0 B6R0.2 C=C(Br)CC(N)=O Amb25174913 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [0,0,0,0,0,0|1,0,1]=2 2 B6R0.2 C=C(Cl)CC(N)=O Amb24376175 [0,0,0,0,0,0|2,0,1]=3 3 B6R0.2 CC(=C)CC(=O)C Amb17593075 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.2 CC(=C)CC(Cl)Cl Amb24429119 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.2 CC(=C)CN(C)C Amb25747292 [0,0,0,0,0,0|4,0,0]=4 6 B6R0.2 CC(=C)NC(C)=C Amb25173591 [0,0,0,0,0,0|4,0,0]=4 7 B6R0.2 CC(=CC(=O)N)C Amb10561758 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.2 CC(=CC(=O)O)C Amb1485519 [0,0,0,0,0,0|1,0,1]=2 9 B6R0.2 CC(=N)C=C(C)N Amb25339858 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.2 CC(=N)CC(N)=O Amb25259783 [0,0,0,0,0,0|2,0,0]=2 11 B6R0.2 CC(=N)NC(C)=N Amb25746818 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.2 CC(=N)NC(N)=N Amb25265116 [0,0,0,0,0,0|4,0,0]=4 13 B6R0.2 CC(=O)C=S(C)C Amb25370005 [0,0,0,0,0,0|3,0,1]=4 14 B6R0.2 CC(=O)CC(=C)Br Amb25662372 [0,0,0,0,0,0|2,0,0]=2 15 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [0,0,0,0,0,0|1,0,0]=1 16 B6R0.2 CC(=O)CC(C)=N Amb22345922 [0,0,0,0,0,0|2,0,0]=2 17 B6R0.2 CC(=O)CC(C)=O Amb22727963 [0,0,0,0,0,0|1,0,0]=1 18 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,0,0|1,0,2]=3 19 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [0,0,0,0,0,0|1,0,2]=3 20 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [0,0,0,0,0,0|2,0,1]=3 21 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,0,0,0,0,0|2,0,1]=3 22 B6R0.2 CC(=O)CC(N)=S Amb24102403 [0,0,0,0,0,0|1,1,0]=2 23 B6R0.2 CC(=O)CC(O)=O Amb22348460 [0,0,0,0,0,0|0,0,0]=0 24 B6R0.2 CC(=O)CC(O)=S Amb24689856 [0,0,0,0,0,0|0,1,0]=1 25 B6R0.2 CC(=O)CC(O)O Amb25273111 [0,0,0,0,0,0|0,0,2]=2 26 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [0,0,0,0,0,0|0,0,1]=1 27 B6R0.2 CC(=O)CP(Cl)Cl Amb25319017 [0,0,0,0,0,0|3,0,0]=3 28 B6R0.2 CC(=O)CS(C)=O Amb25025354 [0,0,0,0,0,0|2,0,0]=2 29 B6R0.2 CC(=O)C[N+]([O-])=O Amb18833135 [0,0,0,0,0,0|1,0,1]=2 30 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [0,0,0,0,0,0|3,0,0]=3 31 B6R0.2 CC(=O)NC(=S)N Amb10068733 [0,0,0,0,0,0|2,1,0]=3 32 B6R0.2 CC(=O)NC(N)=N Amb22754056 [0,0,0,0,0,0|3,0,0]=3 33 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,0,0|4,0,0]=4 34 B6R0.2 CC(=O)OC(N)=N Amb25242014 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.2 CC(=O)O[Al](O)O Amb22336483 [0,0,0,0,0,0|2,0,1]=3 36 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22045487 [0,0,0,0,0,0|1,0,2]=3 37 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22053694 [0,0,0,0,0,0|1,0,2]=3 38 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22054021 [0,0,0,0,0,0|1,0,2]=3 39 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730050 [0,0,0,0,0,0|1,0,2]=3 40 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730391 [0,0,0,0,0,0|1,0,2]=3 41 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22733055 [0,0,0,0,0,0|1,0,2]=3 42 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734591 [0,0,0,0,0,0|1,0,2]=3 43 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734615 [0,0,0,0,0,0|1,0,2]=3 44 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734932 [0,0,0,0,0,0|1,0,2]=3 45 B6R0.2 CC(=S)C=C(C)O Amb24518407 [0,0,0,0,0,0|1,1,1]=3 46 B6R0.2 CC(=S)CC(N)=O Amb24479846 [0,0,0,0,0,0|1,1,0]=2 47 B6R0.2 CC(=S)\C=C(\C)/N Amb24332649 [0,0,0,0,0,0|2,1,1]=4 48 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [0,0,0,0,0,0|1,0,1]=2 49 B6R0.2 CC(Br)CC(C)=C Amb24365286 [0,0,0,0,0,0|3,0,1]=4 50 B6R0.2 CC(Br)CC(C)O Amb25139315 [0,0,0,0,0,0|2,0,2]=4 51 B6R0.2 CC(Br)CC(N)=N Amb25700372 [0,0,0,0,0,0|3,0,1]=4 52 B6R0.2 CC(Br)CC(N)=O Amb24635749 [0,0,0,0,0,0|2,0,1]=3 53 B6R0.2 CC(Br)OC(C)=O Amb19958925 [0,0,0,0,0,0|3,0,1]=4 54 B6R0.2 CC(C)=C=C(C)C Amb17670588 [0,0,0,0,0,0|3,0,1]=4 