0,0|2,0,0]=4 16528 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,1,0,1,0,0|2,0,0]=4 16529 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,1,0,1,0,0|2,0,0]=4 16530 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,1,0,1,0,0|2,0,0]=4 16531 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,1,0,1,0,0|2,0,0]=4 16532 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,1,0,1,0,0|2,0,0]=4 16533 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,1,0,1,0,0|1,0,0]=3 16534 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,1,0,1,0,0|1,0,0]=3 16535 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,1,0,1,0,0|1,0,0]=3 16536 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,1,0,1,0,0|1,0,0]=3 16537 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,1,0,1,0,0|1,0,0]=3 16538 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,1,0,1,0,0|2,0,0]=4 16539 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,1,0,1,0,0|2,0,0]=4 16540 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,1,0,1,0,0|2,0,0]=4 16541 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,1,0,1,0,0|1,0,0]=3 16542 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,1,0,1,0,0|1,0,0]=3 16543 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,1,0,1,0,0|1,0,0]=3 16544 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,1,0,1,0,0|2,0,0]=4 16545 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,1,0,1,0,0|2,0,0]=4 16546 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,1,0,1,0,0|2,0,0]=4 16547 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,1,0,1,0,0|2,0,0]=4 16548 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,1,0,1,0,0|2,0,0]=4 16549 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,1,0,1,0,0|2,0,0]=4 16550 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,1,0,1,0,0|2,0,0]=4 16551 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,1,0,1,0,0|2,0,0]=4 16552 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,1,0,1,0,0|2,0,0]=4 16553 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,1,0,1,0,0|2,0,0]=4 16554 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,1,0,1,0,0|2,0,0]=4 16555 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,1,0,1,0,0|2,0,0]=4 16556 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,1,0,1,0,0|2,0,0]=4 16557 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,1,0,1,0,0|2,0,0]=4 16558 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,1,0,1,0,0|2,0,0]=4 16559 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,1,0,1,0,0|2,0,0]=4 16560 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,1,0,1,0,0|2,0,0]=4 16561 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,1,0,1,0,0|1,0,0]=3 16562 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [0,1,0,1,0,0|2,0,0]=4 16563 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,1,0,1,0,0|2,0,0]=4 16564 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,1,0,1,0,0|2,0,0]=4 16565 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,1,0,1,0,0|2,0,0]=4 16566 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,1,0,1,0,0|2,0,0]=4 16567 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,1,0,1,0,0|2,0,0]=4 16568 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,1,0,1,0,0|2,0,0]=4 16569 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,1,0,1,0,0|2,0,0]=4 16570 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,1,0,1,0,0|2,0,0]=4 16571 B9R1.35 O=C1CC(C(F)F)CN1 Amb24681385 [0,1,0,1,0,0|2,0,0]=4 16572 B9R1.35 O=C1CCC(B(O)O)C1 Amb27866777 [0,1,0,1,0,0|2,0,0]=4 16573 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [0,1,0,1,0,0|1,0,1]=4 16574 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,1,0,1,0,0|1,0,1]=4 16575 B9R1.35 O=C1CCC(C(F)F)N1 Amb23437767 [0,1,0,1,0,0|2,0,0]=4 16576 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,1,0,1,0,0|1,0,1]=4 16577 B9R1.35 O=C1CC[C@@H](C(F)F)N1 Amb25336383 [0,1,0,1,0,0|2,0,0]=4 16578 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,1,0,1,0,0|1,0,1]=4 16579 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [0,1,0,1,0,0|1,0,1]=4 16580 B9R1.45 C=C(C)C(=O)C1CC1C Amb27655307 [0,1,0,1,0,0|1,0,1]=4 16581 B9R1.45 CC(C)C(O)C1CC1C Amb28197492 [0,1,0,1,0,0|1,0,1]=4 16582 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [0,1,0,1,0,0|1,0,1]=4 16583 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,1,0,1,0,0|1,0,0]=3 16584 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,1,0,1,0,0|1,0,0]=3 16585 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,1,0,1,0,0|1,0,0]=3 16586 B9R1.69 C=C1CC(O)CCC1C Amb28401292 [0,1,0,1,0,0|2,0,0]=4 16587 B9R1.69 C=C1CCN(C)C(C)C1 Amb27228799 [0,1,0,1,0,0|2,0,0]=4 16588 B9R1.69 C=C1CC[C@H](C)[C@H](O)C1 Amb28133380 [0,1,0,1,0,0|2,0,0]=4 16589 B9R1.69 C=C1C[C@@H](O)CC[C@H]1C Amb27650219 [0,1,0,1,0,0|2,0,0]=4 16590 B9R1.69 CC1=C(C)CC(C)CC1 Amb26603643 [0,1,0,1,0,0|1,0,1]=4 16591 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,1,0,1,0,0|0,0,2]=4 16592 B9R1.69 CC1=CC(=O)C(O)CC1 Amb27838713 [0,1,0,1,0,0|0,0,2]=4 16593 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,1,0,1,0,0|0,0,2]=4 16594 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,1,0,1,0,0|0,0,2]=4 16595 B9R1.69 CC1=CC(C)C(C)CC1 Amb25048711 [0,1,0,1,0,0|1,0,0]=3 16596 B9R1.69 CC1=CC(C)C(O)CC1 Amb27664856 [0,1,0,1,0,0|1,0,0]=3 16597 B9R1.69 CC1=CC(Cl)C(C)CC1 Amb27483834 [0,1,0,1,0,0|2,0,0]=4 16598 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [0,1,0,1,0,0|2,0,0]=4 16599 B9R1.69 CC1=CC(O)CCC1Cl Amb27233700 [0,1,0,1,0,0|2,0,0]=4 16600 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [0,1,0,1,0,0|2,0,0]=4 16601 B9R1.69 CC1=CC(O)[C@H](C)CC1 Amb28049248 [0,1,0,1,0,0|2,0,0]=4 16602 B9R1.69 CC1=CCC(=O)C[C@@H]1C Amb27434226 [0,1,0,1,0,0|0,0,2]=4 16603 B9R1.69 CC1=CCC(O)C(C)C1 Amb27977995 [0,1,0,1,0,0|1,0,1]=4 16604 B9R1.69 CC1=CC[C@@H](O)C(C)C1 Amb27956617 [0,1,0,1,0,0|1,0,1]=4 16605 B9R1.69 CC1=C[C@@H](O)CC[C@H]1Cl Amb27985909 [0,1,0,1,0,0|2,0,0]=4 16606 B9R1.69 CC1=C[C@@H](O)CC[C@H]1O Amb27970996 [0,1,0,1,0,0|2,0,0]=4 16607 B9R1.69 CC1=C[C@@H](O)[C@H](O)CC1 Amb27255140 [0,1,0,1,0,0|2,0,0]=4 16608 B9R1.69 CC1=C[C@H](O)[C@H](O)CC1 Amb28321435 [0,1,0,1,0,0|2,0,0]=4 16609 B9R1.69 CC1=NC(C)C(O)CC1 Amb28319717 [0,1,0,1,0,0|1,0,0]=3 16610 B9R1.69 CC1CC(=N)NCC1N Amb28285433 [0,1,0,1,0,0|2,0,0]=4 16611 B9R1.69 CC1CC(=N)NC[C@@H]1C Amb27213704 [0,1,0,1,0,0|2,0,0]=4 16612 B9R1.69 CC1CC(=O)C(C)CN1 Amb32757537 [0,1,0,1,0,0|1,0,0]=3 16613 B9R1.69 CC1CC(=O)C(C)CN1 Amb792443 [0,1,0,1,0,0|1,0,0]=3 16614 B9R1.69 CC1CC(=O)C(C)CS1 Amb4399940 [0,1,0,1,0,0|1,0,0]=3 16615 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|0,0,0]=2 16616 B9R1.69 CC1CC(=O)CCN1C Amb19148128 [0,1,0,1,0,0|1,0,0]=3 16617 B9R1.69 CC1CC(=O)CCS1=O Amb28461149 [0,1,0,1,0,0|1,0,0]=3 16618 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,1,0,1,0,0|0,0,0]=2 16619 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,1,0,0|1,0,0]=3 16620 B9R1.69 CC1CC(=O)NNC1Cl Amb27796166 [0,1,0,1,0,0|2,0,0]=4 16621 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,1,0,1,0,0|1,0,0]=3 16622 B9R1.69 CC1CC(N)CCC1N Amb27440794 [0,1,0,1,0,0|1,0,1]=4 16623 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|1,0,1]=4 16624 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|0,0,2]=4 16625 B9R1.69 CC1CC=C(Cl)C(=O)C1 Amb27199164 [0,1,0,1,0,0|0,0,2]=4 16626 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 16627 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,1,0,1,0,0|0,0,0]=2 16628 B9R1.69 CC1CCC(=O)CC1Cl Amb27872191 [0,1,0,1,0,0|1,0,0]=3 16629 B9R1.69 CC1CCC(=O)CC1I Amb32867595 [0,1,0,1,0,0|1,0,0]=3 16630 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,1,0,1,0,0|1,0,0]=3 16631 B9R1.69 CC1CCC(=O)CC1O Amb27180113 [0,1,0,1,0,0|1,0,0]=3 16632 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [0,1,0,1,0,0|0,0,0]=2 16633 B9R1.69 CC1CCC(Br)C(C)C1 Amb18329561 [0,1,0,1,0,0|1,0,1]=4 16634 B9R1.69 CC1CCC(Br)CC1C Amb25838066 [0,1,0,1,0,0|1,0,1]=4 16635 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [0,1,0,1,0,0|0,0,0]=2 16636 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [0,1,0,1,0,0|1,0,0]=3 16637 B9R1.69 CC1CCC(C)C(C)C1 Amb4017852 [0,1,0,1,0,0|1,0,1]=4 16638 B9R1.69 CC1CCC(C)C(C)N1 Amb28046662 [0,1,0,1,0,0|1,0,1]=4 16639 B9R1.69 CC1CCC(C)C(N)C1 Amb6374323 [0,1,0,1,0,0|1,0,1]=4 16640 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [0,1,0,1,0,0|0,0,2]=4 16641 B9R1.69 CC1CCC(C)C(S)C1 Amb25296681 [0,1,0,1,0,0|0,1,1]=4 16642 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [0,1,0,1,0,0|0,0,0]=2 16643 B9R1.69 CC1CCC(Cl)C(C)C1 Amb27837439 [0,1,0,1,0,0|1,0,1]=4 16644 B9R1.69 CC1CCC(Cl)C(N)C1 Amb28060238 [0,1,0,1,0,0|1,0,1]=4 16645 B9R1.69 CC1CCC(Cl)C(O)C1 Amb27965032 [0,1,0,1,0,0|0,0,2]=4 16646 B9R1.69 CC1CCC(Cl)CC1C Amb26562244 [0,1,0,1,0,0|1,0,1]=4 16647 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [0,1,0,1,0,0|0,0,0]=2 16648 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [0,1,0,1,0,0|1,0,0]=3 16649 B9R1.69 CC1CCC(N)C(C)C1 Amb19515132 [0,1,0,1,0,0|1,0,1]=4 16650 B9R1.69 CC1CCC(N)C(C)N1 Amb24654514 [0,1,0,1,0,0|1,0,1]=4 16651 B9R1.69 CC1CCC(N)C(F)C1 Amb32656302 [0,1,0,1,0,0|1,0,1]=4 16652 B9R1.69 CC1CCC(N)C(N)C1 Amb18832603 [0,1,0,1,0,0|1,0,1]=4 16653 B9R1.69 CC1CCC(N)CC1C Amb33543352 [0,1,0,1,0,0|1,0,1]=4 16654 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,1,0,1,0,0|1,0,0]=3 16655 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [0,1,0,1,0,0|1,0,1]=4 16656 B9R1.69 CC1CCC(O)C(Cl)C1 Amb28291502 [0,1,0,1,0,0|1,0,1]=4 16657 B9R1.69 CC1CCC(O)C(F)C1 Amb33229936 [0,1,0,1,0,0|1,0,1]=4 16658 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|1,0,1]=4 16659 B9R1.69 CC1CCC(O)C(S)C1 Amb27495493 [0,1,0,1,0,0|0,1,1]=4 16660 B9R1.69 CC1CCC(O)CC1C Amb10844787 [0,1,0,1,0,0|0,0,2]=4 16661 B9R1.69 CC1CCC(S)C(C)C1 Amb26043135 [0,1,0,1,0,0|1,0,1]=4 16662 B9R1.69 CC1CCC(S)CC1C Amb27589824 [0,1,0,1,0,0|0,1,1]=4 16663 B9R1.69 CC1CCN(C)CC1=O Amb27861305 [0,1,0,1,0,0|1,0,0]=3 16664 B9R1.69 CC1CCN(N)C(=O)N1 Amb25917643 [0,1,0,1,0,0|2,0,0]=4 16665 B9R1.69 CC1CC[C@@H](O)[C@H](N)C1 Amb25912139 [0,1,0,1,0,0|1,0,1]=4 16666 B9R1.69 CC1CN(C)CCC1Br Amb26847616 [0,1,0,1,0,0|2,0,0]=4 16667 B9R1.69 CC1CN(C)CCC1N Amb13951888 [0,1,0,1,0,0|2,0,0]=4 16668 B9R1.69 CC1CN(C)CCC1O Amb4362743 [0,1,0,1,0,0|2,0,0]=4 16669 B9R1.69 CC1CN(C)CCC1S Amb24435312 [0,1,0,1,0,0|2,0,0]=4 16670 B9R1.69 CC1CNC(=N)CC1C Amb25960293 [0,1,0,1,0,0|2,0,0]=4 16671 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,1,0,1,0,0|2,0,0]=4 16672 B9R1.69 CC1CNC(=O)CN1C Amb33347762 [0,1,0,1,0,0|2,0,0]=4 16673 B9R1.69 CC1CNC(C)C(=O)N1 Amb18642668 [0,1,0,1,0,0|2,0,0]=4 16674 B9R1.69 CC1NC(=O)CCC1=O Amb27874094 [0,1,0,1,0,0|1,0,1]=4 16675 B9R1.69 CC1NC(=O)CCC1Cl Amb27397322 [0,1,0,1,0,0|1,0,0]=3 16676 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,1,0,1,0,0|1,0,0]=3 16677 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|1,0,0]=3 16678 B9R1.69 CC1NC(=O)COC1C Amb27440075 [0,1,0,1,0,0|2,0,0]=4 16679 B9R1.69 CC1NCC(=O)NC1C Amb27201107 [0,1,0,1,0,0|2,0,0]=4 16680 B9R1.69 CC1OC(=O)CCC1Br Amb27875143 [0,1,0,1,0,0|1,0,0]=3 16681 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,1,0,1,0,0|1,0,1]=4 16682 B9R1.69 CN1CCC(=O)CC1Cl Amb22496675 [0,1,0,1,0,0|2,0,0]=4 16683 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [0,1,0,1,0,0|2,0,0]=4 16684 B9R1.69 CN1CCC(N)CC1=O Amb28895935 [0,1,0,1,0,0|2,0,0]=4 16685 B9R1.69 CN1CCC(N)CC1=O Amb8010833 [0,1,0,1,0,0|2,0,0]=4 16686 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,1,0,1,0,0|0,0,0]=2 16687 B9R1.69 C[C@@H]1CC(=O)[C@H](C)CN1 Amb27188273 [0,1,0,1,0,0|1,0,0]=3 16688 B9R1.69 C[C@@H]1CCC(O)C[C@H]1C Amb27445019 [0,1,0,1,0,0|0,0,2]=4 16689 B9R1.69 C[C@@H]1CC[C@@H](C)[C@@H](N)C1 Amb28055512 [0,1,0,1,0,0|1,0,1]=4 16690 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](C)C1 Amb28061313 [0,1,0,1,0,0|1,0,1]=4 16691 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [0,1,0,1,0,0|0,0,2]=4 16692 B9R1.69 C[C@@H]1CC[C@@H](O)C[C@H]1C Amb28053499 [0,1,0,1,0,0|0,0,2]=4 16693 B9R1.69 C[C@@H]1CC[C@H](Br)[C@@H](Cl)C1 Amb27442191 [0,1,0,1,0,0|1,0,1]=4 16694 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [0,1,0,1,0,0|0,0,0]=2 16695 B9R1.69 C[C@@H]1CC[C@H](N)[C@H](C)C1 Amb28055517 [0,1,0,1,0,0|1,0,1]=4 16696 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](O)C1 Amb28204040 [0,1,0,1,0,0|0,0,2]=4 16697 B9R1.69 C[C@@H]1CN(C)CC[C@@H]1N Amb26930764 [0,1,0,1,0,0|2,0,0]=4 16698 B9R1.69 C[C@@H]1CN(C)CC[C@@H]1N Amb30526910 [0,1,0,1,0,0|2,0,0]=4 16699 B9R1.69 C[C@@H]1CN(C)CC[C@@H]1O Amb27962392 [0,1,0,1,0,0|2,0,0]=4 16700 B9R1.69 C[C@@H]1CN(C)CC[C@H]1N Amb22756869 [0,1,0,1,0,0|2,0,0]=4 16701 B9R1.69 C[C@@H]1CN(C)CC[C@H]1N Amb30526888 [0,1,0,1,0,0|2,0,0]=4 16702 B9R1.69 C[C@@H]1CN(C)CC[C@H]1O Amb27218249 [0,1,0,1,0,0|2,0,0]=4 16703 B9R1.69 C[C@@H]1CN[C@H](C)C(=O)N1 Amb23385259 [0,1,0,1,0,0|2,0,0]=4 16704 B9R1.69 C[C@@H]1COC(=O)N[C@H]1C Amb27203324 [0,1,0,1,0,0|2,0,0]=4 16705 B9R1.69 C[C@@H]1C[C@H](N)CC[C@@H]1O Amb27968631 [0,1,0,1,0,0|1,0,1]=4 16706 B9R1.69 C[C@@H]1C[C@H](N)CC[C@H]1O Amb28346268 [0,1,0,1,0,0|1,0,1]=4 16707 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [0,1,0,1,0,0|2,0,0]=4 16708 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [0,1,0,1,0,0|2,0,0]=4 16709 B9R1.69 C[C@@H]1OC[C@@H](C)NC1=O Amb27216673 [0,1,0,1,0,0|2,0,0]=4 16710 B9R1.69 C[C@@H]1O[C@H](C)CC[C@@H]1N Amb27202482 [0,1,0,1,0,0|0,0,2]=4 16711 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|0,0,0]=2 16712 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,1,0,0|1,0,0]=3 16713 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,1,0,1,0,0|0,0,0]=2 16714 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,1,0,1,0,0|0,0,0]=2 16715 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [0,1,0,1,0,0|0,0,2]=4 16716 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [0,1,0,1,0,0|0,0,2]=4 16717 B9R1.69 C[C@H]1CC[C@@H](C)N[C@H]1C Amb27667416 [0,1,0,1,0,0|1,0,1]=4 16718 B9R1.69 C[C@H]1CC[C@@H](Cl)[C@H](Br)C1 Amb27268449 [0,1,0,1,0,0|1,0,1]=4 16719 B9R1.69 C[C@H]1CC[C@@H](N)[C@H](N)C1 Amb27244101 [0,1,0,1,0,0|1,0,1]=4 16720 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [0,1,0,1,0,0|1,0,0]=3 16721 B9R1.69 C[C@H]1CC[C@@H](O)C[C@@H]1C Amb27452456 [0,1,0,1,0,0|0,0,2]=4 16722 B9R1.69 C[C@H]1CC[C@@H](O)C[C@H]1C Amb28247082 [0,1,0,1,0,0|0,0,2]=4 16723 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [0,1,0,1,0,0|0,0,0]=2 16724 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [0,1,0,1,0,0|0,0,2]=4 16725 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [0,1,0,1,0,0|0,0,0]=2 16726 B9R1.69 C[C@H]1CC[C@H](O)C[C@H]1C Amb28134680 [0,1,0,1,0,0|0,0,2]=4 16727 B9R1.69 C[C@H]1CNC(=O)O[C@H]1C Amb27492970 [0,1,0,1,0,0|2,0,0]=4 16728 B9R1.69 C[C@H]1CN[C@@H](C)C(=O)N1 Amb23385307 [0,1,0,1,0,0|2,0,0]=4 16729 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb22587547 [0,1,0,1,0,0|2,0,0]=4 16730 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb23385266 [0,1,0,1,0,0|2,0,0]=4 16731 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,1,0,1,0,0|2,0,0]=4 16732 B9R1.69 C[C@H]1CO[C@@H](C)C(=O)N1 Amb26975581 [0,1,0,1,0,0|2,0,0]=4 16733 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1C Amb27978914 [0,1,0,1,0,0|0,0,2]=4 16734 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1C Amb26026793 [0,1,0,1,0,0|1,0,1]=4 16735 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1N Amb28055532 [0,1,0,1,0,0|1,0,1]=4 16736 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,1,0,1,0,0|1,0,0]=3 16737 B9R1.69 N[C@H]1CCC(O)NC1=O Amb26317903 [0,1,0,1,0,0|2,0,0]=4 16738 B9R1.69 O=C1CCC(=O)C(Br)C1 Amb25775016 [0,1,0,1,0,0|1,0,1]=4 16739 B9R1.69 O=C1CCC(=O)C(Cl)C1 Amb24452362 [0,1,0,1,0,0|1,0,1]=4 16740 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [0,1,0,1,0,0|1,0,1]=4 16741 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,1,0,1,0,0|2,0,0]=4 16742 B9R1.93 C=C[C@H]1C[C@@]1(C)C(C)=O Amb27440389 [0,1,0,1,0,0|0,0,2]=4 16743 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [0,1,0,1,0,0|2,0,0]=4 16744 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [0,1,0,1,0,0|1,0,0]=3 16745 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [0,1,0,1,0,0|1,0,0]=3 16746 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [0,1,0,1,0,0|1,0,0]=3 16747 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [0,1,0,1,0,0|1,0,0]=3 16748 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [0,1,0,1,0,0|1,0,0]=3 16749 B9R1.93 CC[C@@H]1C[C@@]1(N)C(N)=O Amb27215769 [0,1,0,1,0,0|1,0,0]=3 16750 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [0,1,0,1,0,0|1,0,0]=3 16751 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [0,1,0,1,0,0|1,0,0]=3 16752 B9R1.93 CC[C@H]1C[C@@]1(N)C(N)=O Amb28286397 [0,1,0,1,0,0|1,0,0]=3 16753 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [0,1,0,1,0,0|1,0,0]=3 16754 B9R1.93 CC[C@H]1C[C@]1(N)C(N)=O Amb28286982 [0,1,0,1,0,0|1,0,0]=3 16755 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [0,1,0,1,0,0|2,0,0]=4 16756 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [0,1,0,1,0,0|2,0,0]=4 16757 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [0,1,0,1,0,0|2,0,0]=4 16758 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [0,1,0,1,0,0|2,0,0]=4 16759 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [0,1,0,1,0,0|2,0,0]=4 16760 B9R1.93 NCC1CC1(N)C(=O)O Amb27873291 [0,1,0,1,0,0|2,0,0]=4 16761 B9R1.93 NC[C@@H]1C[C@@]1(N)C(=O)O Amb24763621 [0,1,0,1,0,0|2,0,0]=4 16762 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [0,1,0,1,0,0|2,0,0]=4 16763 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [0,1,0,1,0,0|2,0,0]=4 16764 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [0,1,0,1,0,0|2,0,0]=4 16765 B9R1.93 O=C(O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|2,0,0]=4 16766 B9R1.95 C#CC1CC(C(C)=O)C1 Amb27669434 [0,1,0,1,0,0|0,0,2]=4 16767 B9R1.95 C#C[C@H]1C[C@@H](C(C)=O)C1 Amb27211903 [0,1,0,1,0,0|0,0,2]=4 16768 B9R1.95 CC(=O)C1CC(C=O)C1 Amb32669290 [0,1,0,1,0,0|1,0,1]=4 16769 B9R1.95 CC(=O)N1CC(CBr)C1 Amb27813085 [0,1,0,1,0,0|2,0,0]=4 16770 B9R1.95 CC(=O)N1CC(CN)C1 Amb28436806 [0,1,0,1,0,0|2,0,0]=4 16771 B9R1.95 CC(=O)N1CC(CN)C1 Amb33463045 [0,1,0,1,0,0|2,0,0]=4 16772 B9R1.95 CC(=O)N1CC(CO)C1 Amb26549681 [0,1,0,1,0,0|2,0,0]=4 16773 B9R1.95 CCC1C=C(C(N)=O)C1 Amb28049401 [0,1,0,1,0,0|1,0,1]=4 16774 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [0,1,0,1,0,0|1,0,0]=3 16775 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,1,0,1,0,0|1,0,0]=3 16776 B9R1.95 CCC1CN(C(=O)Cl)C1 Amb35667759 [0,1,0,1,0,0|2,0,0]=4 16777 B9R1.95 CCC1CN(C(C)=N)C1 Amb30023414 [0,1,0,1,0,0|2,0,0]=4 16778 B9R1.95 CCC1CN(C(C)=O)C1 Amb35645756 [0,1,0,1,0,0|1,0,0]=3 16779 B9R1.95 CCC1CN(C(N)=O)C1 Amb30039311 [0,1,0,1,0,0|2,0,0]=4 16780 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,1,0,1,0,0|2,0,0]=4 16781 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [0,1,0,1,0,0|1,0,0]=3 16782 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,1,0,1,0,0|2,0,0]=4 16783 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,1,0,1,0,0|2,0,0]=4 16784 B9R1.95 CNC1CC(C(C)=O)C1 Amb30032621 [0,1,0,1,0,0|1,0,0]=3 16785 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670672 [0,1,0,1,0,0|2,0,0]=4 16786 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670673 [0,1,0,1,0,0|2,0,0]=4 16787 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,1,0,1,0,0|2,0,0]=4 16788 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,1,0,1,0,0|2,0,0]=4 16789 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670695 [0,1,0,1,0,0|2,0,0]=4 16790 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670696 [0,1,0,1,0,0|2,0,0]=4 16791 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,1,0,1,0,0|2,0,0]=4 16792 B9R1.95 COC1CC(C(C)=O)C1 Amb24595933 [0,1,0,1,0,0|1,0,0]=3 16793 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,1,0,1,0,0|2,0,0]=4 16794 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,1,0,1,0,0|2,0,0]=4 16795 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,1,0,1,0,0|2,0,0]=4 16796 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,1,0,1,0,0|2,0,0]=4 16797 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,1,0,1,0,0|2,0,0]=4 16798 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,1,0,1,0,0|2,0,0]=4 16799 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,1,0,1,0,0|2,0,0]=4 16800 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|2,0,0]=4 16801 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,1,0,1,0,0|2,0,0]=4 16802 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,1,0,1,0,0|2,0,0]=4 16803 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,1,0,1,0,0|2,0,0]=4 16804 B9R1.100 CCCCC(Br)C1CC1 Amb27826788 [0,1,0,1,0,0|1,0,1]=4 16805 B9R1.100 CCCCC(C)C1CC1 Amb25286937 [0,1,0,1,0,0|1,0,1]=4 16806 B9R1.100 CCCCC(Cl)C1CC1 Amb27837489 [0,1,0,1,0,0|1,0,1]=4 16807 B9R1.100 CCCCC(N)C1CC1 Amb3788101 [0,1,0,1,0,0|1,0,1]=4 16808 B9R1.100 CCCCC(O)C1CC1 Amb27837486 [0,1,0,1,0,0|1,0,1]=4 16809 B9R1.100 CCCCC(O)C1CO1 Amb28048180 [0,1,0,1,0,0|0,0,2]=4 16810 B9R1.100 CCCC[C@@H](O)[C@@H]1CO1 Amb27186933 [0,1,0,1,0,0|0,0,2]=4 16811 B9R1.100 CCCC[C@@H](O)[C@H]1CO1 Amb27219813 [0,1,0,1,0,0|0,0,2]=4 16812 B9R1.100 CCCC[C@H](N)C1CC1 Amb28388893 [0,1,0,1,0,0|1,0,1]=4 16813 B9R1.100 CCCC[C@H](O)[C@H]1CO1 Amb27197461 [0,1,0,1,0,0|0,0,2]=4 16814 B9R1.106 CC1CCC(C)S1(=O)=O Amb2813294 [0,1,0,1,0,0|2,0,0]=4 16815 B9R1.106 CC1CCC(N)C1(C)C Amb23589636 [0,1,0,1,0,0|1,0,1]=4 16816 B9R1.107 CCC1CC(N)C1(C)C Amb35705390 [0,1,0,1,0,0|1,0,1]=4 16817 B9R1.110 C=C(C(=O)O)C1CCC1 Amb26589067 [0,1,0,1,0,0|1,0,1]=4 16818 B9R1.110 C=C(C)C(N)C1CSC1 Amb35697083 [0,1,0,1,0,0|2,0,0]=4 16819 B9R1.110 C=C(C)C(O)C1CCC1 Amb28364580 [0,1,0,1,0,0|1,0,0]=3 16820 B9R1.110 C=C(C)C(O)C1CNC1 Amb30026477 [0,1,0,1,0,0|2,0,0]=4 16821 B9R1.110 C=C(C)C(O)C1CSC1 Amb35711351 [0,1,0,1,0,0|2,0,0]=4 16822 B9R1.110 CC(=N)N(C)C1CCC1 Amb27812898 [0,1,0,1,0,0|2,0,0]=4 16823 B9R1.110 CC(=O)C(C)C1CCC1 Amb35603891 [0,1,0,1,0,0|0,0,0]=2 16824 B9R1.110 CC(=O)C(C)C1CNC1 Amb24673466 [0,1,0,1,0,0|1,0,0]=3 16825 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,1,0,1,0,0|0,0,0]=2 16826 B9R1.110 CC(=O)N(C)C1CCC1 Amb26025919 [0,1,0,1,0,0|1,0,0]=3 16827 B9R1.110 CC(=O)N(C)C1CNC1 Amb21960866 [0,1,0,1,0,0|2,0,0]=4 16828 B9R1.110 CC(=O)N(C)C1CNC1 Amb26326635 [0,1,0,1,0,0|2,0,0]=4 16829 B9R1.110 CC(C(=O)Cl)C1CCC1 Amb29849535 [0,1,0,1,0,0|1,0,0]=3 16830 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [0,1,0,1,0,0|1,0,0]=3 16831 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [0,1,0,1,0,0|2,0,0]=4 16832 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [0,1,0,1,0,0|2,0,0]=4 16833 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [0,1,0,1,0,0|2,0,0]=4 16834 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [0,1,0,1,0,0|2,0,0]=4 16835 B9R1.110 CC(C(=O)O)N1CCC1 Amb24178905 [0,1,0,1,0,0|2,0,0]=4 16836 B9R1.110 CC(C(=O)O)N1CCC1 Amb33329262 [0,1,0,1,0,0|2,0,0]=4 16837 B9R1.110 CC(C(=O)[O-])C1COC1 Amb35752725 [0,1,0,1,0,0|2,0,0]=4 16838 B9R1.110 CC(C(N)=O)C1CCC1 Amb30008333 [0,1,0,1,0,0|1,0,0]=3 16839 B9R1.110 CC(C(N)=O)C1CNC1 Amb27593677 [0,1,0,1,0,0|2,0,0]=4 16840 B9R1.110 CC(Cl)C(C)C1CCC1 Amb27879003 [0,1,0,1,0,0|1,0,1]=4 16841 B9R1.110 CC(O)C(C)C1CCC1 Amb24481851 [0,1,0,1,0,0|0,0,2]=4 16842 B9R1.110 CN(C(=O)Cl)C1CCC1 Amb32863940 [0,1,0,1,0,0|2,0,0]=4 16843 B9R1.110 CN(C(N)=O)C1CCC1 Amb27465967 [0,1,0,1,0,0|2,0,0]=4 16844 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [0,1,0,1,0,0|2,0,0]=4 16845 B9R1.110 C[C@@H](N)C(O)C1CCC1 Amb35624101 [0,1,0,1,0,0|1,0,1]=4 16846 B9R1.110 C[C@@H](O)[C@H](N)C1CCC1 Amb27787967 [0,1,0,1,0,0|0,0,2]=4 16847 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [0,1,0,1,0,0|2,0,0]=4 16848 B9R1.110 C[C@H](N)C(O)C1CCC1 Amb35737943 [0,1,0,1,0,0|1,0,1]=4 16849 B9R1.110 NC(=O)C(F)C1CNC1 Amb28288969 [0,1,0,1,0,0|2,0,0]=4 16850 B9R1.110 NC(=O)C(N)C1CCC1 Amb27237393 [0,1,0,1,0,0|1,0,0]=3 16851 B9R1.110 NC(=O)C(N)C1COC1 Amb33065789 [0,1,0,1,0,0|2,0,0]=4 16852 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [0,1,0,1,0,0|1,0,0]=3 16853 B9R1.110 NC(C(=O)O)C1CNC1 Amb30040080 [0,1,0,1,0,0|2,0,0]=4 16854 B9R1.110 NC(C(=O)O)C1COC1 Amb22405987 [0,1,0,1,0,0|2,0,0]=4 16855 B9R1.110 NC(C(=O)O)C1CSC1 Amb27844776 [0,1,0,1,0,0|2,0,0]=4 16856 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [0,1,0,1,0,0|1,0,0]=3 16857 B9R1.110 N[C@@H](C(=O)O)C1COC1 Amb22737550 [0,1,0,1,0,0|2,0,0]=4 16858 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [0,1,0,1,0,0|1,0,0]=3 16859 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [0,1,0,1,0,0|1,0,0]=3 16860 B9R1.110 N[C@H](C(=O)O)C1COC1 Amb22737551 [0,1,0,1,0,0|2,0,0]=4 16861 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [0,1,0,1,0,0|1,0,0]=3 16862 B9R1.110 O=C(O)C(F)C1COC1 Amb33165607 [0,1,0,1,0,0|2,0,0]=4 16863 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [0,1,0,1,0,0|1,0,0]=3 16864 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [0,1,0,1,0,0|2,0,0]=4 16865 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [0,1,0,1,0,0|1,0,0]=3 16866 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [0,1,0,1,0,0|1,0,0]=3 16867 B9R1.110 O=C([O-])C(O)C1COC1 Amb32650165 [0,1,0,1,0,0|2,0,0]=4 16868 B9R1.112 C=C(C)C(N)CC1CC1 Amb28313656 [0,1,0,1,0,0|1,0,0]=3 16869 B9R1.112 CC(=O)C(=O)NC1CC1 Amb17399817 [0,1,0,1,0,0|1,0,1]=4 16870 B9R1.112 CC(=O)C(C)NC1CC1 Amb25119978 [0,1,0,1,0,0|1,0,0]=3 16871 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [0,1,0,1,0,0|0,0,0]=2 16872 B9R1.112 CC(C)[C@H](N)CC1CC1 Amb27267256 [0,1,0,1,0,0|1,0,1]=4 16873 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,1,0,1,0,0|1,0,0]=3 16874 B9R1.112 CC(CC1CC1)C(N)=O Amb33495655 [0,1,0,1,0,0|1,0,0]=3 16875 B9R1.112 CC(N)C(O)CC1CC1 Amb35588688 [0,1,0,1,0,0|1,0,1]=4 16876 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,1,0,1,0,0|2,0,0]=4 16877 B9R1.112 CC(NC1CC1)C(N)=O Amb7758269 [0,1,0,1,0,0|2,0,0]=4 16878 B9R1.112 CC(O)C(C)CC1CC1 Amb24429505 [0,1,0,1,0,0|0,0,2]=4 16879 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,1,0,1,0,0|2,0,0]=4 16880 B9R1.112 CN(CC1CC1)C(=O)Cl Amb32863866 [0,1,0,1,0,0|2,0,0]=4 16881 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,1,0,1,0,0|1,0,0]=3 16882 B9R1.112 C[C@@H](N)C(O)CC1CC1 Amb35624306 [0,1,0,1,0,0|1,0,1]=4 16883 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,1,0,1,0,0|2,0,0]=4 16884 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,1,0,1,0,0|1,0,0]=3 16885 B9R1.112 C[C@H](N)C(O)CC1CC1 Amb35618417 [0,1,0,1,0,0|1,0,1]=4 16886 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [0,1,0,1,0,0|1,0,0]=3 16887 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [0,1,0,1,0,0|1,0,0]=3 16888 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,1,0,1,0,0|1,0,0]=3 16889 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,1,0,1,0,0|1,0,0]=3 16890 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,1,0,1,0,0|1,0,0]=3 16891 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,1,0,1,0,0|2,0,0]=4 16892 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,1,0,1,0,0|1,0,0]=3 16893 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [0,1,0,1,0,0|1,0,1]=4 16894 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,1,0,1,0,0|1,0,0]=3 16895 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,1,0,1,0,0|1,0,0]=3 16896 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|1,0,0]=3 16897 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,1,0,1,0,0|1,0,0]=3 16898 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,1,0,1,0,0|1,0,0]=3 16899 B9R1.155 CCCC1C(N)C1(C)C Amb28049258 [0,1,0,1,0,0|1,0,1]=4 16900 B9R1.155 CCC[C@@H]1[C@@H](N)C1(C)C Amb33374811 [0,1,0,1,0,0|1,0,1]=4 16901 B9R1.159 C=C(C)C1(O)CCC1C Amb28071760 [0,1,0,1,0,0|1,0,0]=3 16902 B9R1.159 CC1(C(=O)O)CCC1N Amb28397422 [0,1,0,1,0,0|2,0,0]=4 16903 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [0,1,0,1,0,0|1,0,0]=3 16904 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [0,1,0,1,0,0|1,0,0]=3 16905 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [0,1,0,1,0,0|1,0,0]=3 16906 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [0,1,0,1,0,0|1,0,0]=3 16907 B9R1.159 C[C@@H]1CC[C@@]1(N)C(N)=O Amb28346845 [0,1,0,1,0,0|1,0,0]=3 16908 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [0,1,0,1,0,0|1,0,0]=3 16909 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [0,1,0,1,0,0|1,0,0]=3 16910 B9R1.159 C[C@]1(C(=O)O)CC[C@H]1N Amb27961498 [0,1,0,1,0,0|2,0,0]=4 16911 B9R1.159 NC1(C(=O)O)CCC1O Amb27482724 [0,1,0,1,0,0|2,0,0]=4 16912 B9R1.159 NC1CCC1(F)C(=O)O Amb27768660 [0,1,0,1,0,0|2,0,0]=4 16913 B9R1.159 N[C@@H]1CC[C@]1(F)C(=O)O Amb27188263 [0,1,0,1,0,0|2,0,0]=4 16914 B9R1.159 N[C@H]1CC[C@@]1(N)C(=O)O Amb27216513 [0,1,0,1,0,0|2,0,0]=4 16915 B9R1.159 N[C@]1(C(=O)O)CC[C@@H]1O Amb28058284 [0,1,0,1,0,0|2,0,0]=4 16916 B9R1.159 O=C(O)C1(O)CCC1Br Amb28137512 [0,1,0,1,0,0|2,0,0]=4 16917 B9R1.163 C=C(C)C1(F)CCNC1 Amb27170350 [0,1,0,1,0,0|2,0,0]=4 16918 B9R1.163 C=C(C)C1(N)CCCC1 Amb33201934 [0,1,0,1,0,0|1,0,0]=3 16919 B9R1.163 C=C(C)C1(O)CCCC1 Amb28246362 [0,1,0,1,0,0|1,0,0]=3 16920 B9R1.163 CC(=O)C1(C)C=CCC1 Amb28199940 [0,1,0,1,0,0|0,0,2]=4 16921 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [0,1,0,1,0,0|0,0,0]=2 16922 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [0,1,0,1,0,0|1,0,0]=3 16923 B9R1.163 CC(=O)C1(C)CCCO1 Amb24332633 [0,1,0,1,0,0|1,0,0]=3 16924 B9R1.163 CC(=O)C1(C)CCNC1 Amb25698020 [0,1,0,1,0,0|1,0,0]=3 16925 B9R1.163 CC(=O)C1(C)NCCO1 Amb27795907 [0,1,0,1,0,0|2,0,0]=4 16926 B9R1.163 