55 B6R0.2 CC(C)=CC(N)=N Amb24677991 [0,0,0,0,0,0|3,0,1]=4 56 B6R0.2 CC(C)=CC(N)=S Amb18108367 [0,0,0,0,0,0|2,1,1]=4 57 B6R0.2 CC(C)=C[N+]([O-])=O Amb22167019 [0,0,0,0,0,0|2,0,2]=4 58 B6R0.2 CC(C)=NC(N)=O Amb24682478 [0,0,0,0,0,0|3,0,0]=3 59 B6R0.2 CC(C)CC(=C)Br Amb22583739 [0,0,0,0,0,0|3,0,1]=4 60 B6R0.2 CC(C)CC([O-])=O Amb22732147 [0,0,0,0,0,0|1,0,2]=3 61 B6R0.2 CC(C)CC([O-])=O Amb22732282 [0,0,0,0,0,0|1,0,2]=3 62 B6R0.2 CC(C)CC([O-])=O Amb22734041 [0,0,0,0,0,0|1,0,2]=3 63 B6R0.2 CC(C)CC([O-])=O Amb22734425 [0,0,0,0,0,0|1,0,2]=3 64 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,0,0|3,0,1]=4 65 B6R0.2 CC(C)CS([O-])=O Amb19930010 [0,0,0,0,0,0|2,0,2]=4 66 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [0,0,0,0,0,0|1,0,1]=2 67 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [0,0,0,0,0,0|1,0,2]=3 68 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [0,0,0,0,0,0|2,0,2]=4 69 B6R0.2 CC(C)NC(=O)F Amb24567697 [0,0,0,0,0,0|3,0,1]=4 70 B6R0.2 CC(C)OC(=C)O Amb24086570 [0,0,0,0,0,0|3,0,1]=4 71 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,0,0|3,0,1]=4 72 B6R0.2 CC(C)SC(N)=O Amb24461669 [0,0,0,0,0,0|3,0,1]=4 73 B6R0.2 CC(CC(=C)C)O Amb17593083 [0,0,0,0,0,0|2,0,1]=3 74 B6R0.2 CC(CC(=N)N)C Amb10066934 [0,0,0,0,0,0|3,0,1]=4 75 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [0,0,0,0,0,0|2,0,1]=3 76 B6R0.2 CC(CC(=O)C)N Amb2583230 [0,0,0,0,0,0|2,0,1]=3 77 B6R0.2 CC(CC(=O)C)O Amb17593091 [0,0,0,0,0,0|1,0,1]=2 78 B6R0.2 CC(CC(Cl)C)O Amb17593253 [0,0,0,0,0,0|2,0,2]=4 79 B6R0.2 CC(CC(O)C)O Amb10068523 [0,0,0,0,0,0|1,0,3]=4 80 B6R0.2 CC(Cl)=CC(N)=O Amb24567853 [0,0,0,0,0,0|2,0,1]=3 81 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [0,0,0,0,0,0|3,0,1]=4 82 B6R0.2 CC(Cl)CP(O)O Amb25061243 [0,0,0,0,0,0|2,0,2]=4 83 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [0,0,0,0,0,0|3,0,1]=4 84 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [0,0,0,0,0,0|3,0,1]=4 85 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [0,0,0,0,0,0|3,0,1]=4 86 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [0,0,0,0,0,0|3,0,1]=4 87 B6R0.2 CC(F)=CC(O)=O Amb24676595 [0,0,0,0,0,0|1,0,1]=2 88 B6R0.2 CC(F)CC(O)=O Amb24561809 [0,0,0,0,0,0|1,0,1]=2 89 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [0,0,0,0,0,0|2,0,2]=4 90 B6R0.2 CC(I)=CC(O)=O Amb24668934 [0,0,0,0,0,0|1,0,1]=2 91 B6R0.2 CC(I)CC(C)O Amb25743469 [0,0,0,0,0,0|2,0,2]=4 92 B6R0.2 CC(I)CC(N)=O Amb25783800 [0,0,0,0,0,0|2,0,1]=3 93 B6R0.2 CC(N)=CC(N)=S Amb24097463 [0,0,0,0,0,0|2,1,1]=4 94 B6R0.2 CC(N)=CC(O)=O Amb25856437 [0,0,0,0,0,0|1,0,1]=2 95 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [0,0,0,0,0,0|2,0,1]=3 96 B6R0.2 CC(N)CC(C)=C Amb25064223 [0,0,0,0,0,0|3,0,1]=4 97 B6R0.2 CC(N)CC(C)=O Amb22587050 [0,0,0,0,0,0|2,0,1]=3 98 B6R0.2 CC(N)CC(N)=N Amb25051498 [0,0,0,0,0,0|3,0,1]=4 99 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,0,0|2,0,1]=3 100 B6R0.2 CC(N)CC(N)=S Amb25198821 [0,0,0,0,0,0|2,1,1]=4 101 B6R0.2 CC(N)CC(O)=O Amb19888354 [0,0,0,0,0,0|1,0,1]=2 102 B6R0.2 CC(NC(=O)N)C Amb1104587 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.2 CC(O)=CC(O)O Amb24431523 [0,0,0,0,0,0|0,0,4]=4 104 B6R0.2 CC(O)C=C(C)C Amb22229846 [0,0,0,0,0,0|2,0,2]=4 105 B6R0.2 CC(O)CC(=C)Br Amb24618620 [0,0,0,0,0,0|2,0,2]=4 106 B6R0.2 CC(O)CC(C)N Amb18640217 [0,0,0,0,0,0|2,0,2]=4 107 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,0,0,0,0,0|1,1,2]=4 108 B6R0.2 CC(O)CC(O)=O Amb22348403 [0,0,0,0,0,0|0,0,2]=2 109 B6R0.2 CC(O)CC(O)O Amb25716084 [0,0,0,0,0,0|0,0,4]=4 110 B6R0.2 CC(O)CC(S)=S Amb25215114 [0,0,0,0,0,0|0,2,2]=4 111 B6R0.2 CC(O)CP(O)=O Amb24406357 [0,0,0,0,0,0|1,0,2]=3 112 B6R0.2 CC(O)NC(N)=O Amb25811550 [0,0,0,0,0,0|2,0,2]=4 113 B6R0.2 CC(O)OC(N)=O Amb24669632 [0,0,0,0,0,0|2,0,2]=4 114 B6R0.2 CC(O)SC(C)=O Amb24544015 [0,0,0,0,0,0|2,0,1]=3 115 B6R0.2 CC(O)\C=C(\C)/S Amb25800756 [0,0,0,0,0,0|1,1,2]=4 116 B6R0.2 CC(P)CC(C)O Amb25792365 [0,0,0,0,0,0|2,0,2]=4 117 B6R0.2 CC(S)=CC(C)=O Amb24611600 [0,0,0,0,0,0|1,1,1]=3 118 B6R0.2 CC(S)CC(C)=O Amb24600676 [0,0,0,0,0,0|1,1,1]=3 119 B6R0.2 CC(S)CC(C)O Amb24122653 [0,0,0,0,0,0|1,1,2]=4 120 B6R0.2 CC(S)CC(N)=O Amb24479823 [0,0,0,0,0,0|1,1,1]=3 121 B6R0.2 CC(S)CC(O)=O Amb18281031 [0,0,0,0,0,0|0,1,1]=2 122 B6R0.2 CN(Br)CC(O)=O Amb25745878 [0,0,0,0,0,0|2,0,0]=2 123 B6R0.2 CN(C)CB(O)O Amb25131560 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.2 CN(C)CC(=C)Br Amb24699168 [0,0,0,0,0,0|4,0,0]=4 125 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,0,0|3,0,0]=3 126 B6R0.2 CN(C)CC(N)=S Amb19373088 [0,0,0,0,0,0|3,1,0]=4 127 B6R0.2 CN(C)CC(O)O Amb25226405 [0,0,0,0,0,0|2,0,2]=4 128 B6R0.2 CN(C)CC(O)S Amb24610156 [0,0,0,0,0,0|2,1,1]=4 129 B6R0.2 CN(C)CC([O-])=O Amb22002291 [0,0,0,0,0,0|2,0,1]=3 130 B6R0.2 CN(C)CS(O)=O Amb25376029 [0,0,0,0,0,0|3,0,0]=3 131 B6R0.2 CN(C)C[SiH](O)O Amb25811267 [0,0,0,0,0,0|2,1,1]=4 132 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,0,0|4,0,0]=4 133 B6R0.2 CN(CC(=N)N)C Amb10610521 [0,0,0,0,0,0|4,0,0]=4 134 B6R0.2 CN(CC(=N)N)C Amb10610536 [0,0,0,0,0,0|4,0,0]=4 135 B6R0.2 CN(CC(=O)N)C Amb17231806 [0,0,0,0,0,0|3,0,0]=3 136 B6R0.2 CN(CC(=S)N)C Amb16232219 [0,0,0,0,0,0|3,1,0]=4 137 B6R0.2 CN(C[C@@H](O)C)C Amb10844893 [0,0,0,0,0,0|3,0,1]=4 138 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [0,0,0,0,0,0|2,0,0]=2 139 B6R0.2 CN(N)CC(O)=O Amb23592296 [0,0,0,0,0,0|2,0,0]=2 140 B6R0.2 CN(N)NC(N)=O Amb25327360 [0,0,0,0,0,0|4,0,0]=4 141 B6R0.2 CN(O)CC(O)=O Amb24732008 [0,0,0,0,0,0|1,0,1]=2 142 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,0,0|2,0,0]=2 143 B6R0.2 CS(=O)CC(O)=O Amb18957960 [0,0,0,0,0,0|1,0,0]=1 144 B6R0.2 CS(C)=CC(O)=O Amb25717234 [0,0,0,0,0,0|2,0,1]=3 145 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [0,0,0,0,0,0|0,0,3]=3 146 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [0,0,0,0,0,0|2,0,0]=2 147 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [0,0,0,0,0,0|1,0,1]=2 148 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [0,0,0,0,0,0|2,0,1]=3 149 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [0,0,0,0,0,0|2,0,1]=3 150 B6R0.2 C[C@@H](O)C=C(C)C Amb25700154 [0,0,0,0,0,0|2,0,2]=4 151 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [0,0,0,0,0,0|2,0,2]=4 152 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [0,0,0,0,0,0|1,0,3]=4 153 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [0,0,0,0,0,0|1,0,2]=3 154 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [0,0,0,0,0,0|3,0,1]=4 155 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [0,0,0,0,0,0|2,0,2]=4 156 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [0,0,0,0,0,0|2,0,2]=4 157 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [0,0,0,0,0,0|0,1,1]=2 158 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [0,0,0,0,0,0|1,0,1]=2 159 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [0,0,0,0,0,0|1,0,1]=2 160 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [0,0,0,0,0,0|2,0,1]=3 161 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [0,0,0,0,0,0|1,0,1]=2 162 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [0,0,0,0,0,0|1,0,1]=2 163 B6R0.2 C[C@H](O)C=C(C)C Amb24734239 [0,0,0,0,0,0|2,0,2]=4 164 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [0,0,0,0,0,0|1,0,1]=2 165 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [0,0,0,0,0,0|2,0,2]=4 166 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [0,0,0,0,0,0|1,0,3]=4 167 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [0,0,0,0,0,0|0,0,2]=2 168 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [0,0,0,0,0,0|2,0,2]=4 169 