CC(=O)C1(C)OCCO1 Amb27955538 [0,1,0,1,0,0|2,0,0]=4 16927 B9R1.163 CC(=O)C1(C)OCCS1 Amb25188965 [0,1,0,1,0,0|2,0,0]=4 16928 B9R1.163 CC(=O)C1(C)SCCS1 Amb28458583 [0,1,0,1,0,0|2,0,0]=4 16929 B9R1.163 CC(=O)C1(Cl)CCCC1 Amb27950094 [0,1,0,1,0,0|0,0,0]=2 16930 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [0,1,0,1,0,0|0,0,0]=2 16931 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [0,1,0,1,0,0|0,0,0]=2 16932 B9R1.163 CC(=O)C1(N)CCOC1 Amb24427660 [0,1,0,1,0,0|1,0,0]=3 16933 B9R1.163 CC(=O)C1(N)NCCS1 Amb27162223 [0,1,0,1,0,0|2,0,0]=4 16934 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [0,1,0,1,0,0|0,0,0]=2 16935 B9R1.163 CC(=O)[C@@]1(C)CCCN1 Amb33307927 [0,1,0,1,0,0|1,0,0]=3 16936 B9R1.163 CC(=O)[C@]1(C)CCCN1 Amb33307921 [0,1,0,1,0,0|1,0,0]=3 16937 B9R1.163 CC(C)C1(N)CCCC1 Amb9676108 [0,1,0,1,0,0|1,0,1]=4 16938 B9R1.163 CC(C)C1(O)CCCC1 Amb9675984 [0,1,0,1,0,0|1,0,1]=4 16939 B9R1.163 CC(N)C1(C)CCCC1 Amb24587997 [0,1,0,1,0,0|1,0,1]=4 16940 B9R1.163 CC(N)C1(O)CCCC1 Amb25145994 [0,1,0,1,0,0|1,0,1]=4 16941 B9R1.163 CC1(C(=O)Cl)CCCC1 Amb24476587 [0,1,0,1,0,0|1,0,0]=3 16942 B9R1.163 CC1(C(=O)Cl)CCCO1 Amb26359915 [0,1,0,1,0,0|2,0,0]=4 16943 B9R1.163 CC1(C(=O)Cl)CCCS1 Amb27838547 [0,1,0,1,0,0|2,0,0]=4 16944 B9R1.163 CC1(C(=O)O)CCCC1 Amb482493 [0,1,0,1,0,0|1,0,0]=3 16945 B9R1.163 CC1(C(=O)O)CCCN1 Amb15701407 [0,1,0,1,0,0|2,0,0]=4 16946 B9R1.163 CC1(C(=O)O)CCCN1 Amb22587331 [0,1,0,1,0,0|2,0,0]=4 16947 B9R1.163 CC1(C(=O)O)CCCO1 Amb1088877 [0,1,0,1,0,0|2,0,0]=4 16948 B9R1.163 CC1(C(=O)O)CCCS1 Amb20623191 [0,1,0,1,0,0|2,0,0]=4 16949 B9R1.163 CC1(C(=O)O)CCNC1 Amb20634439 [0,1,0,1,0,0|2,0,0]=4 16950 B9R1.163 CC1(C(=O)O)CCNC1 Amb2683246 [0,1,0,1,0,0|2,0,0]=4 16951 B9R1.163 CC1(C(=O)O)CCOC1 Amb18280535 [0,1,0,1,0,0|2,0,0]=4 16952 B9R1.163 CC1(C(=O)O)CCSC1 Amb27782020 [0,1,0,1,0,0|2,0,0]=4 16953 B9R1.163 CC1(C(N)=O)CCCC1 Amb4018896 [0,1,0,1,0,0|1,0,0]=3 16954 B9R1.163 CC1(C(N)=O)CCCN1 Amb20061427 [0,1,0,1,0,0|2,0,0]=4 16955 B9R1.163 CC1(C(N)=O)CCNC1 Amb27474417 [0,1,0,1,0,0|2,0,0]=4 16956 B9R1.163 CC1([N+](=O)[O-])CCCC1 Amb27643895 [0,1,0,1,0,0|2,0,0]=4 16957 B9R1.163 CN(C)C1(C)CCCC1 Amb27485740 [0,1,0,1,0,0|2,0,0]=4 16958 B9R1.163 C[C@@H](N)C1(C)CCCC1 Amb28385735 [0,1,0,1,0,0|1,0,1]=4 16959 B9R1.163 C[C@@H](O)C1(C)CCCC1 Amb27591700 [0,1,0,1,0,0|0,0,2]=4 16960 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb10603262 [0,1,0,1,0,0|2,0,0]=4 16961 B9R1.163 C[C@@]1(C(=O)O)CCCN1 Amb22405952 [0,1,0,1,0,0|2,0,0]=4 16962 B9R1.163 C[C@@]1(C(=O)O)CCCO1 Amb27600317 [0,1,0,1,0,0|2,0,0]=4 16963 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Amb26869183 [0,1,0,1,0,0|2,0,0]=4 16964 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb24410858 [0,1,0,1,0,0|2,0,0]=4 16965 B9R1.163 C[C@@]1(C(N)=O)CCCN1 Amb33457642 [0,1,0,1,0,0|2,0,0]=4 16966 B9R1.163 C[C@H](N)C1(C)CCCC1 Amb27400446 [0,1,0,1,0,0|1,0,1]=4 16967 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb22406107 [0,1,0,1,0,0|2,0,0]=4 16968 B9R1.163 C[C@]1(C(=O)O)CCCN1 Amb8630480 [0,1,0,1,0,0|2,0,0]=4 16969 B9R1.163 C[C@]1(C(=O)O)CCCO1 Amb24117235 [0,1,0,1,0,0|2,0,0]=4 16970 B9R1.163 C[C@]1(C(=O)O)CCNC1 Amb24346794 [0,1,0,1,0,0|2,0,0]=4 16971 B9R1.163 C[C@]1(C(N)=O)CCCN1 Amb25146194 [0,1,0,1,0,0|2,0,0]=4 16972 B9R1.163 N=C(N)C1(N)CCCC1 Amb25260496 [0,1,0,1,0,0|2,0,0]=4 16973 B9R1.163 N=C(N)C1(N)CCCC1 Amb32718824 [0,1,0,1,0,0|2,0,0]=4 16974 B9R1.163 N=C(N)C1(O)CCCC1 Amb27876344 [0,1,0,1,0,0|2,0,0]=4 16975 B9R1.163 NC(=O)C1(Cl)CCCC1 Amb27879093 [0,1,0,1,0,0|1,0,0]=3 16976 B9R1.163 NC(=O)C1(F)CCCC1 Amb28193242 [0,1,0,1,0,0|1,0,0]=3 16977 B9R1.163 NC(=O)C1(F)CCNC1 Amb24759688 [0,1,0,1,0,0|2,0,0]=4 16978 B9R1.163 NC(=O)C1(F)CCNC1 Amb28049785 [0,1,0,1,0,0|2,0,0]=4 16979 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [0,1,0,1,0,0|1,0,0]=3 16980 B9R1.163 NC(=O)C1(N)CCCC1 Amb8628017 [0,1,0,1,0,0|1,0,0]=3 16981 B9R1.163 NC(=O)C1(N)CCNC1 Amb27874404 [0,1,0,1,0,0|2,0,0]=4 16982 B9R1.163 NC(=O)C1(N)CCOC1 Amb25835775 [0,1,0,1,0,0|2,0,0]=4 16983 B9R1.163 NC(=O)C1(N)CCOC1 Amb32708549 [0,1,0,1,0,0|2,0,0]=4 16984 B9R1.163 NC(=O)C1(N)CCSC1 Amb18279185 [0,1,0,1,0,0|2,0,0]=4 16985 B9R1.163 NC(=O)C1(O)CCCC1 Amb33529797 [0,1,0,1,0,0|1,0,0]=3 16986 B9R1.163 NC(=O)C1(O)CCNC1 Amb23515119 [0,1,0,1,0,0|2,0,0]=4 16987 B9R1.163 NC(=O)C1(O)CCNC1 Amb28555395 [0,1,0,1,0,0|2,0,0]=4 16988 B9R1.163 NC(=O)C1(O)CCSC1 Amb24116837 [0,1,0,1,0,0|2,0,0]=4 16989 B9R1.163 NC(=S)C1(N)CCCC1 Amb19374908 [0,1,0,1,0,0|1,1,0]=4 16990 B9R1.163 NC1(C(=O)Cl)CCCC1 Amb27236109 [0,1,0,1,0,0|1,0,0]=3 16991 B9R1.163 NC1(C(=O)O)CCCC1 Amb1838882 [0,1,0,1,0,0|1,0,0]=3 16992 B9R1.163 NC1(C(=O)O)CCNC1 Amb8630265 [0,1,0,1,0,0|2,0,0]=4 16993 B9R1.163 NC1(C(=O)O)CCOC1 Amb16232669 [0,1,0,1,0,0|2,0,0]=4 16994 B9R1.163 NC1(C(=O)O)CCOC1 Amb22274600 [0,1,0,1,0,0|2,0,0]=4 16995 B9R1.163 NC1(C(=O)O)CCSC1 Amb9724111 [0,1,0,1,0,0|2,0,0]=4 16996 B9R1.163 N[C@@]1(C(=O)O)CCNC1 Amb6893795 [0,1,0,1,0,0|2,0,0]=4 16997 B9R1.163 N[C@@]1(C(=O)O)CCOC1 Amb20241211 [0,1,0,1,0,0|2,0,0]=4 16998 B9R1.163 N[C@@]1(C(=O)O)CCSC1 Amb27972704 [0,1,0,1,0,0|2,0,0]=4 16999 B9R1.163 N[C@]1(C(=O)O)CCNC1 Amb6893796 [0,1,0,1,0,0|2,0,0]=4 17000 B9R1.163 N[C@]1(C(=O)O)CCOC1 Amb20241209 [0,1,0,1,0,0|2,0,0]=4 17001 B9R1.163 O=C(Cl)C1(Br)CCCC1 Amb25888908 [0,1,0,1,0,0|1,0,0]=3 17002 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [0,1,0,1,0,0|1,0,0]=3 17003 B9R1.163 O=C(Cl)C1(Cl)CCOC1 Amb33127959 [0,1,0,1,0,0|2,0,0]=4 17004 B9R1.163 O=C(O)C1(Br)CCCC1 Amb17595053 [0,1,0,1,0,0|1,0,0]=3 17005 B9R1.163 O=C(O)C1(Cl)CCCC1 Amb32716554 [0,1,0,1,0,0|1,0,0]=3 17006 B9R1.163 O=C(O)C1(Cl)CCOC1 Amb33127967 [0,1,0,1,0,0|2,0,0]=4 17007 B9R1.163 O=C(O)C1(F)CCCC1 Amb26957187 [0,1,0,1,0,0|1,0,0]=3 17008 B9R1.163 O=C(O)C1(F)CCNC1 Amb24120613 [0,1,0,1,0,0|2,0,0]=4 17009 B9R1.163 O=C(O)C1(F)CCNC1 Amb32992647 [0,1,0,1,0,0|2,0,0]=4 17010 B9R1.163 O=C(O)C1(F)CCOC1 Amb24420228 [0,1,0,1,0,0|2,0,0]=4 17011 B9R1.163 O=C(O)C1(O)CCCC1 Amb1159211 [0,1,0,1,0,0|1,0,0]=3 17012 B9R1.163 O=C(O)C1(O)CCNC1 Amb22500918 [0,1,0,1,0,0|2,0,0]=4 17013 B9R1.163 O=C(O)C1(O)CCNC1 Amb22899772 [0,1,0,1,0,0|2,0,0]=4 17014 B9R1.163 O=C(O)C1(O)CCOC1 Amb26332318 [0,1,0,1,0,0|2,0,0]=4 17015 B9R1.163 O=C(O)C1(O)CCSC1 Amb18944714 [0,1,0,1,0,0|2,0,0]=4 17016 B9R1.163 O=C(O)C1(S)CCCC1 Amb27185727 [0,1,0,1,0,0|1,0,0]=3 17017 B9R1.163 O=C(O)C1(S)CCCN1 Amb28383197 [0,1,0,1,0,0|2,0,0]=4 17018 B9R1.163 O=C(O)[C@@]1(F)CCCN1 Amb22748241 [0,1,0,1,0,0|2,0,0]=4 17019 B9R1.163 O=C(O)[C@@]1(O)CCSC1 Amb28119971 [0,1,0,1,0,0|2,0,0]=4 17020 B9R1.163 O=C(O)[C@]1(F)CCCN1 Amb27216006 [0,1,0,1,0,0|2,0,0]=4 17021 B9R1.163 O=[N+]([O-])C1(Br)CCCC1 Amb33298983 [0,1,0,1,0,0|2,0,0]=4 17022 B9R1.163 [NH3+]C1(C(=O)O)CC[NH2+]C1 Amb22583868 [0,1,0,1,0,0|2,0,0]=4 17023 B9R1.163 [NH3+]C1(C(=O)[O-])CCNC1 Amb22231944 [0,1,0,1,0,0|2,0,0]=4 17024 B9R1.10 CC1(C)CCC(Br)CC1 Amb33546099 [0,1,0,1,0,0|1,0,1]=4 17025 B9R1.10 CC1(C)CCC(N)CC1 Amb19334953 [0,1,0,1,0,0|1,0,1]=4 17026 B9R1.10 CC1(C)CCC(N)CC1 Amb20241201 [0,1,0,1,0,0|1,0,1]=4 17027 B9R1.10 CC1(C)CCC(O)CC1 Amb2722969 [0,1,0,1,0,0|1,0,1]=4 17028 B9R1.10 CC1(C)CCC(S)CC1 Amb27475990 [0,1,0,1,0,0|1,0,1]=4 17029 B9R1.10 CC1(Cl)CCC(Cl)CC1 Amb28144768 [0,1,0,1,0,0|1,0,1]=4 17030 B9R1.10 CC1(F)CCC(N)CC1 Amb25829401 [0,1,0,1,0,0|1,0,1]=4 17031 B9R1.10 CC1(F)CCC(N)CC1 Amb33291278 [0,1,0,1,0,0|1,0,1]=4 17032 B9R1.10 CC1(N)CCC(N)CC1 Amb27640685 [0,1,0,1,0,0|1,0,1]=4 17033 B9R1.10 CC1(N)CCC(O)CC1 Amb23589778 [0,1,0,1,0,0|1,0,1]=4 17034 B9R1.10 CC1(N)CCC(O)CC1 Amb33330208 [0,1,0,1,0,0|1,0,1]=4 17035 B9R1.10 CC1(N)CCC(S)CC1 Amb32788898 [0,1,0,1,0,0|1,0,1]=4 17036 B9R1.10 CC1(O)CCC(N)CC1 Amb20624019 [0,1,0,1,0,0|0,0,2]=4 17037 B9R1.10 CC1(O)CCC(N)CC1 Amb22755958 [0,1,0,1,0,0|0,0,2]=4 17038 B9R1.10 CC1(O)CCC(O)CC1 Amb25674827 [0,1,0,1,0,0|0,0,2]=4 17039 B9R1.10 CC1(O)CCC(S)CC1 Amb32788129 [0,1,0,1,0,0|0,0,2]=4 17040 B9R1.10 CC1CCC(C)(C)CC1 Amb22227677 [0,1,0,1,0,0|1,0,1]=4 17041 B9R1.10 CC1CCC(C)(N)CC1 Amb13952177 [0,1,0,1,0,0|1,0,1]=4 17042 B9R1.10 CC1CCC(C)(N)CC1 Amb9676078 [0,1,0,1,0,0|1,0,1]=4 17043 B9R1.10 CC1CCC(C)(O)CC1 Amb9675900 [0,1,0,1,0,0|0,0,2]=4 17044 B9R1.10 CP1(=O)CCC(=O)CC1 Amb26489398 [0,1,0,1,0,0|1,0,1]=4 17045 B9R1.10 CP1(=S)CCC(O)CC1 Amb27456672 [0,1,0,1,0,0|1,1,0]=4 17046 B9R1.10 C[C@H]1CC[C@@](C)(N)CC1 Amb27168662 [0,1,0,1,0,0|1,0,1]=4 17047 B9R1.10 C[C@H]1CC[C@](C)(N)CC1 Amb27259317 [0,1,0,1,0,0|1,0,1]=4 17048 B9R1.10 C[C@H]1CC[C@](C)(O)CC1 Amb28205300 [0,1,0,1,0,0|0,0,2]=4 17049 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb23440250 [0,1,0,1,0,0|1,0,1]=4 17050 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb24645739 [0,1,0,1,0,0|1,0,1]=4 17051 B9R1.10 C[C@]1(N)CC[C@H](O)CC1 Amb23440251 [0,1,0,1,0,0|1,0,1]=4 17052 B9R1.10 C[C@]1(N)CC[C@H](O)CC1 Amb26504982 [0,1,0,1,0,0|1,0,1]=4 17053 B9R1.10 C[C@]1(O)CC[C@@H](N)CC1 Amb22746430 [0,1,0,1,0,0|0,0,2]=4 17054 B9R1.10 C[C@]1(O)CC[C@@H](O)CC1 Amb24643905 [0,1,0,1,0,0|0,0,2]=4 17055 B9R1.10 C[C@]1(O)CC[C@H](N)CC1 Amb22886178 [0,1,0,1,0,0|0,0,2]=4 17056 B9R1.10 C[C@]1(O)CC[C@H](O)CC1 Amb27421997 [0,1,0,1,0,0|0,0,2]=4 17057 B9R1.10 C[N+]1(C)CCC(O)CC1 Amb24117819 [0,1,0,1,0,0|2,0,0]=4 17058 B9R1.10 C[N+]1(C)CCC(O)CC1 Amb35826257 [0,1,0,1,0,0|2,0,0]=4 17059 B9R1.10 C[Si]1(C)CCC(N)CC1 Amb27619684 [0,1,0,1,0,0|1,1,0]=4 17060 B9R1.10 NC1CCS(=O)(=O)CC1 Amb6479163 [0,1,0,1,0,0|2,0,0]=4 17061 B9R1.10 NC1CCS(=O)(=O)CC1 Amb7969747 [0,1,0,1,0,0|2,0,0]=4 17062 B9R1.10 O=S1(=O)CCC(Br)CC1 Amb20667734 [0,1,0,1,0,0|2,0,0]=4 17063 B9R1.10 O=S1(=O)CCC(Cl)CC1 Amb18180187 [0,1,0,1,0,0|2,0,0]=4 17064 B9R1.10 O=S1(=O)CCC(I)CC1 Amb20668982 [0,1,0,1,0,0|2,0,0]=4 17065 B9R1.10 O=S1(=O)CCC(O)CC1 Amb10608457 [0,1,0,1,0,0|2,0,0]=4 17066 B9R1.10 O=S1(=O)CCC(S)CC1 Amb18792731 [0,1,0,1,0,0|2,0,0]=4 17067 B9R1.55 CC(=O)C1=C(C)C(C)C1 Amb28122458 [0,1,0,1,0,0|0,0,2]=4 17068 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,1,0,0|1,0,0]=3 17069 B9R1.55 CC(=O)[C@@H]1C[C@H](Cl)[C@H]1Cl Amb27244175 [0,1,0,1,0,0|1,0,0]=3 17070 B9R1.55 CC(O)C1CC(C)C1C Amb27174537 [0,1,0,1,0,0|0,0,2]=4 17071 B9R1.55 CC1CC(C(=O)Cl)N1C Amb27594214 [0,1,0,1,0,0|2,0,0]=4 17072 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,1,0,0|2,0,0]=4 17073 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,1,0,0|2,0,0]=4 17074 B9R1.55 C[C@@H]1C[C@H](C(=O)Cl)N1C Amb27654275 [0,1,0,1,0,0|2,0,0]=4 17075 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,1,0,1,0,0|1,0,0]=3 17076 B9R1.55 C[C@H]1C[C@@H](C(=O)Cl)N1C Amb27858264 [0,1,0,1,0,0|2,0,0]=4 17077 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,1,0,1,0,0|2,0,0]=4 17078 B9R1.82 CC(CO)C1CC(=O)O1 Amb28315511 [0,1,0,1,0,0|2,0,0]=4 17079 B9R1.82 CCC(Br)C1CC(=O)O1 Amb27636202 [0,1,0,1,0,0|1,0,0]=3 17080 B9R1.82 CCC(C)C1CC(=O)N1 Amb27780586 [0,1,0,1,0,0|1,0,0]=3 17081 B9R1.82 CCC(O)C1CC(N)C1 Amb35625272 [0,1,0,1,0,0|1,0,1]=4 17082 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,1]=4 17083 B9R1.82 COC(C)C1CC(=O)N1 Amb28320401 [0,1,0,1,0,0|2,0,0]=4 17084 B9R1.82 C[C@@H](CO)[C@@H]1CC(=O)N1 Amb28059566 [0,1,0,1,0,0|2,0,0]=4 17085 B9R1.125 C=C1CCC(C)(CO)C1 Amb28138620 [0,1,0,1,0,0|2,0,0]=4 17086 B9R1.125 CC1(C#N)CCC(=O)C1 Amb24722939 [0,1,0,1,0,0|1,0,1]=4 17087 B9R1.125 CC1(C=O)CCC(=O)C1 Amb28285173 [0,1,0,1,0,0|1,0,1]=4 17088 B9R1.125 CC1(CBr)CNC(=O)C1 Amb32666888 [0,1,0,1,0,0|2,0,0]=4 17089 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,1,0,1,0,0|2,0,0]=4 17090 B9R1.125 CC1(CN)CCC(=O)N1 Amb28935017 [0,1,0,1,0,0|2,0,0]=4 17091 B9R1.125 CC1(CN)CCC(=O)O1 Amb27815595 [0,1,0,1,0,0|2,0,0]=4 17092 B9R1.125 CC1(CN)CNC(=O)C1 Amb24677517 [0,1,0,1,0,0|2,0,0]=4 17093 B9R1.125 CC1(CO)CCC(=O)N1 Amb25796503 [0,1,0,1,0,0|2,0,0]=4 17094 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,1,0,1,0,0|2,0,0]=4 17095 B9R1.125 CC1(CO)COC(=O)C1 Amb24748377 [0,1,0,1,0,0|2,0,0]=4 17096 B9R1.125 CC1(CO)CSC(=O)C1 Amb27594628 [0,1,0,1,0,0|2,0,0]=4 17097 B9R1.125 CCC1(C)CC(=O)CO1 Amb27803429 [0,1,0,1,0,0|1,0,0]=3 17098 B9R1.125 CCC1(C)CC(=O)NN1 Amb35685804 [0,1,0,1,0,0|2,0,0]=4 17099 B9R1.125 CCC1(C)CNC(=O)C1 Amb24655544 [0,1,0,1,0,0|1,0,0]=3 17100 B9R1.125 CCC1(C)CSC(=O)C1 Amb26406975 [0,1,0,1,0,0|1,0,0]=3 17101 B9R1.125 CCC1(C)N=C(C)CS1 Amb24394922 [0,1,0,1,0,0|2,0,0]=4 17102 B9R1.125 CCC1(C)NCC(=O)N1 Amb27196981 [0,1,0,1,0,0|2,0,0]=4 17103 B9R1.125 CCC1(F)CCC(N)C1 Amb28250554 [0,1,0,1,0,0|1,0,1]=4 17104 B9R1.125 CCC1(N)CCC(C)C1 Amb28292255 [0,1,0,1,0,0|1,0,1]=4 17105 B9R1.125 CCC1(O)CCC(C)C1 Amb25132617 [0,1,0,1,0,0|1,0,1]=4 17106 B9R1.125 CCC1(O)CCC(N)C1 Amb27413240 [0,1,0,1,0,0|1,0,1]=4 17107 B9R1.125 CC[C@]1(C)CCC(=O)C1 Amb27838732 [0,1,0,1,0,0|0,0,0]=2 17108 B9R1.125 C[C@@]1(C=O)CCC(=O)C1 Amb27798280 [0,1,0,1,0,0|1,0,1]=4 17109 B9R1.125 O=C1CC(O)(CF)CO1 Amb27495587 [0,1,0,1,0,0|2,0,0]=4 17110 B9R1.127 C=CC1(C)CC1C(C)=O Amb27948651 [0,1,0,1,0,0|0,0,2]=4 17111 B9R1.127 CC(=O)C1OC1(C)CCl Amb24670937 [0,1,0,1,0,0|2,0,0]=4 17112 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|2,0,0]=4 17113 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|1,0,0]=3 17114 B9R1.133 CCC1CCS(=O)(=O)N1 Amb32992184 [0,1,0,1,0,0|2,0,0]=4 17115 B9R1.133 CCC1COS(=O)(=O)C1 Amb28251685 [0,1,0,1,0,0|2,0,0]=4 17116 B9R1.133 CNC1CCS(=N)(=O)C1 Amb32671202 [0,1,0,1,0,0|2,0,0]=4 17117 B9R1.133 CNC1CCS(=N)(=O)C1 Amb32927015 [0,1,0,1,0,0|2,0,0]=4 17118 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1290363 [0,1,0,1,0,0|2,0,0]=4 17119 B9R1.133 CNC1CCS(=O)(=O)C1 Amb5716905 [0,1,0,1,0,0|2,0,0]=4 17120 B9R1.133 COC1CCS(=O)(=O)C1 Amb2793199 [0,1,0,1,0,0|2,0,0]=4 17121 B9R1.133 C[NH2+]C1CCS(=O)(=O)C1 Amb3318766 [0,1,0,1,0,0|2,0,0]=4 17122 B9R1.133 C[NH2+]C1CCS(=O)(=O)C1 Amb5716909 [0,1,0,1,0,0|2,0,0]=4 17123 B9R1.133 NCC1CCS(=O)(=O)C1 Amb19204939 [0,1,0,1,0,0|2,0,0]=4 17124 B9R1.133 NCC1CCS(=O)(=O)C1 Amb2793200 [0,1,0,1,0,0|2,0,0]=4 17125 B9R1.133 O=P1(O)CCC(CO)C1 Amb27853831 [0,1,0,1,0,0|2,0,0]=4 17126 B9R1.133 O=S1(=O)CCC(CBr)C1 Amb25321623 [0,1,0,1,0,0|2,0,0]=4 17127 B9R1.133 O=S1(=O)CCC(CCl)C1 Amb9751094 [0,1,0,1,0,0|2,0,0]=4 17128 B9R1.133 O=S1(=O)CCC(CO)C1 Amb2548453 [0,1,0,1,0,0|2,0,0]=4 17129 B9R1.133 O=S1(=O)CCC(CS)C1 Amb18062508 [0,1,0,1,0,0|2,0,0]=4 17130 B9R1.133 [NH3+]CC1CCS(=O)(=O)C1 Amb5716911 [0,1,0,1,0,0|2,0,0]=4 17131 B9R1.138 CC1C(N)CCS1(=O)=O Amb25888704 [0,1,0,1,0,0|2,0,0]=4 17132 B9R1.138 CC1C(N)CCS1(=O)=O Amb28895949 [0,1,0,1,0,0|2,0,0]=4 17133 B9R1.138 CC1C(O)CCC1(C)C Amb27857523 [0,1,0,1,0,0|1,0,1]=4 17134 B9R1.138 CC1C(S)CCS1(=O)=O Amb27158581 [0,1,0,1,0,0|2,0,0]=4 17135 B9R1.138 C[C@@H]1[C@H](N)CCS1(=O)=O Amb28071322 [0,1,0,1,0,0|2,0,0]=4 17136 B9R1.138 C[C@@H]1[C@H](N)CCS1(=O)=O Amb32661165 [0,1,0,1,0,0|2,0,0]=4 17137 B9R1.138 C[C@H]1[C@@H](N)CCS1(=O)=O Amb26078845 [0,1,0,1,0,0|2,0,0]=4 17138 B9R1.138 C[C@H]1[C@@H](N)CCS1(=O)=O Amb35745774 [0,1,0,1,0,0|2,0,0]=4 17139 B9R1.147 C=C(C)CCC1(N)CC1 Amb33200279 [0,1,0,1,0,0|1,0,0]=3 17140 B9R1.147 C=C(C)CCC1(O)CC1 Amb33199208 [0,1,0,1,0,0|1,0,0]=3 17141 B9R1.147 CC(=O)CCC1(C)CC1 Amb33314305 [0,1,0,1,0,0|0,0,0]=2 17142 B9R1.147 CC(=O)NCC1(C)CC1 Amb28189735 [0,1,0,1,0,0|1,0,0]=3 17143 B9R1.147 CC(=O)NCC1(N)CC1 Amb33228760 [0,1,0,1,0,0|1,0,0]=3 17144 B9R1.147 CC(=O)OCC1(F)CC1 Amb28291710 [0,1,0,1,0,0|1,0,0]=3 17145 B9R1.147 CC(=O)SCC1(C)CC1 Amb28120147 [0,1,0,1,0,0|1,0,0]=3 17146 B9R1.147 CC(=O)\C=C\C1(C)CC1 Amb33079784 [0,1,0,1,0,0|0,0,2]=4 17147 B9R1.147 CC(C)=CCC1(N)CC1 Amb29883940 [0,1,0,1,0,0|1,0,1]=4 17148 B9R1.147 CC(C)CCC1(N)CC1 Amb18523798 [0,1,0,1,0,0|1,0,1]=4 17149 B9R1.147 CC(C)CCC1(O)CC1 Amb24642189 [0,1,0,1,0,0|1,0,1]=4 17150 B9R1.147 CC(N)CCC1(C)CC1 Amb33314156 [0,1,0,1,0,0|1,0,1]=4 17151 B9R1.147 CC(O)CCC1(C)CC1 Amb33313079 [0,1,0,1,0,0|0,0,2]=4 17152 B9R1.147 CC(O)CCC1(N)CC1 Amb35643076 [0,1,0,1,0,0|0,0,2]=4 17153 B9R1.147 CC(O)CCC1(O)CC1 Amb28205941 [0,1,0,1,0,0|0,0,2]=4 17154 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,1,0,1,0,0|1,0,0]=3 17155 B9R1.147 CC1(CCS(=O)Cl)CC1 Amb32720683 [0,1,0,1,0,0|2,0,0]=4 17156 B9R1.147 CC1(CCS(=O)[O-])CC1 Amb32754822 [0,1,0,1,0,0|2,0,0]=4 17157 B9R1.147 CC1(CCS(N)=O)CC1 Amb32720684 [0,1,0,1,0,0|2,0,0]=4 17158 B9R1.147 CC1(CC[N+](=O)[O-])CC1 Amb33312920 [0,1,0,1,0,0|2,0,0]=4 17159 B9R1.147 CC1(CNC(=O)Cl)CC1 Amb35633322 [0,1,0,1,0,0|2,0,0]=4 17160 B9R1.147 CC1(NCC(=O)O)CC1 Amb27444501 [0,1,0,1,0,0|2,0,0]=4 17161 B9R1.147 CC1(NCC(N)=O)CC1 Amb27974935 [0,1,0,1,0,0|2,0,0]=4 17162 B9R1.147 CC1(OCC(=O)O)CC1 Amb26056469 [0,1,0,1,0,0|2,0,0]=4 17163 B9R1.147 CN(C)CCC1(N)CC1 Amb18203237 [0,1,0,1,0,0|2,0,0]=4 17164 B9R1.147 CN(C)CCC1(O)CC1 Amb24615987 [0,1,0,1,0,0|2,0,0]=4 17165 B9R1.147 CS(=O)CCC1(N)CC1 Amb28142473 [0,1,0,1,0,0|1,0,0]=3 17166 B9R1.147 C[C@@H](N)CCC1(C)CC1 Amb33313122 [0,1,0,1,0,0|1,0,1]=4 17167 B9R1.147 C[C@@H](O)CCC1(C)CC1 Amb33310957 [0,1,0,1,0,0|0,0,2]=4 17168 B9R1.147 C[C@H](N)CCC1(C)CC1 Amb33313121 [0,1,0,1,0,0|1,0,1]=4 17169 B9R1.147 C[C@H](O)CCC1(C)CC1 Amb33311525 [0,1,0,1,0,0|0,0,2]=4 17170 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,1,0,1,0,0|1,0,0]=3 17171 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,1,0,1,0,0|1,0,0]=3 17172 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,1,0,1,0,0|1,0,0]=3 17173 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,1,0,1,0,0|1,0,0]=3 17174 B9R1.185 CCC(Cl)C1CC1(C)C Amb27810718 [0,1,0,1,0,0|1,0,1]=4 17175 B9R1.185 CCC(N)C1CC1(C)C Amb25978589 [0,1,0,1,0,0|1,0,1]=4 17176 B9R1.185 CCC(O)C1CC1(C)C Amb27603064 [0,1,0,1,0,0|1,0,1]=4 17177 B9R1.185 CCC(S)C1CC1(C)C Amb26541330 [0,1,0,1,0,0|1,0,1]=4 17178 B9R1.185 CC[C@@H](O)C1CC1(C)C Amb27272856 [0,1,0,1,0,0|1,0,1]=4 17179 B9R1.185 CC[C@@H](O)[C@@H]1CC1(C)C Amb27978407 [0,1,0,1,0,0|1,0,1]=4 17180 B9R1.185 CC[C@H](O)[C@@H]1CC1(C)C Amb27620170 [0,1,0,1,0,0|1,0,1]=4 17181 B9R1.185 CC[C@H](O)[C@H]1CC1(C)C Amb27420475 [0,1,0,1,0,0|1,0,1]=4 17182 B9R1.19 CC(C)(C)C1CCCC1 Amb27488715 [0,1,0,1,0,0|1,0,1]=4 17183 B9R1.19 CC(C)(N)C1CCCC1 Amb28995278 [0,1,0,1,0,0|1,0,1]=4 17184 B9R1.19 CC(C)(N)C1CCCC1 Amb9677043 [0,1,0,1,0,0|1,0,1]=4 17185 B9R1.19 CC(C)(O)C1CCCC1 Amb9677029 [0,1,0,1,0,0|0,0,2]=4 17186 B9R1.19 CP(=O)(O)C1CCCN1 Amb27799028 [0,1,0,1,0,0|2,0,0]=4 17187 B9R1.19 CP(C)(=O)C1CCCN1 Amb35746231 [0,1,0,1,0,0|2,0,0]=4 17188 B9R1.19 CP(C)(=O)C1CCCN1 Amb35752075 [0,1,0,1,0,0|2,0,0]=4 17189 B9R1.19 CP(C)(=O)C1CCNC1 Amb33804856 [0,1,0,1,0,0|2,0,0]=4 17190 B9R1.19 CS(=N)(=O)C1CCCC1 Amb32671035 [0,1,0,1,0,0|1,0,0]=3 17191 B9R1.19 CS(=N)(=O)C1CCCC1 Amb33483189 [0,1,0,1,0,0|1,0,0]=3 17192 B9R1.19 CS(=N)(=O)C1CCOC1 Amb32675174 [0,1,0,1,0,0|2,0,0]=4 17193 B9R1.19 CS(=N)(=O)C1CCOC1 Amb33456977 [0,1,0,1,0,0|2,0,0]=4 17194 B9R1.19 CS(=N)(=O)N1CCCC1 Amb29851643 [0,1,0,1,0,0|2,0,0]=4 17195 B9R1.19 CS(=O)(=O)C1CCNC1 Amb21963335 [0,1,0,1,0,0|2,0,0]=4 17196 B9R1.19 CS(=O)(=O)C1CCNC1 Amb3940946 [0,1,0,1,0,0|2,0,0]=4 17197 B9R1.19 CS(=O)(=O)N1CCCC1 Amb3357687 [0,1,0,1,0,0|2,0,0]=4 17198 B9R1.19 CS(=O)(=O)[C@@H]1CCNC1 Amb20671397 [0,1,0,1,0,0|2,0,0]=4 17199 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 Amb20671396 [0,1,0,1,0,0|2,0,0]=4 17200 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 Amb22405888 [0,1,0,1,0,0|2,0,0]=4 17201 B9R1.19 C[S@](=N)(=O)C1CCCC1 Amb33744010 [0,1,0,1,0,0|1,0,0]=3 17202 B9R1.19 NS(=O)(=O)C1CCCC1 Amb9818657 [0,1,0,1,0,0|2,0,0]=4 17203 B9R1.19 O=S(=O)(Cl)C1CCCC1 Amb5735429 [0,1,0,1,0,0|2,0,0]=4 17204 B9R1.19 O=S(=O)(F)C1CCCC1 Amb27667443 [0,1,0,1,0,0|2,0,0]=4 17205 B9R1.19 O=S(=O)(O)C1CCCC1 Amb24615046 [0,1,0,1,0,0|2,0,0]=4 17206 B9R1.19 O=S(=O)([O-])C1CCCC1 Amb33625229 [0,1,0,1,0,0|2,0,0]=4 17207 B9R1.47 CC1CC1CC(C)(C)N Amb33145412 [0,1,0,1,0,0|1,0,1]=4 17208 B9R1.47 CC1CC1CC(C)(C)O Amb33144864 [0,1,0,1,0,0|0,0,2]=4 17209 B9R1.47 CC1CC1CS(=O)(=O)Cl Amb25709771 [0,1,0,1,0,0|2,0,0]=4 17210 B9R1.47 CC1CC1CS(=O)(=O)F Amb33352217 [0,1,0,1,0,0|2,0,0]=4 17211 B9R1.47 CC1CC1CS(N)(=O)=O