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,0,0,0,0,0|1,0,3]=4 170 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [0,0,0,0,0,0|0,1,1]=2 171 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,0,0|3,0,0]=3 172 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [0,0,0,0,0,0|2,0,0]=2 173 B6R0.2 C\C(=C/C(=O)C)\N Amb1149988 [0,0,0,0,0,0|2,0,1]=3 174 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [0,0,0,0,0,0|1,0,1]=2 175 B6R0.2 C\C(\Cl)=C/C(C)=O Amb25795658 [0,0,0,0,0,0|2,0,1]=3 176 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [0,0,0,0,0,0|1,0,1]=2 177 B6R0.2 C\C(\Cl)=C\C(N)=O Amb24714532 [0,0,0,0,0,0|2,0,1]=3 178 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [0,0,0,0,0,0|1,0,1]=2 179 B6R0.2 C\C(\F)=C/C(C)=O Amb24614698 [0,0,0,0,0,0|2,0,1]=3 180 B6R0.2 C\C(\F)=C\C(C)=O Amb25717786 [0,0,0,0,0,0|2,0,1]=3 181 B6R0.2 C\C(\I)=C/C(N)=O Amb25378941 [0,0,0,0,0,0|2,0,1]=3 182 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [0,0,0,0,0,0|1,0,1]=2 183 B6R0.2 C\C(\N)=C\C(N)=O Amb22002462 [0,0,0,0,0,0|2,0,1]=3 184 B6R0.2 C\C(\N)=C\C(N)=S Amb19929130 [0,0,0,0,0,0|2,1,1]=4 185 B6R0.2 C\C(\N)=C\[N+]([O-])=O Amb21953595 [0,0,0,0,0,0|2,0,2]=4 186 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [0,0,0,0,0,0|1,0,1]=2 187 B6R0.2 C\C(\[O-])=C/C(C)=O Amb19894693 [0,0,0,0,0,0|1,0,2]=3 188 B6R0.2 C\C(\[O-])=C\C(C)=O Amb19959976 [0,0,0,0,0,0|1,0,2]=3 189 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239360 [0,0,0,0,0,0|1,0,2]=3 190 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239373 [0,0,0,0,0,0|1,0,2]=3 191 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239374 [0,0,0,0,0,0|1,0,2]=3 192 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239443 [0,0,0,0,0,0|1,0,2]=3 193 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20246565 [0,0,0,0,0,0|1,0,2]=3 194 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045337 [0,0,0,0,0,0|1,0,2]=3 195 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045339 [0,0,0,0,0,0|1,0,2]=3 196 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045350 [0,0,0,0,0,0|1,0,2]=3 197 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045370 [0,0,0,0,0,0|1,0,2]=3 198 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045376 [0,0,0,0,0,0|1,0,2]=3 199 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045378 [0,0,0,0,0,0|1,0,2]=3 200 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045379 [0,0,0,0,0,0|1,0,2]=3 201 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045386 [0,0,0,0,0,0|1,0,2]=3 202 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045388 [0,0,0,0,0,0|1,0,2]=3 203 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045392 [0,0,0,0,0,0|1,0,2]=3 204 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045393 [0,0,0,0,0,0|1,0,2]=3 205 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045408 [0,0,0,0,0,0|1,0,2]=3 206 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045419 [0,0,0,0,0,0|1,0,2]=3 207 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045578 [0,0,0,0,0,0|1,0,2]=3 208 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045602 [0,0,0,0,0,0|1,0,2]=3 209 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045712 [0,0,0,0,0,0|1,0,2]=3 210 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045835 [0,0,0,0,0,0|1,0,2]=3 211 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045854 [0,0,0,0,0,0|1,0,2]=3 212 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045869 [0,0,0,0,0,0|1,0,2]=3 213 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22052617 [0,0,0,0,0,0|1,0,2]=3 214 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053071 [0,0,0,0,0,0|1,0,2]=3 215 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053499 [0,0,0,0,0,0|1,0,2]=3 216 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053500 [0,0,0,0,0,0|1,0,2]=3 217 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053502 [0,0,0,0,0,0|1,0,2]=3 218 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053503 [0,0,0,0,0,0|1,0,2]=3 219 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053559 [0,0,0,0,0,0|1,0,2]=3 220 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053596 [0,0,0,0,0,0|1,0,2]=3 221 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053692 [0,0,0,0,0,0|1,0,2]=3 222 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053697 [0,0,0,0,0,0|1,0,2]=3 223 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053737 [0,0,0,0,0,0|1,0,2]=3 224 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053933 [0,0,0,0,0,0|1,0,2]=3 225 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053935 [0,0,0,0,0,0|1,0,2]=3 226 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053939 [0,0,0,0,0,0|1,0,2]=3 227 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053940 [0,0,0,0,0,0|1,0,2]=3 228 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053954 [0,0,0,0,0,0|1,0,2]=3 229 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054002 [0,0,0,0,0,0|1,0,2]=3 230 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054020 [0,0,0,0,0,0|1,0,2]=3 231 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054022 [0,0,0,0,0,0|1,0,2]=3 232 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054119 [0,0,0,0,0,0|1,0,2]=3 233 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22466635 [0,0,0,0,0,0|1,0,2]=3 234 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22728947 [0,0,0,0,0,0|1,0,2]=3 235 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729908 [0,0,0,0,0,0|1,0,2]=3 236 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729969 [0,0,0,0,0,0|1,0,2]=3 237 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729970 [0,0,0,0,0,0|1,0,2]=3 238 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730028 [0,0,0,0,0,0|1,0,2]=3 239 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730125 [0,0,0,0,0,0|1,0,2]=3 240 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22731170 [0,0,0,0,0,0|1,0,2]=3 241 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733289 [0,0,0,0,0,0|1,0,2]=3 242 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733723 [0,0,0,0,0,0|1,0,2]=3 243 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22735083 [0,0,0,0,0,0|1,0,2]=3 244 B6R0.2 C\C(\[O-])=C\[N+]([O-])=O Amb22549288 [0,0,0,0,0,0|1,0,3]=4 245 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [0,0,0,0,0,0|2,0,0]=2 246 B6R0.2 NC(=N)CC(=O)N Amb1981332 [0,0,0,0,0,0|3,0,0]=3 247 B6R0.2 NC(=N)NC(=O)C Amb2236591 [0,0,0,0,0,0|3,0,0]=3 248 B6R0.2 NC(=N)NC(=O)N Amb17610487 [0,0,0,0,0,0|4,0,0]=4 249 B6R0.2 NC(=N)NC(N)=O Amb22351794 [0,0,0,0,0,0|4,0,0]=4 250 B6R0.2 NC(=N)NC(N)=O Amb22730112 [0,0,0,0,0,0|4,0,0]=4 251 B6R0.2 NC(=NC(=O)N)N Amb17614858 [0,0,0,0,0,0|4,0,0]=4 252 B6R0.2 NC(=O)C=C(Cl)Cl Amb25728096 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.2 NC(=O)CC(=N)[NH3+] Amb2439350 [0,0,0,0,0,0|3,0,0]=3 254 B6R0.2 NC(=O)CC(=O)N Amb1971463 [0,0,0,0,0,0|2,0,0]=2 255 B6R0.2 NC(=O)CC(=S)N Amb1155422 [0,0,0,0,0,0|2,1,0]=3 256 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [0,0,0,0,0,0|3,0,1]=4 257 B6R0.2 NC(=O)CC(O)O Amb25810087 [0,0,0,0,0,0|1,0,2]=3 258 B6R0.2 NC(=O)CC([O-])=O Amb22263088 [0,0,0,0,0,0|1,0,1]=2 259 B6R0.2 NC(=O)NC(N)=N Amb22167718 [0,0,0,0,0,0|4,0,0]=4 260 B6R0.2 NC(=O)N[N+]([O-])=O Amb17672280 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.2 NC(=O)[CH-]C(N)=O Amb24591184 [0,0,0,0,0,0|2,0,1]=3 262 B6R0.2 NC(=S)CC(=S)N Amb1981072 [0,0,0,0,0,0|2,2,0]=4 263 B6R0.2 NC(F)CC(O)=O Amb24479804 [0,0,0,0,0,0|2,0,1]=3 264 B6R0.2 N[13C](=O)N[13C](N)=O Amb22367408 [0,0,0,0,0,0|3,0,0]=3 265 B6R0.2 N[13C](=O)[13CH2][13C](=O)N Amb17616663 [0,0,0,0,0,0|2,0,0]=2 266 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [0,0,0,0,0,0|1,0,2]=3 267 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [0,0,0,0,0,0|2,0,1]=3 268 B6R0.2 O=C(Cl)C=C(Br)Br Amb25026151 [0,0,0,0,0,0|3,0,1]=4 269 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [0,0,0,0,0,0|3,0,1]=4 270 B6R0.2 OB(C=C(C)C)O Amb2455988 [0,0,0,0,0,0|2,0,2]=4 271 B6R0.2 OB(CC(C)C)O Amb2447316 [0,0,0,0,0,0|2,0,2]=4 272 B6R0.2 OB(O)CC(O)=O Amb24053058 [0,0,0,0,0,0|2,0,1]=3 273 B6R0.2 OC(=O)C=C(Br)Br Amb24435008 [0,0,0,0,0,0|2,0,1]=3 274 B6R0.2 OC(=O)C=C(F)F Amb24116995 [0,0,0,0,0,0|2,0,1]=3 275 B6R0.2 OC(=O)CC(=S)N Amb17465742 [0,0,0,0,0,0|1,1,0]=2 276 B6R0.2 OC(=O)CC(F)Br Amb25336987 [0,0,0,0,0,0|2,0,1]=3 277 B6R0.2 OC(=O)CC(F)F Amb22001551 [0,0,0,0,0,0|2,0,1]=3 278 B6R0.2 OC(=O)CC(O)=O Amb21935659 [0,0,0,0,0,0|1,0,0]=1 279 B6R0.2 OC(=O)CC(O)=O Amb22230690 [0,0,0,0,0,0|1,0,0]=1 280 B6R0.2 OC(=O)CC(O)=O Amb22230927 [0,0,0,0,0,0|1,0,0]=1 281 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [0,0,0,0,0,0|3,0,0]=3 282 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [0,0,0,0,0,0|1,0,0]=1 283 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [0,0,0,0,0,0|1,0,0]=1 284 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [0,0,0,0,0,0|1,0,0]=1 285 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [0,0,0,0,0,0|2,0,0]=2 286 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [0,0,0,0,0,0|2,0,0]=2 287 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [0,0,0,0,0,0|0,0,3]=3 288 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [0,0,0,0,0,0|2,0,0]=2 289 B6R0.2 [15NH2]C(=O)[15NH]C([15NH2])=O Amb22367466 [0,0,0,0,0,0|3,0,0]=3 290 B6R0.2 [15NH2]C(=[15N]C(=O)C)[15NH2] Amb17614859 [0,0,0,0,0,0|3,0,0]=3 291 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [0,0,0,0,0,0|2,0,0]=2 292 B6R0.2 [O-]C(=O)CC(=O)[O-] Amb10070428 [0,0,0,0,0,0|1,0,1]=2 293 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [0,0,0,0,0,0|2,0,2]=4 294 B6R0.2 [O-]C(=O)CC([O-])=O Amb22730396 [0,0,0,0,0,0|1,0,1]=2 295 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [0,0,0,0,0,0|0,0,3]=3 296 B6R0.2 [O-][N+](=O)CC(=O)N Amb10069145 [0,0,0,0,0,0|2,0,1]=3 297 B6R0.2 [O-][N+](=O)CC(=O)N Amb1101925 [0,0,0,0,0,0|2,0,1]=3 298 B5R0.1 BC(=O)NCC Amb22343194 [1,0,0,0,0,0|2,0,1]=4 299 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,0,0,0,0|1,0,1]=3 300 B5R0.1 C=C(F)CCO Amb25747437 [1,0,0,0,0,0|1,0,2]=4 301 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,0,0,0,0|0,0,3]=4 302 B5R0.1 C=CCB(O)O Amb20240823 [1,0,0,0,0,0|1,0,2]=4 303 B5R0.1 C=CCC(O)O Amb25144470 [1,0,0,0,0,0|0,0,3]=4 304 B5R0.1 C=CCS([O-])=O Amb25810896 [1,0,0,0,0,0|1,0,2]=4 305 B5R0.1 C=CC[N+]([O-])=O Amb24625461 [1,0,0,0,0,0|1,0,2]=4 306 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,0,0,0,0|2,0,1]=4 307 B5R0.1 CC#CC(=O)C Amb17593016 [1,0,0,0,0,0|1,0,2]=4 308 B5R0.1 CC#CC(=O)N Amb10552409 [1,0,0,0,0,0|1,0,2]=4 309 B5R0.1 CC(=C)CC#N Amb17712309 [1,0,0,0,0,0|2,0,1]=4 310 B5R0.1 CC(=C)CC=C Amb22347764 [1,0,0,0,0,0|2,0,0]=3 311 B5R0.1 CC(=C)CCBr Amb21857866 [1,0,0,0,0,0|2,0,1]=4 312 B5R0.1 CC(=C)CCN Amb17673481 [1,0,0,0,0,0|2,0,1]=4 313 B5R0.1 CC(=C)CON Amb18560218 [1,0,0,0,0,0|3,0,0]=4 314 B5R0.1 CC(=C)C[Mg]Cl Amb22338380 [1,0,0,0,0,0|3,0,0]=4 315 B5R0.1 CC(=C)C[Zn]Cl Amb22897694 [1,0,0,0,0,0|3,0,0]=4 316 B5R0.1 CC(=C)NC=O Amb25065862 [1,0,0,0,0,0|2,0,0]=3 317 B5R0.1 CC(=C)\C=C/C Amb22733448 [1,0,0,0,0,0|2,0,1]=4 318 B5R0.1 CC(=C)\C=C/Cl Amb25123259 [1,0,0,0,0,0|2,0,1]=4 319 B5R0.1 CC(=C)\C=C\Br Amb25242010 [1,0,0,0,0,0|2,0,1]=4 320 B5R0.1 CC(=C)\C=C\Cl Amb24526409 [1,0,0,0,0,0|2,0,1]=4 321 B5R0.1 CC(=C)\C=C\I Amb25299248 [1,0,0,0,0,0|2,0,1]=4 322 B5R0.1 CC(=N)CC#N Amb17593017 [1,0,0,0,0,0|2,0,1]=4 