Amb25342147 [0,1,0,1,0,0|2,0,0]=4 17212 B9R1.47 CC1CC1NS(C)(=N)=O Amb30019221 [0,1,0,1,0,0|2,0,0]=4 17213 B9R1.47 CC1CC1NS(C)(=O)=O Amb27258860 [0,1,0,1,0,0|2,0,0]=4 17214 B9R1.47 CS(=O)(=O)CC1CC1N Amb33055762 [0,1,0,1,0,0|2,0,0]=4 17215 B9R1.47 CS(=O)(=O)C[C@@H]1C[C@H]1N Amb33055759 [0,1,0,1,0,0|2,0,0]=4 17216 B9R1.68 CC1CCC1S(=O)(=O)Cl Amb24532584 [0,1,0,1,0,0|2,0,0]=4 17217 B9R1.68 CC1CCC1S(=O)(=O)F Amb33352371 [0,1,0,1,0,0|2,0,0]=4 17218 B9R1.68 CC1CCC1S(N)(=O)=O Amb25833817 [0,1,0,1,0,0|2,0,0]=4 17219 B9R1.87 CCC1CC1S(=O)(=O)Cl Amb24116962 [0,1,0,1,0,0|2,0,0]=4 17220 B9R1.87 CS(=O)(=O)C1CC1CN Amb23453034 [0,1,0,1,0,0|2,0,0]=4 17221 B9R1.114 CC(C)(N)CC1CCC1 Amb26565781 [0,1,0,1,0,0|1,0,1]=4 17222 B9R1.114 CC(C)(O)CC1CCC1 Amb27146277 [0,1,0,1,0,0|0,0,2]=4 17223 B9R1.114 CS(=N)(=O)CC1CNC1 Amb35750588 [0,1,0,1,0,0|2,0,0]=4 17224 B9R1.114 CS(=N)(=O)CC1CNC1 Amb35751710 [0,1,0,1,0,0|2,0,0]=4 17225 B9R1.114 CS(=N)(=O)CC1CNC1 Amb35788958 [0,1,0,1,0,0|2,0,0]=4 17226 B9R1.114 CS(=N)(=O)NC1CCC1 Amb35710953 [0,1,0,1,0,0|2,0,0]=4 17227 B9R1.114 CS(=O)(=O)CC1CCN1 Amb23453022 [0,1,0,1,0,0|2,0,0]=4 17228 B9R1.114 CS(=O)(=O)CC1CNC1 Amb22496457 [0,1,0,1,0,0|2,0,0]=4 17229 B9R1.114 CS(=O)(=O)CC1CNC1 Amb33714475 [0,1,0,1,0,0|2,0,0]=4 17230 B9R1.114 CS(=O)(=O)C[C@@H]1CCN1 Amb33295297 [0,1,0,1,0,0|2,0,0]=4 17231 B9R1.114 CS(=O)(=O)C[C@@H]1CCN1 Amb33295299 [0,1,0,1,0,0|2,0,0]=4 17232 B9R1.114 CS(=O)(=O)NC1CCC1 Amb25118044 [0,1,0,1,0,0|2,0,0]=4 17233 B9R1.114 NS(=O)(=O)CC1CCC1 Amb22059636 [0,1,0,1,0,0|2,0,0]=4 17234 B9R1.114 O=S(=O)(Br)CC1CCC1 Amb27426375 [0,1,0,1,0,0|2,0,0]=4 17235 B9R1.114 O=S(=O)(Cl)CC1CCC1 Amb22001639 [0,1,0,1,0,0|2,0,0]=4 17236 B9R1.114 O=S(=O)(F)CC1CCC1 Amb32717426 [0,1,0,1,0,0|2,0,0]=4 17237 B9R1.114 O=S(=O)([O-])CC1CCC1 Amb27236103 [0,1,0,1,0,0|2,0,0]=4 17238 B9R1.115 CC(C)(N)CCC1CC1 Amb26599390 [0,1,0,1,0,0|1,0,1]=4 17239 B9R1.115 CC(C)(O)CCC1CC1 Amb25777764 [0,1,0,1,0,0|0,0,2]=4 17240 B9R1.115 CS(=N)(=O)NCC1CC1 Amb35704437 [0,1,0,1,0,0|2,0,0]=4 17241 B9R1.115 CS(=O)(=O)CCC1CC1 Amb27450215 [0,1,0,1,0,0|1,0,0]=3 17242 B9R1.115 CS(=O)(=O)CCC1CO1 Amb24361854 [0,1,0,1,0,0|2,0,0]=4 17243 B9R1.115 CS(=O)(=O)CC[C@@H]1CO1 Amb33054010 [0,1,0,1,0,0|2,0,0]=4 17244 B9R1.115 CS(=O)(=O)CC[C@H]1CO1 Amb33054009 [0,1,0,1,0,0|2,0,0]=4 17245 B9R1.115 CS(=O)(=O)NCC1CC1 Amb27489240 [0,1,0,1,0,0|2,0,0]=4 17246 B9R1.115 CS(=O)(=O)OCC1CC1 Amb27248536 [0,1,0,1,0,0|2,0,0]=4 17247 B9R1.115 CS(C)(=O)=NCC1CC1 Amb27395537 [0,1,0,1,0,0|2,0,0]=4 17248 B9R1.115 NS(=O)(=O)CCC1CC1 Amb24478680 [0,1,0,1,0,0|2,0,0]=4 17249 B9R1.115 O=S(=O)(Cl)CCC1CC1 Amb22059472 [0,1,0,1,0,0|2,0,0]=4 17250 B9R1.115 O=S(=O)(F)CCC1CC1 Amb27598648 [0,1,0,1,0,0|2,0,0]=4 17251 B9R1.150 CC1(C)CCCC1(C)N Amb24568711 [0,1,0,1,0,0|1,0,1]=4 17252 B9R1.150 CC1(C)CCCC1(C)N Amb33743680 [0,1,0,1,0,0|1,0,1]=4 17253 B9R1.150 CC1(C)CCCC1(C)O Amb27838538 [0,1,0,1,0,0|0,0,2]=4 17254 B9R1.150 CC1(O)CCCC1(C)O Amb27944579 [0,1,0,1,0,0|0,0,2]=4 17255 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [0,1,0,1,0,0|1,0,1]=4 17256 B9R1.161 C=C(C)C1OC1C(C)=O Amb24520738 [0,1,0,1,0,0|1,0,1]=4 17257 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [0,1,0,1,0,0|1,0,1]=4 17258 B9R1.161 C=C(C)[C@@H]1O[C@@H]1C(C)=O Amb25163815 [0,1,0,1,0,0|1,0,1]=4 17259 B9R1.161 C=C(C)[C@H]1C[C@H]1C(C)=O Amb28054459 [0,1,0,1,0,0|0,0,1]=3 17260 B9R1.161 CC(=O)C1CC1=C(C)C Amb27409612 [0,1,0,1,0,0|0,0,2]=4 17261 B9R1.161 CC(=O)C1CC1C(C)=O Amb27861276 [0,1,0,1,0,0|0,0,1]=3 17262 B9R1.161 CC(=O)C1CC1C(C)C Amb28049066 [0,1,0,1,0,0|0,0,0]=2 17263 B9R1.161 CC(=O)C1OC1C(C)C Amb27212949 [0,1,0,1,0,0|1,0,0]=3 17264 B9R1.161 CC(=O)[C@@H]1C[C@H]1C(C)=O Amb28246517 [0,1,0,1,0,0|0,0,1]=3 17265 B9R1.161 CC(=O)[C@H]1C[C@H]1C(C)=O Amb28248083 [0,1,0,1,0,0|0,0,1]=3 17266 B9R1.161 CC(C)=C1CC1C(C)O Amb27806624 [0,1,0,1,0,0|1,0,1]=4 17267 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,1,0,1,0,0|1,0,0]=3 17268 B9R1.161 CC(C)C1CC1C(C)N Amb27169286 [0,1,0,1,0,0|1,0,1]=4 17269 B9R1.161 CC(C)C1CC1C(C)O Amb28190309 [0,1,0,1,0,0|0,0,2]=4 17270 B9R1.161 CC(C)C1CC1C(N)=O Amb27815060 [0,1,0,1,0,0|1,0,0]=3 17271 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,1,0,1,0,0|1,0,0]=3 17272 B9R1.161 CC(C)[C@@H]1C[C@H]1[C@@H](C)O Amb27852782 [0,1,0,1,0,0|0,0,2]=4 17273 B9R1.161 CC(C)[C@@H]1C[C@H]1[C@H](C)O Amb27853890 [0,1,0,1,0,0|0,0,2]=4 17274 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,1,0,1,0,0|2,0,0]=4 17275 B9R1.161 CC(N)C1CC1C(=O)O Amb27441985 [0,1,0,1,0,0|1,0,0]=3 17276 B9R1.161 CC(O)C1CC1C(=O)O Amb25888760 [0,1,0,1,0,0|1,0,0]=3 17277 B9R1.161 CC(O)[C@@H]1C[C@@H]1C(=O)O Amb28457538 [0,1,0,1,0,0|1,0,0]=3 17278 B9R1.161 CC(O)[C@@H]1C[C@H]1C(=O)O Amb27489157 [0,1,0,1,0,0|1,0,0]=3 17279 B9R1.161 NC(=O)C1CC1C(F)F Amb27236256 [0,1,0,1,0,0|2,0,0]=4 17280 B9R1.161 O=C(O)C1CC1C(F)F Amb25338314 [0,1,0,1,0,0|2,0,0]=4 17281 B9R1.161 O=C(O)[C@@H]1C[C@@H]1C(F)F Amb26459940 [0,1,0,1,0,0|2,0,0]=4 17282 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(F)F Amb24654017 [0,1,0,1,0,0|2,0,0]=4 17283 B9R1.166 CC(=O)C1OCC1(C)C Amb27226252 [0,1,0,1,0,0|1,0,0]=3 17284 B9R1.166 CC(=O)[C@H]1CC[C@@]1(C)F Amb27788386 [0,1,0,1,0,0|0,0,0]=2 17285 B9R1.166 CC(Br)C1CCC1(C)C Amb27260941 [0,1,0,1,0,0|1,0,1]=4 17286 B9R1.166 CC(Cl)C1CCC1(C)C Amb27973343 [0,1,0,1,0,0|1,0,1]=4 17287 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,1,0,1,0,0|1,0,0]=3 17288 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,1,0,1,0,0|2,0,0]=4 17289 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,1,0,1,0,0|2,0,0]=4 17290 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,1,0,1,0,0|2,0,0]=4 17291 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,1,0,1,0,0|2,0,0]=4 17292 B9R1.166 CC1(C)COC1C(=O)Cl Amb35745011 [0,1,0,1,0,0|2,0,0]=4 17293 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,1,0,1,0,0|2,0,0]=4 17294 B9R1.166 CN(N)C1CCC1(C)C Amb29875559 [0,1,0,1,0,0|2,0,0]=4 17295 B9R1.166 O=C(O)C1CCC1(F)F Amb24452747 [0,1,0,1,0,0|2,0,0]=4 17296 B9R1.170 CC(=O)CC1CC1(C)O Amb28461242 [0,1,0,1,0,0|0,0,0]=2 17297 B9R1.170 CC(=O)CC1CC1(F)F Amb25370357 [0,1,0,1,0,0|1,0,0]=3 17298 B9R1.170 CC(N)CC1CC1(C)C Amb33735893 [0,1,0,1,0,0|1,0,1]=4 17299 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,1,0,1,0,0|1,0,0]=3 17300 B9R1.170 CC1(C)CC1NC(=O)Cl Amb35625820 [0,1,0,1,0,0|2,0,0]=4 17301 B9R1.170 CN(C)CC1CC1(C)C Amb27945598 [0,1,0,1,0,0|2,0,0]=4 17302 B9R1.170 C[C@@H](N)CC1CC1(C)C Amb33747372 [0,1,0,1,0,0|1,0,1]=4 17303 B9R1.170 C[C@H](N)CC1CC1(C)C Amb33744600 [0,1,0,1,0,0|1,0,1]=4 17304 B9R1.170 C[C@H](O)C[C@@H]1C[C@]1(C)O Amb27422515 [0,1,0,1,0,0|0,0,2]=4 17305 B9R1.170 C[C@H](O)C[C@H]1C[C@@]1(C)O Amb27260265 [0,1,0,1,0,0|0,0,2]=4 17306 B9R1.170 NC(=O)CC1CC1(Cl)Cl Amb27809283 [0,1,0,1,0,0|2,0,0]=4 17307 B9R1.170 O=C(O)CC1CC1(Cl)Cl Amb28458433 [0,1,0,1,0,0|2,0,0]=4 17308 B9R1.170 O=C(O)CC1CC1(F)F Amb22411507 [0,1,0,1,0,0|2,0,0]=4 17309 B9R1.170 O=C([O-])CC1CC1(F)F Amb30585198 [0,1,0,1,0,0|2,0,0]=4 17310 B9R2.18 C=C1C2CCC(=O)C12 Amb27749879 [0,0,0,2,0,0|0,0,2]=4 17311 B9R2.18 C=C1C2CCC(O)C12 Amb27598579 [0,0,0,2,0,0|2,0,0]=4 17312 B9R2.18 CC1C2CCC(=O)C12 Amb27803582 [0,0,0,2,0,0|0,0,0]=2 17313 B9R2.18 CC1[C@@H]2CC[C@H](O)[C@H]12 Amb28052862 [0,0,0,2,0,0|0,0,2]=4 17314 B9R2.18 C[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27433144 [0,0,0,2,0,0|0,0,0]=2 17315 B9R2.18 C[C@H]1[C@@H]2CCC(=O)[C@H]12 Amb27433145 [0,0,0,2,0,0|0,0,0]=2 17316 B9R2.18 C[C@H]1[C@@H]2CC[C@@H](O)[C@H]12 Amb28345451 [0,0,0,2,0,0|0,0,2]=4 17317 B9R2.18 O=C1CC[C@H]2C(Br)[C@@H]12 Amb27630445 [0,0,0,2,0,0|1,0,0]=3 17318 B9R2.18 O=C1CC[C@H]2[C@@H](Br)[C@@H]12 Amb27644076 [0,0,0,2,0,0|1,0,0]=3 17319 B9R2.20 Cl[C@@H]1CC[C@@H]2CC[C@@H]21 Amb27777148 [0,0,0,2,0,0|1,0,1]=4 17320 B9R2.20 Cl[C@H]1CC[C@@H]2CC[C@H]12 Amb27212344 [0,0,0,2,0,0|1,0,1]=4 17321 B9R2.20 NC1=NCC2CCC12 Amb27602052 [0,0,0,2,0,0|2,0,0]=4 17322 B9R2.20 NC1CCC2CCC12 Amb26043876 [0,0,0,2,0,0|1,0,1]=4 17323 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [0,0,0,2,0,0|0,0,2]=4 17324 B9R2.20 O=C1CCC2CCC12 Amb26556513 [0,0,0,2,0,0|0,0,0]=2 17325 B9R2.20 O=C1CC[C@@H]2C=C[C@H]12 Amb27782001 [0,0,0,2,0,0|0,0,2]=4 17326 B9R2.20 O=C1CC[C@@H]2CC[C@H]12 Amb27214199 [0,0,0,2,0,0|0,0,0]=2 17327 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,0,0,2,0,0|1,0,0]=3 17328 B9R2.20 O=C1NC[C@@H]2CC[C@H]12 Amb28131123 [0,0,0,2,0,0|1,0,0]=3 17329 B9R2.20 O[C@@H]1CC[C@H]2CC[C@@H]12 Amb27420440 [0,0,0,2,0,0|0,0,2]=4 17330 B9R2.20 O[C@H]1CC[C@@H]2CC[C@H]12 Amb28256395 [0,0,0,2,0,0|0,0,2]=4 17331 B9R2.20 O[C@H]1CC[C@H]2CC[C@@H]12 Amb27653200 [0,0,0,2,0,0|0,0,2]=4 17332 B9R2.20 SC1CCC2CCC12 Amb32788214 [0,0,0,2,0,0|0,1,1]=4 17333 B9R2.20 SC1CC[C@@H]2CC[C@H]12 Amb32788780 [0,0,0,2,0,0|0,1,1]=4 17334 B9R2.31 CC1C2CC(=O)C1C2 Amb28193471 [0,0,0,2,0,0|0,0,0]=2 17335 B9R2.31 C[C@@H]1[C@@H]2C[C@H](O)[C@H]1C2 Amb27190682 [0,0,0,2,0,0|0,0,2]=4 17336 B9R2.31 C[C@@H]1[C@H]2CC(=O)[C@@H]1C2 Amb28320366 [0,0,0,2,0,0|0,0,0]=2 17337 B9R2.31 NC1C2CC1C(=O)N2 Amb27481752 [0,0,0,2,0,0|2,0,0]=4 17338 B9R2.31 NC1[C@@H]2C[C@H]1NC2=O Amb28131384 [0,0,0,2,0,0|2,0,0]=4 17339 B9R2.31 O=C1C[C@@H]2C[C@H]1[C@@H]2Cl Amb28195039 [0,0,0,2,0,0|1,0,0]=3 17340 B9R2.33 CC1=NC2CCC2N1 Amb27759845 [0,0,0,2,0,0|2,0,0]=4 17341 B9R2.33 ClC1CC2CCC2C1 Amb27974247 [0,0,0,2,0,0|1,0,1]=4 17342 B9R2.33 NC1CC2CCC2C1 Amb24696800 [0,0,0,2,0,0|1,0,1]=4 17343 B9R2.33 NN1CC2CCC2C1 Amb30028011 [0,0,0,2,0,0|2,0,0]=4 17344 B9R2.33 O=C1CC2C=CC2C1 Amb28059971 [0,0,0,2,0,0|0,0,2]=4 17345 B9R2.33 O=C1CC2CCC2C1 Amb28316189 [0,0,0,2,0,0|0,0,0]=2 17346 B9R2.33 O=C1CC2CCC2N1 Amb28398052 [0,0,0,2,0,0|1,0,0]=3 17347 B9R2.33 O=C1CC2CC[C@H]2C1 Amb28048983 [0,0,0,2,0,0|0,0,0]=2 17348 B9R2.33 O=C1C[C@@H]2CC[C@@H]2C1 Amb26937805 [0,0,0,2,0,0|0,0,0]=2 17349 B9R2.33 O=C1C[C@@H]2CC[C@@H]2N1 Amb27420727 [0,0,0,2,0,0|1,0,0]=3 17350 B9R2.33 O=C1NC2CCC2N1 Amb27804174 [0,0,0,2,0,0|2,0,0]=4 17351 B9R2.33 O=C1NC2CCC2O1 Amb26067754 [0,0,0,2,0,0|2,0,0]=4 17352 B9R2.33 OC1CC2CCC2C1 Amb28292645 [0,0,0,2,0,0|0,0,2]=4 17353 B9R2.33 OC1C[C@H]2CC[C@@H]2C1 Amb27208215 [0,0,0,2,0,0|0,0,2]=4 17354 B9R2.33 O[C@H]1C[C@@H]2CC[C@@H]2C1 Amb27836254 [0,0,0,2,0,0|0,0,2]=4 17355 B9R2.33 SC1CC2CCC2C1 Amb32788881 [0,0,0,2,0,0|0,1,1]=4 17356 B9R2.39 BrC1=C[C@H]2CC[C@@H]1C2 Amb28058988 [0,0,0,2,0,0|1,0,1]=4 17357 B9R2.39 BrC1CC2CCC1C2 Amb6365773 [0,0,0,2,0,0|1,0,1]=4 17358 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27880716 [0,0,0,2,0,0|1,0,1]=4 17359 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@H]1C2 Amb25934082 [0,0,0,2,0,0|1,0,1]=4 17360 B9R2.39 Br[C@@H]1C[C@H]2CC[C@@H]1C2 Amb26528019 [0,0,0,2,0,0|1,0,1]=4 17361 B9R2.39 Br[C@H]1C[C@@H]2CC[C@H]1C2 Amb25378969 [0,0,0,2,0,0|1,0,1]=4 17362 B9R2.39 Br[C@H]1C[C@H]2CC[C@H]1C2 Amb27215665 [0,0,0,2,0,0|1,0,1]=4 17363 B9R2.39 C=C1CC2CCC1C2 Amb4019165 [0,0,0,2,0,0|1,0,0]=3 17364 B9R2.39 CC1=CC2CCC1C2 Amb25246974 [0,0,0,2,0,0|1,0,0]=3 17365 B9R2.39 CC1=C[C@H]2CC[C@@H]1C2 Amb28320492 [0,0,0,2,0,0|1,0,0]=3 17366 B9R2.39 CC1CC2CCC1O2 Amb27202757 [0,0,0,2,0,0|0,0,2]=4 17367 B9R2.39 CC1NC2CCC1C2 Amb18203385 [0,0,0,2,0,0|1,0,1]=4 17368 B9R2.39 CN1C[C@H]2CC[C@@H]1C2 Amb27627840 [0,0,0,2,0,0|2,0,0]=4 17369 B9R2.39 ClC1CC2CCC1C2 Amb22360712 [0,0,0,2,0,0|1,0,1]=4 17370 B9R2.39 ClC1C[C@@H]2CC[C@H]1C2 Amb27203372 [0,0,0,2,0,0|1,0,1]=4 17371 B9R2.39 Cl[C@H]1C[C@H]2CC[C@@H]1C2 Amb27436694 [0,0,0,2,0,0|1,0,1]=4 17372 B9R2.39 NC1CC2CCC1C2 Amb19374620 [0,0,0,2,0,0|1,0,1]=4 17373 B9R2.39 NC1CC2CCC1C2 Amb3371573 [0,0,0,2,0,0|1,0,1]=4 17374 B9R2.39 NC1C[C@H]2CC[C@@H]1C2 Amb27420147 [0,0,0,2,0,0|1,0,1]=4 17375 B9R2.39 NN1CC2CCC1C2 Amb18641715 [0,0,0,2,0,0|2,0,0]=4 17376 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22745923 [0,0,0,2,0,0|1,0,1]=4 17377 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22757963 [0,0,0,2,0,0|1,0,1]=4 17378 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24181889 [0,0,0,2,0,0|1,0,1]=4 17379 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb3941691 [0,0,0,2,0,0|1,0,1]=4 17380 B9R2.39 N[C@H]1C[C@@H]2CCC1C2 Amb6753692 [0,0,0,2,0,0|1,0,1]=4 17381 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 Amb33871470 [0,0,0,2,0,0|1,0,1]=4 17382 B9R2.39 N[C@H]1C[C@H]2CC[C@@H]1C2 Amb27420218 [0,0,0,2,0,0|1,0,1]=4 17383 B9R2.39 O=C1CC2C=CC1C2 Amb4477237 [0,0,0,2,0,0|0,0,2]=4 17384 B9R2.39 O=C1CC2CC1CN2 Amb34912723 [0,0,0,2,0,0|1,0,0]=3 17385 B9R2.39 O=C1CC2CC1CO2 Amb28048948 [0,0,0,2,0,0|1,0,0]=3 17386 B9R2.39 O=C1CC2CC1CS2 Amb27199157 [0,0,0,2,0,0|1,0,0]=3 17387 B9R2.39 O=C1CC2CCC1C2 Amb6608983 [0,0,0,2,0,0|0,0,0]=2 17388 B9R2.39 O=C1CC2CCC1N2 Amb26502233 [0,0,0,2,0,0|1,0,0]=3 17389 B9R2.39 O=C1CC2CCC1O2 Amb25322815 [0,0,0,2,0,0|1,0,0]=3 17390 B9R2.39 O=C1CC2CNC1C2 Amb26860988 [0,0,0,2,0,0|1,0,0]=3 17391 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,0,0,2,0,0|1,0,0]=3 17392 B9R2.39 O=C1CC2CSC1C2 Amb28321970 [0,0,0,2,0,0|1,0,0]=3 17393 B9R2.39 O=C1CN2CCC1C2 Amb10067112 [0,0,0,2,0,0|1,0,0]=3 17394 B9R2.39 O=C1CN2CCC1C2 Amb20171539 [0,0,0,2,0,0|1,0,0]=3 17395 B9R2.39 O=C1CN2CC[C@@H]1C2 Amb26480461 [0,0,0,2,0,0|1,0,0]=3 17396 B9R2.39 O=C1C[C@@H]2C=C[C@H]1C2 Amb28385475 [0,0,0,2,0,0|0,0,2]=4 17397 B9R2.39 O=C1C[C@@H]2CC[C@@H]1C2 Amb27622753 [0,0,0,2,0,0|0,0,0]=2 17398 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 Amb4605941 [0,0,0,2,0,0|0,0,0]=2 17399 B9R2.39 O=C1C[C@@H]2C[C@H]1CN2 Amb26578211 [0,0,0,2,0,0|1,0,0]=3 17400 B9R2.39 O=C1C[C@@H]2C[C@H]1CN2 Amb33715684 [0,0,0,2,0,0|1,0,0]=3 17401 B9R2.39 O=C1C[C@H]2C=C[C@@H]1C2 Amb25061616 [0,0,0,2,0,0|0,0,2]=4 17402 B9R2.39 O=C1C[C@H]2CC[C@@H]1N2 Amb27421729 [0,0,0,2,0,0|1,0,0]=3 17403 B9R2.39 O=C1C[C@H]2CC[C@@H]1O2 Amb27195774 [0,0,0,2,0,0|1,0,0]=3 17404 B9R2.39 O=C1C[C@H]2CS[C@@H]1C2 Amb28428954 [0,0,0,2,0,0|1,0,0]=3 17405 B9R2.39 O=C1NC2CCC1C2 Amb20623082 [0,0,0,2,0,0|1,0,0]=3 17406 B9R2.39 O=C1NC2CNC1C2 Amb18641690 [0,0,0,2,0,0|2,0,0]=4 17407 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 Amb25174368 [0,0,0,2,0,0|1,0,0]=3 17408 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Amb22587593 [0,0,0,2,0,0|2,0,0]=4 17409 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 Amb8516352 [0,0,0,2,0,0|1,0,0]=3 17410 B9R2.39 O=C1OC2CCC1C2 Amb31379084 [0,0,0,2,0,0|1,0,0]=3 17411 B9R2.39 O=C1OC2CNC1C2 Amb15692521 [0,0,0,2,0,0|2,0,0]=4 17412 B9R2.39 O=C1OC2CNC1C2 Amb28934913 [0,0,0,2,0,0|2,0,0]=4 17413 B9R2.39 O=C1OC2CN[C@H]1C2 Amb27637868 [0,0,0,2,0,0|2,0,0]=4 17414 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb19516242 [0,0,0,2,0,0|2,0,0]=4 17415 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb27779719 [0,0,0,2,0,0|2,0,0]=4 17416 B9R2.39 O=S1CC2CC1CN2 Amb25806028 [0,0,0,2,0,0|2,0,0]=4 17417 B9R2.39 O=S1CC2CC1CN2 Amb32665001 [0,0,0,2,0,0|2,0,0]=4 17418 B9R2.39 O=S1C[C@@H]2C[C@@H]1CN2 Amb34914992 [0,0,0,2,0,0|2,0,0]=4 17419 B9R2.39 O=S1C[C@@H]2C[C@H]1CN2 Amb24560813 [0,0,0,2,0,0|2,0,0]=4 17420 B9R2.39 O=S1C[C@@H]2C[C@H]1CN2 Amb32664645 [0,0,0,2,0,0|2,0,0]=4 17421 B9R2.39 OC1CC2CCC1C2 Amb2780727 [0,0,0,2,0,0|0,0,2]=4 17422 B9R2.39 OC1CC2CC[C@H]1C2 Amb28079100 [0,0,0,2,0,0|0,0,2]=4 17423 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 Amb27962782 [0,0,0,2,0,0|0,0,2]=4 17424 B9R2.39 ON1C[C@@H]2CC[C@H]1C2 Amb25912114 [0,0,0,2,0,0|1,0,1]=4 17425 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27481081 [0,0,0,2,0,0|0,0,2]=4 17426 B9R2.39 O[C@@H]1C[C@H]2CCC1C2 Amb28455166 [0,0,0,2,0,0|0,0,2]=4 17427 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 Amb10844941 [0,0,0,2,0,0|0,0,2]=4 17428 B9R2.39 O[C@H]1CC2CC[C@@H]1C2 Amb27853961 [0,0,0,2,0,0|0,0,2]=4 17429 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1C2 Amb24567063 [0,0,0,2,0,0|0,0,2]=4 17430 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1C2 Amb3940163 [0,0,0,2,0,0|0,0,2]=4 17431 B9R2.39 SC1CC2CCC1C2 Amb25359572 [0,0,0,2,0,0|0,1,1]=4 17432 B9R2.47 CCC1CC2CC2N1 Amb27411817 [0,0,0,2,0,0|1,0,1]=4 17433 B9R2.47 CC[C@H]1C[C@@H]2C[C@@H]2N1 Amb27446310 [0,0,0,2,0,0|1,0,1]=4 17434 B9R2.54 C[C@@H]1[C@@H]2CC(O)C[C@@H]21 Amb27472588 [0,0,0,2,0,0|0,0,2]=4 17435 B9R2.54 C[C@@H]1[C@@H]2C[C@H](O)C[C@@H]21 Amb28346063 [0,0,0,2,0,0|0,0,2]=4 17436 B9R2.54 C[C@H]1[C@@H]2C[C@@H](O)C[C@H]12 Amb27452356 [0,0,0,2,0,0|0,0,2]=4 17437 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|1,0,1]=4 17438 B9R2.68 C1CC2CCC(C1)N2 Amb19374849 [0,0,0,2,0,0|1,0,1]=4 17439 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [0,0,0,2,0,0|0,0,2]=4 17440 B9R2.68 C1CC2CCC(C2)N1 Amb18641674 [0,0,0,2,0,0|1,0,1]=4 17441 B9R2.68 C1CC2CCC(C2)N1 Amb35789676 [0,0,0,2,0,0|1,0,1]=4 17442 B9R2.68 C1CC2CCN(C1)C2 Amb27872310 [0,0,0,2,0,0|2,0,0]=4 17443 B9R2.68 C1CC2CNC(C1)C2 Amb3941214 [0,0,0,2,0,0|1,0,1]=4 17444 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 Amb22405871 [0,0,0,2,0,0|1,0,1]=4 17445 B9R2.68 C1C[C@@H]2CN[C@H](C1)C2 Amb34915801 [0,0,0,2,0,0|1,0,1]=4 17446 B9R2.68 C1C[C@H]2CC[C@@H](C1)N2 Amb33523610 [0,0,0,2,0,0|1,0,1]=4 17447 B9R2.68 C1C[C@H]2CON(C1)C2 Amb27435263 [0,0,0,2,0,0|1,0,1]=4 17448 B9R2.68 C1C[C@H]2C[C@@H](C1)CN2 Amb23385228 [0,0,0,2,0,0|1,0,1]=4 17449 B9R2.110 BrC12CCC(CC1)C2 Amb27591520 [0,0,0,2,0,0|1,0,1]=4 17450 B9R2.110 CC12CCC(CC1)N2 Amb32685256 [0,0,0,2,0,0|1,0,1]=4 17451 B9R2.110 CC12CCC(CC1)N2 Amb33330395 [0,0,0,2,0,0|1,0,1]=4 17452 B9R2.110 NC12CCC(CC1)C2 Amb27394106 [0,0,0,2,0,0|1,0,1]=4 17453 B9R2.110 NC12CCC(CC1)C2 Amb28934878 [0,0,0,2,0,0|1,0,1]=4 17454 B9R2.110 OC12CCC(CC1)C2 Amb22235809 [0,0,0,2,0,0|0,0,2]=4 17455 B9R2.139 CC1CCC2(CC2)N1 Amb18203382 [0,0,0,2,0,0|1,0,1]=4 17456 B9R2.139 NC1CCC2(CC2)C1 Amb26368952 [0,0,0,2,0,0|1,0,1]=4 17457 B9R2.139 NN1CCC2(CC2)C1 Amb27656058 [0,0,0,2,0,0|2,0,0]=4 17458 B9R2.139 O=C1CC2(CC2)CN1 Amb25935275 [0,0,0,2,0,0|1,0,0]=3 17459 B9R2.139 O=C1CC2(CC2)CO1 Amb25662215 [0,0,0,2,0,0|1,0,0]=3 17460 B9R2.139 O=C1CCC2(CC2)N1 Amb16186647 [0,0,0,2,0,0|1,0,0]=3 17461 B9R2.139 O=C1COC2(CC2)C1 Amb35693021 [0,0,0,2,0,0|1,0,0]=3 17462 B9R2.139 O=C1NC2(CC2)CO1 Amb24572471 [0,0,0,2,0,0|2,0,0]=4 17463 B9R2.8 NC1CC2CC(C1)C2 Amb25992458 [0,0,0,2,0,0|1,0,1]=4 17464 B9R2.8 O=C1CC2CC(C1)C2 Amb25706934 [0,0,0,2,0,0|0,0,0]=2 17465 B9R2.8 O=C1CC2CC(C1)O2 Amb27261957 [0,0,0,2,0,0|1,0,0]=3 17466 B9R2.8 OC1CC2CC(C1)C2 Amb24719737 [0,0,0,2,0,0|0,0,2]=4 17467 B9R2.21 CC1CCC2OC2C1 Amb1141335 [0,0,0,2,0,0|0,0,2]=4 17468 B9R2.21 CN1CC2CC2CN1 Amb27642953 [0,0,0,2,0,0|2,0,0]=4 17469 B9R2.21 ClC1CCC2CC2C1 Amb27233015 [0,0,0,2,0,0|1,0,1]=4 17470 B9R2.21 NC1CCC2CC2C1 Amb26367227 [0,0,0,2,0,0|1,0,1]=4 17471 B9R2.21 NC1CCC2CC2C1 Amb32664396 [0,0,0,2,0,0|1,0,1]=4 17472 B9R2.21 NC1CC[C@H]2C[C@H]2C1 Amb33191737 [0,0,0,2,0,0|1,0,1]=4 17473 B9R2.21 NN1CCC2CC2C1 Amb29882027 [0,0,0,2,0,0|2,0,0]=4 17474 B9R2.21 N[C@@H]1CC[C@@H]2C[C@@H]2C1 Amb28423376 [0,0,0,2,0,0|1,0,1]=4 17475 B9R2.21 O=C1C=CC2CC2C1 Amb28284686 [0,0,0,2,0,0|0,0,2]=4 17476 B9R2.21 O=C1CC2CC2CN1 Amb33716335 [0,0,0,2,0,0|1,0,0]=3 17477 B9R2.21 O=C1CCC2CC2C1 Amb28316224 [0,0,0,2,0,0|0,0,0]=2 17478 B9R2.21 O=C1CCC2CC2N1 Amb27636987 [0,0,0,2,0,0|1,0,0]=3 17479 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,2,0,0|1,0,0]=3 17480 B9R2.21 O=C1NC2CC2CO1 Amb28247932 [0,0,0,2,0,0|2,0,0]=4 17481 B9R2.21 OC1CC[C@@H]2C[C@@H]2C1 Amb27857686 [0,0,0,2,0,0|0,0,2]=4 17482 B9R2.21 O[C@H]1CC[C@H]2C[C@H]2C1 Amb27978320 [0,0,0,2,0,0|0,0,2]=4 17483 B9R2.25 CC1=CC(=O)[C@@H]2C[C@H]12 Amb27797370 [0,0,0,2,0,0|0,0,2]=4 17484 B9R2.25 CC1CC(=O)C2CC12 Amb27598799 [0,0,0,2,0,0|0,0,0]=2 17485 B9R2.25 O=C1CC(=O)[C@@H]2C[C@H]12 Amb28048943 [0,0,0,2,0,0|1,0,1]=4 17486 B9R2.38 CC12CC(=O)CC1C2 Amb24357249 [0,0,0,2,0,0|0,0,0]=2 17487 B9R2.38 CC12CC(Cl)CC1C2 Amb27259187 [0,0,0,2,0,0|1,0,1]=4 17488 B9R2.38 C[C@]12C[C@H]1C[C@@H](Cl)C2 Amb27858702 [0,0,0,2,0,0|1,0,1]=4 17489 B9R2.38 C[C@]12C[C@H]1C[C@@H](O)C2 Amb28053792 [0,0,0,2,0,0|0,0,2]=4 17490 