323 B5R0.1 CC(=N)NCO Amb24751321 [1,0,0,0,0,0|2,0,1]=4 324 B5R0.1 CC(=O)C#CBr Amb24334279 [1,0,0,0,0,0|1,0,2]=4 325 B5R0.1 CC(=O)C=C=C Amb23447108 [1,0,0,0,0,0|1,0,2]=4 326 B5R0.1 CC(=O)C=C=N Amb25663158 [1,0,0,0,0,0|1,0,2]=4 327 B5R0.1 CC(=O)CC#C Amb17673302 [1,0,0,0,0,0|1,0,1]=3 328 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|1,0,1]=3 329 B5R0.1 CC(=O)CC#N Amb22274239 [1,0,0,0,0,0|1,0,1]=3 330 B5R0.1 CC(=O)CC=O Amb17666764 [1,0,0,0,0,0|0,0,0]=1 331 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|1,0,1]=3 332 B5R0.1 CC(=O)CCN Amb10067110 [1,0,0,0,0,0|1,0,1]=3 333 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|1,0,1]=3 334 B5R0.1 CC(=O)CN=O Amb24645582 [1,0,0,0,0,0|1,0,0]=2 335 B5R0.1 CC(=O)CON Amb25128844 [1,0,0,0,0,0|2,0,0]=3 336 B5R0.1 CC(=O)CSCl Amb24631131 [1,0,0,0,0,0|2,0,0]=3 337 B5R0.1 CC(=O)NC#N Amb17772293 [1,0,0,0,0,0|2,0,1]=4 338 B5R0.1 CC(=O)NC#P Amb24356543 [1,0,0,0,0,0|2,0,1]=4 339 B5R0.1 CC(=O)NC=C Amb24323579 [1,0,0,0,0,0|2,0,0]=3 340 B5R0.1 CC(=O)NC=S Amb24390998 [1,0,0,0,0,0|1,1,0]=3 341 B5R0.1 CC(=O)NCCl Amb25790034 [1,0,0,0,0,0|2,0,1]=4 342 B5R0.1 CC(=O)NCS Amb25124326 [1,0,0,0,0,0|1,1,1]=4 343 B5R0.1 CC(=O)OC=C Amb21618930 [1,0,0,0,0,0|2,0,0]=3 344 B5R0.1 CC(=O)OC=C Amb22338143 [1,0,0,0,0,0|2,0,0]=3 345 B5R0.1 CC(=O)OC=C Amb22338476 [1,0,0,0,0,0|2,0,0]=3 346 B5R0.1 CC(=O)OC=C Amb22366845 [1,0,0,0,0,0|2,0,0]=3 347 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,0,0,0,0|1,0,0]=2 348 B5R0.1 CC(=O)OCCl Amb17673336 [1,0,0,0,0,0|2,0,1]=4 349 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|2,0,1]=4 350 B5R0.1 CC(=O)OCN Amb24359000 [1,0,0,0,0,0|2,0,1]=4 351 B5R0.1 CC(=O)ONN Amb17615002 [1,0,0,0,0,0|3,0,0]=4 352 B5R0.1 CC(=O)O[13CH]=[13CH2] Amb22351356 [1,0,0,0,0,0|2,0,0]=3 353 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|2,0,1]=4 354 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,0,0,0,0|1,0,1]=3 355 B5R0.1 CC(=O)\C=C\Br Amb25803449 [1,0,0,0,0,0|1,0,1]=3 356 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,0,0,0,0|1,0,1]=3 357 B5R0.1 CC(=O)\C=C\I Amb25269482 [1,0,0,0,0,0|1,0,1]=3 358 B5R0.1 CC(=S)N=C=O Amb25286075 [1,0,0,0,0,0|1,1,1]=4 359 B5R0.1 CC(=S)NC=C Amb24689648 [1,0,0,0,0,0|2,1,0]=4 360 B5R0.1 CC(=S)NCO Amb25739054 [1,0,0,0,0,0|1,1,1]=4 361 B5R0.1 CC(Br)=CCO Amb25719036 [1,0,0,0,0,0|1,0,2]=4 362 B5R0.1 CC(Br)CC=O Amb25074611 [1,0,0,0,0,0|1,0,1]=3 363 B5R0.1 CC(C)=C=C=O Amb24699230 [1,0,0,0,0,0|1,0,2]=4 364 B5R0.1 CC(C)=C=CBr Amb17673288 [1,0,0,0,0,0|2,0,1]=4 365 B5R0.1 CC(C)=CC=C Amb22229813 [1,0,0,0,0,0|2,0,1]=4 366 B5R0.1 CC(C)C[13CH]=O Amb22353955 [1,0,0,0,0,0|1,0,1]=3 367 B5R0.1 CC(Cl)=CCO Amb24061938 [1,0,0,0,0,0|1,0,2]=4 368 B5R0.1 CC(Cl)CC=O Amb18640602 [1,0,0,0,0,0|1,0,1]=3 369 B5R0.1 CC(Cl)OC=O Amb25811235 [1,0,0,0,0,0|2,0,1]=4 370 B5R0.1 CC(Cl)\C=C\O Amb22734803 [1,0,0,0,0,0|1,0,2]=4 371 B5R0.1 CC(F)CCO Amb21951900 [1,0,0,0,0,0|1,0,2]=4 372 B5R0.1 CC(I)=CCO Amb24652791 [1,0,0,0,0,0|1,0,2]=4 373 B5R0.1 CC(N)CC=C Amb17673480 [1,0,0,0,0,0|2,0,1]=4 374 B5R0.1 CC(N)CC=C Amb19515336 [1,0,0,0,0,0|2,0,1]=4 375 B5R0.1 CC(N)CC=O Amb25292247 [1,0,0,0,0,0|1,0,1]=3 376 B5R0.1 CC(O)CCO Amb22227721 [1,0,0,0,0,0|0,0,3]=4 377 B5R0.1 CC(O)CCO Amb22232248 [1,0,0,0,0,0|0,0,3]=4 378 B5R0.1 CC(O)CN=O Amb25746175 [1,0,0,0,0,0|1,0,2]=4 379 B5R0.1 CC(O)CNO Amb24333693 [1,0,0,0,0,0|1,0,2]=4 380 B5R0.1 CC(S)CC=O Amb18122380 [1,0,0,0,0,0|0,1,1]=3 381 B5R0.1 CC(S)CCO Amb19148316 [1,0,0,0,0,0|0,1,2]=4 382 B5R0.1 CC(S)NC=O Amb25835741 [1,0,0,0,0,0|1,1,1]=4 383 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,0,0,0,0|1,0,1]=3 384 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|1,0,2]=4 385 B5R0.1 CCCC(=C)Br Amb22583743 [1,0,0,0,0,0|2,0,1]=4 386 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|2,0,1]=4 387 