B9R2.96 NC12CCCC(C1)C2 Amb34149789 [0,0,0,2,0,0|1,0,1]=4 17491 B9R2.96 OC12CCCC(C1)C2 Amb34158542 [0,0,0,2,0,0|0,0,2]=4 17492 B9R2.109 CC1=CCCC2OC12 Amb27875404 [0,0,0,2,0,0|2,0,0]=4 17493 B9R2.109 NC1CCCC2CC12 Amb19375082 [0,0,0,2,0,0|1,0,1]=4 17494 B9R2.109 NC1CCCC2CC12 Amb32681181 [0,0,0,2,0,0|1,0,1]=4 17495 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb27250144 [0,0,0,2,0,0|1,0,1]=4 17496 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb32663452 [0,0,0,2,0,0|1,0,1]=4 17497 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb27815166 [0,0,0,2,0,0|1,0,1]=4 17498 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb32652158 [0,0,0,2,0,0|1,0,1]=4 17499 B9R2.109 O=C1C=CCC2CC12 Amb27261956 [0,0,0,2,0,0|0,0,2]=4 17500 B9R2.109 O=C1C=CC[C@H]2C[C@@H]12 Amb27199136 [0,0,0,2,0,0|0,0,2]=4 17501 B9R2.109 O=C1CCCC2CC12 Amb17593139 [0,0,0,2,0,0|0,0,0]=2 17502 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|1,0,0]=3 17503 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [0,0,0,2,0,0|0,0,0]=2 17504 B9R2.109 O=C1CCC[C@@H]2C[C@H]12 Amb25934279 [0,0,0,2,0,0|0,0,0]=2 17505 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [0,0,0,2,0,0|0,0,0]=2 17506 B9R2.109 O=C1CCC[C@H]2C[C@H]12 Amb27640590 [0,0,0,2,0,0|0,0,0]=2 17507 B9R2.109 O=C1CCNC2CC12 Amb27239180 [0,0,0,2,0,0|1,0,0]=3 17508 B9R2.109 O=C1NCC[C@@H]2O[C@H]12 Amb27446837 [0,0,0,2,0,0|2,0,0]=4 17509 B9R2.109 O=C1NNCC2CC12 Amb27797433 [0,0,0,2,0,0|2,0,0]=4 17510 B9R2.109 OC1CCCC2CC12 Amb26963531 [0,0,0,2,0,0|0,0,2]=4 17511 B9R2.109 OC1CCC[C@@H]2C[C@H]12 Amb27659888 [0,0,0,2,0,0|0,0,2]=4 17512 B9R2.109 O[C@@H]1CCC[C@H]2C[C@H]21 Amb27432134 [0,0,0,2,0,0|0,0,2]=4 17513 B9R2.109 O[C@H]1CCC[C@@H]2C[C@H]12 Amb27261725 [0,0,0,2,0,0|0,0,2]=4 17514 B9R2.109 O[C@H]1CCC[C@H]2C[C@@H]12 Amb27805079 [0,0,0,2,0,0|0,0,2]=4 17515 B9R2.109 SC1CCCC2CC12 Amb26316463 [0,0,0,2,0,0|0,1,1]=4 17516 B9R2.109 SC1CCC[C@@H]2C[C@H]12 Amb32788238 [0,0,0,2,0,0|0,1,1]=4 17517 B9R2.7 NC1CC2CCCC12 Amb27834589 [0,0,0,2,0,0|1,0,1]=4 17518 B9R2.7 NC1CC2CCCC12 Amb30585129 [0,0,0,2,0,0|1,0,1]=4 17519 B9R2.7 NC1C[C@H]2CCC[C@@H]12 Amb27438793 [0,0,0,2,0,0|1,0,1]=4 17520 B9R2.7 N[C@@H]1C[C@H]2CCC[C@@H]12 Amb28131512 [0,0,0,2,0,0|1,0,1]=4 17521 B9R2.7 O=C1CC2C=CCC12 Amb8631505 [0,0,0,2,0,0|0,0,2]=4 17522 B9R2.7 O=C1CC2CC=CC12 Amb6608765 [0,0,0,2,0,0|0,0,2]=4 17523 B9R2.7 O=C1CC2CCOC12 Amb27593836 [0,0,0,2,0,0|1,0,0]=3 17524 B9R2.7 O=C1CC2CNCC12 Amb26370314 [0,0,0,2,0,0|1,0,0]=3 17525 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,2,0,0|0,0,2]=4 17526 B9R2.7 O=C1C[C@@H]2CCC[C@H]12 Amb27427660 [0,0,0,2,0,0|0,0,0]=2 17527 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,2,0,0|1,0,0]=3 17528 B9R2.7 O=C1C[C@@H]2COC[C@H]12 Amb26920071 [0,0,0,2,0,0|1,0,0]=3 17529 B9R2.7 O=C1C[C@H]2C=CC[C@H]12 Amb25962489 [0,0,0,2,0,0|0,0,2]=4 17530 B9R2.7 O=C1NC2CCCC12 Amb2694983 [0,0,0,2,0,0|1,0,0]=3 17531 B9R2.7 O=C1NC2OCCC12 Amb24481565 [0,0,0,2,0,0|2,0,0]=4 17532 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [0,0,0,2,0,0|1,0,0]=3 17533 B9R2.7 O=C1N[C@@H]2CCN[C@H]12 Amb27796913 [0,0,0,2,0,0|2,0,0]=4 17534 B9R2.7 O=C1N[C@@H]2OCC[C@H]12 Amb33192983 [0,0,0,2,0,0|2,0,0]=4 17535 B9R2.7 O=C1N[C@H]2CCC[C@@H]12 Amb6366178 [0,0,0,2,0,0|1,0,0]=3 17536 B9R2.7 O=C1N[C@H]2OCC[C@@H]12 Amb27785542 [0,0,0,2,0,0|2,0,0]=4 17537 B9R2.7 O[C@@H]1C[C@H]2CCC[C@@H]12 Amb27184164 [0,0,0,2,0,0|0,0,2]=4 17538 B9R2.7 O[C@H]1C[C@H]2CCC[C@@H]12 Amb27652942 [0,0,0,2,0,0|0,0,2]=4 17539 B9R2.7 SC1CC2CCCC12 Amb32788559 [0,0,0,2,0,0|0,1,1]=4 17540 B9R2.7 SC1C[C@@H]2CCC[C@H]12 Amb32788104 [0,0,0,2,0,0|0,1,1]=4 17541 B9R2.41 NC1CC(C2CC2)C1 Amb24759247 [0,0,0,2,0,0|1,0,1]=4 17542 B9R2.41 NC1CC(C2CC2)C1 Amb32679845 [0,0,0,2,0,0|1,0,1]=4 17543 B9R2.41 O=C1CC(C2CC2)C1 Amb25370879 [0,0,0,2,0,0|0,0,0]=2 17544 B9R2.41 O=C1CC(C2CO2)O1 Amb28250347 [0,0,0,2,0,0|2,0,0]=4 17545 B9R2.138 BrC1CC2(CCC2)C1 Amb24750047 [0,0,0,2,0,0|1,0,1]=4 17546 B9R2.138 NC1CC2(CCC2)C1 Amb22642157 [0,0,0,2,0,0|1,0,1]=4 17547 B9R2.138 NC1CC2(CCC2)C1 Amb24183370 [0,0,0,2,0,0|1,0,1]=4 17548 B9R2.138 NN1CC2(CCC2)C1 Amb28289029 [0,0,0,2,0,0|2,0,0]=4 17549 B9R2.138 O=C1CC2(CCC2)C1 Amb20668529 [0,0,0,2,0,0|0,0,0]=2 17550 B9R2.138 O=C1CC2(CCC2)N1 Amb19149093 [0,0,0,2,0,0|1,0,0]=3 17551 B9R2.138 O=C1CC2(CNC2)C1 Amb25747338 [0,0,0,2,0,0|1,0,0]=3 17552 B9R2.138 O=C1CC2(CNC2)C1 Amb30869313 [0,0,0,2,0,0|1,0,0]=3 17553 B9R2.138 O=C1CC2(CNC2)C1 Amb34139369 [0,0,0,2,0,0|1,0,0]=3 17554 B9R2.138 O=C1CC2(COC2)C1 Amb22406126 [0,0,0,2,0,0|1,0,0]=3 17555 B9R2.138 O=C1CC2(CSC2)C1 Amb22406070 [0,0,0,2,0,0|1,0,0]=3 17556 B9R2.138 OC1CC2(CCC2)C1 Amb25113635 [0,0,0,2,0,0|0,0,2]=4 17557 B9R2.1 BrC1CC12CCCC2 Amb32649170 [0,0,0,2,0,0|1,0,1]=4 17558 B9R2.1 NC1CC12CCCC2 Amb17605510 [0,0,0,2,0,0|1,0,1]=4 17559 B9R2.1 NC1CC12CCCC2 Amb28934811 [0,0,0,2,0,0|1,0,1]=4 17560 B9R2.2 C1CCC(C2CO2)C1 Amb27655529 [0,0,0,2,0,0|0,0,2]=4 17561 B9R2.2 C1CCC([C@@H]2CO2)C1 Amb33315082 [0,0,0,2,0,0|0,0,2]=4 17562 B9R2.2 C1CCC([C@H]2CO2)C1 Amb33315083 [0,0,0,2,0,0|0,0,2]=4 17563 B9R2.95 CC1(N)C2CCCC21 Amb27869873 [0,0,0,2,0,0|1,0,1]=4 17564 B9R2.95 CC1(O)C2CCCC21 Amb27646105 [0,0,0,2,0,0|0,0,2]=4 17565 B9R2.144 O=C(O)C12CCC1C2 Amb28252733 [0,0,0,2,0,0|1,0,0]=3 17566 B9R2.148 CN(C)C1C2CCC21 Amb27643785 [0,0,0,2,0,0|2,0,0]=4 17567 B9R2.148 O=C(O)C1C2CCC21 Amb24350799 [0,0,0,2,0,0|1,0,0]=3 17568 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [0,0,0,2,0,0|0,0,0]=2 17569 B9R2.150 CC(=O)[C@H]1C[C@@H]2C[C@@H]21 Amb27640618 [0,0,0,2,0,0|0,0,0]=2 17570 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|1,0,0]=3 17571 B9R2.6 CC12CC1CCCN2 Amb27173752 [0,0,0,2,0,0|1,0,1]=4 17572 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|0,0,2]=4 17573 B9R2.6 NC12CCCCC1C2 Amb25137276 [0,0,0,2,0,0|1,0,1]=4 17574 B9R2.6 NC12CCCCC1C2 Amb30585131 [0,0,0,2,0,0|1,0,1]=4 17575 B9R2.6 N[C@]12CCCC[C@H]1C2 Amb27975720 [0,0,0,2,0,0|1,0,1]=4 17576 B9R2.11 CC1CC1C2CC2N Amb32674637 [0,0,0,2,0,0|1,0,1]=4 17577 B9R2.11 CC1CC1C2CC2N Amb32682424 [0,0,0,2,0,0|1,0,1]=4 17578 B9R2.11 CC1CC1[C@@H]2C[C@H]2N Amb33144657 [0,0,0,2,0,0|1,0,1]=4 17579 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682468 [0,0,0,2,0,0|1,0,1]=4 17580 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682469 [0,0,0,2,0,0|1,0,1]=4 17581 B9R2.12 CC1CC1CC2CO2 Amb33144969 [0,0,0,2,0,0|0,0,2]=4 17582 B9R2.12 NC1CC1CC2CC2 Amb33361459 [0,0,0,2,0,0|1,0,1]=4 17583 B9R2.12 N[C@@H]1C[C@H]1CC2CC2 Amb33361500 [0,0,0,2,0,0|1,0,1]=4 17584 B9R2.44 C=C1CC12CC2CO Amb27652980 [0,0,0,2,0,0|2,0,0]=4 17585 B9R2.44 C=C1C[C@@]12C[C@@H]2CBr Amb28429542 [0,0,0,2,0,0|2,0,0]=4 17586 B9R2.44 C=C1C[C@@]12C[C@@H]2CO Amb27208142 [0,0,0,2,0,0|2,0,0]=4 17587 B9R2.52 C1CCC2CC2NC1 Amb18203388 [0,0,0,2,0,0|1,0,1]=4 17588 B9R2.52 C1CCC2NC2CC1 Amb10609123 [0,0,0,2,0,0|1,0,1]=4 17589 B9R2.52 C1CCC2OC2CC1 Amb9708770 [0,0,0,2,0,0|0,0,2]=4 17590 B9R2.108 NC1CC1C2CCC2 Amb24483254 [0,0,0,2,0,0|1,0,1]=4 17591 B9R2.108 NC1CC1C2CCC2 Amb32663894 [0,0,0,2,0,0|1,0,1]=4 17592 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb24581403 [0,0,0,2,0,0|1,0,1]=4 17593 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb32663923 [0,0,0,2,0,0|1,0,1]=4 17594 B9R2.123 Br[C@@H]1[C@H]2CCCC[C@H]21 Amb25279388 [0,0,0,2,0,0|1,0,1]=4 17595 B9R2.123 CC1C2CCCCC12 Amb22365158 [0,0,0,2,0,0|1,0,1]=4 17596 B9R2.123 CN1C2CCCCC21 Amb22167171 [0,0,0,2,0,0|2,0,0]=4 17597 B9R2.123 ClC1C2CCCCC12 Amb25337704 [0,0,0,2,0,0|1,0,1]=4 17598 B9R2.123 NC1C2CCCCC12 Amb20623881 [0,0,0,2,0,0|1,0,1]=4 17599 B9R2.123 NC1C2CCCCC12 Amb33528684 [0,0,0,2,0,0|1,0,1]=4 17600 B9R2.123 NC1[C@H]2CCCC[C@@H]12 Amb28252466 [0,0,0,2,0,0|1,0,1]=4 17601 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb25113495 [0,0,0,2,0,0|1,0,1]=4 17602 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb32651659 [0,0,0,2,0,0|1,0,1]=4 17603 B9R2.123 OC1C2CCCCC12 Amb17593167 [0,0,0,2,0,0|0,0,2]=4 17604 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|0,0,2]=4 17605 B9R2.14 CC12CCCC1CN2 Amb32658553 [0,0,0,2,0,0|1,0,1]=4 17606 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33734026 [0,0,0,2,0,0|1,0,1]=4 17607 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33742275 [0,0,0,2,0,0|1,0,1]=4 17608 B9R2.120 O=S1(=O)CCC2CC21 Amb32676812 [0,0,0,2,0,0|2,0,0]=4 17609 B9R2.120 O=S1(=O)CC[C@@H]2C[C@@H]21 Amb32679242 [0,0,0,2,0,0|2,0,0]=4 17610 B9R2.119 CP1(=O)CC2OC2C1 Amb35788455 [0,0,0,2,0,0|2,0,0]=4 17611 B9R2.119 C[P@@]1(=O)C[C@H]2O[C@H]2C1 Amb35788374 [0,0,0,2,0,0|2,0,0]=4 17612 B9R2.119 O=S1(=O)CC2CC2C1 Amb32679441 [0,0,0,2,0,0|2,0,0]=4 17613 B9R2.119 O=S1(=O)C[C@H]2C[C@H]2C1 Amb32680426 [0,0,0,2,0,0|2,0,0]=4 17614 B9R2.147 O=C(O)C1C2CC1C2 Amb27634394 [0,0,0,2,0,0|1,0,0]=3 17615 B9R2.157 C1CC(CC2CO2)C1 Amb26390615 [0,0,0,2,0,0|0,0,2]=4 17616 B9R2.69 C1CC1CCC2CO2 Amb27427391 [0,0,0,2,0,0|0,0,2]=4 17617 B9R2.143 CC(=O)C1CC12CC2 Amb24725286 [0,0,0,2,0,0|0,0,0]=2 17618 B9R2.143 CC(=O)C1OC12CC2 Amb26338327 [0,0,0,2,0,0|1,0,0]=3 17619 B9R2.143 CC(O)C1CC12CC2 Amb28344703 [0,0,0,2,0,0|0,0,2]=4 17620 B9R2.143 C[C@@H](N)C1CC12CC2 Amb29849551 [0,0,0,2,0,0|1,0,1]=4 17621 B9R2.143 C[C@@H](O)C1CC12CC2 Amb32675111 [0,0,0,2,0,0|0,0,2]=4 17622 B9R2.143 C[C@H](N)C1CC12CC2 Amb35589339 [0,0,0,2,0,0|1,0,1]=4 17623 B9R2.143 C[C@H](O)C1CC12CC2 Amb35607819 [0,0,0,2,0,0|0,0,2]=4 17624 B9R2.143 N=C(N)C1CC12CC2 Amb26566671 [0,0,0,2,0,0|2,0,0]=4 17625 B9R2.143 N=C(N)C1CC12CC2 Amb33804152 [0,0,0,2,0,0|2,0,0]=4 17626 B9R2.143 NC(=S)C1CC12CC2 Amb33328378 [0,0,0,2,0,0|1,1,0]=4 17627 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|1,0,0]=3 17628 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|1,0,0]=3 17629 B9R2.174 C1CCC2(CC1)CC2 Amb22231454 [0,0,0,2,0,0|1,0,1]=4 17630 B9R2.174 C1CCC2(CC1)CN2 Amb24117848 [0,0,0,2,0,0|1,0,1]=4 17631 B9R2.174 C1CCC2(CC1)CO2 Amb6892810 [0,0,0,2,0,0|0,0,2]=4 17632 B9R2.174 C1CCC2(CC1)CS2 Amb28061897 [0,0,0,2,0,0|0,1,1]=4