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,1]=3 388 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|1,1,1]=4 389 B5R0.1 CCCC(N)O Amb25147414 [1,0,0,0,0,0|1,0,2]=4 390 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,1]=3 391 B5R0.1 CCCC(O)Br Amb25106743 [1,0,0,0,0,0|1,0,2]=4 392 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|1,0,2]=4 393 B5R0.1 CCCC([O-])=O Amb17772223 [1,0,0,0,0,0|0,0,2]=3 394 B5R0.1 CCCC([O-])=O Amb22732283 [1,0,0,0,0,0|0,0,2]=3 395 B5R0.1 CCCC([O-])=O Amb22732651 [1,0,0,0,0,0|0,0,2]=3 396 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|2,0,1]=4 397 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|2,0,1]=4 398 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|2,0,1]=4 399 B5R0.1 CCCS(O)=O Amb24615072 [1,0,0,0,0,0|1,0,1]=3 400 B5R0.1 CCCS([O-])=O Amb19929119 [1,0,0,0,0,0|1,0,2]=4 401 B5R0.1 CCC[13C](O)=O Amb22337992 [1,0,0,0,0,0|0,0,1]=2 402 B5R0.1 CCC[13C](O)=O Amb22338339 [1,0,0,0,0,0|0,0,1]=2 403 B5R0.1 CCNC(=O)Br Amb24563760 [1,0,0,0,0,0|2,0,1]=4 404 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,1]=4 405 B5R0.1 CCNC(O)=S Amb24612743 [1,0,0,0,0,0|1,1,1]=4 406 B5R0.1 CCOC([13CH3])=O Amb22363103 [1,0,0,0,0,0|2,0,1]=4 407 B5R0.1 CCOP(O)=O Amb22360741 [1,0,0,0,0,0|2,0,1]=4 408 B5R0.1 CCO[13C](C)=O Amb22363160 [1,0,0,0,0,0|2,0,1]=4 409 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [1,0,0,0,0,0|2,0,1]=4 410 B5R0.1 CCO[14C](N)=O Amb22732757 [1,0,0,0,0,0|2,0,1]=4 411 B5R0.1 CCSC(N)=O Amb24394612 [1,0,0,0,0,0|2,0,1]=4 412 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [1,0,0,0,0,0|0,0,1]=2 413 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [1,0,0,0,0,0|0,0,2]=3 414 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [1,0,0,0,0,0|0,0,1]=2 415 B5R0.1 CN(C)CC=O Amb22002191 [1,0,0,0,0,0|2,0,0]=3 416 B5R0.1 CN(C)CC=O Amb22491245 [1,0,0,0,0,0|2,0,0]=3 417 B5R0.1 CN(C)CC=O Amb22491584 [1,0,0,0,0,0|2,0,0]=3 418 B5R0.1 CN(C)CC=O Amb22756473 [1,0,0,0,0,0|2,0,0]=3 419 B5R0.1 CN(C)CC=O Amb23440511 [1,0,0,0,0,0|2,0,0]=3 420 B5R0.1 CN(O)CCO Amb25234570 [1,0,0,0,0,0|1,0,2]=4 421 B5R0.1 CN=CC(C)=O Amb25746654 [1,0,0,0,0,0|2,0,1]=4 422 B5R0.1 CNCC(=C)Br Amb18950247 [1,0,0,0,0,0|3,0,0]=4 423 B5R0.1 CNCC(=C)Cl Amb18281327 [1,0,0,0,0,0|3,0,0]=4 424 B5R0.1 CNCC(=O)C Amb17621974 [1,0,0,0,0,0|2,0,0]=3 425 B5R0.1 CNCC(=O)N Amb10610205 [1,0,0,0,0,0|2,0,0]=3 426 B5R0.1 CNCC(=S)N Amb17231807 [1,0,0,0,0,0|2,1,0]=4 427 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,0]=3 428 B5R0.1 CNCC([O-])=O Amb20246714 [1,0,0,0,0,0|1,0,1]=3 429 B5R0.1 CNCP(O)=O Amb24478116 [1,0,0,0,0,0|2,0,0]=3 430 B5R0.1 CNOC(C)=O Amb24323679 [1,0,0,0,0,0|3,0,0]=4 431 B5R0.1 CNOC(C)=O Amb24629247 [1,0,0,0,0,0|3,0,0]=4 432 B5R0.1 COCC(=C)Br Amb25361496 [1,0,0,0,0,0|3,0,0]=4 433 B5R0.1 COCC(=O)Br Amb25282928 [1,0,0,0,0,0|2,0,0]=3 434 B5R0.1 COCC(=O)N Amb1153776 [1,0,0,0,0,0|2,0,0]=3 435 B5R0.1 COCC(C)=S Amb25108516 [1,0,0,0,0,0|2,1,0]=4 436 B5R0.1 CONC(=O)N Amb2417193 [1,0,0,0,0,0|3,0,0]=4 437 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 438 B5R0.1 CS(=O)CC=O Amb25173706 [1,0,0,0,0,0|1,0,0]=2 439 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|2,0,1]=4 440 B5R0.1 CS(=O)CCN Amb19889121 [1,0,0,0,0,0|2,0,1]=4 441 B5R0.1 CS(=O)CCN Amb20248083 [1,0,0,0,0,0|2,0,1]=4 442 B5R0.1 CS(=O)N=C=O Amb24737135 [1,0,0,0,0,0|2,0,1]=4 443 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,0]=3 444 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,0]=2 445 B5R0.1 CSCC(=S)N Amb17503394 [1,0,0,0,0,0|2,1,0]=4 446 B5R0.1 CSCC(C)=C Amb20671946 [1,0,0,0,0,0|3,0,0]=4 447 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,0]=3 448 B5R0.1 CSCC(C)O Amb20622311 [1,0,0,0,0,0|2,0,1]=4 449 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,0]=3 450 B5R0.1 CSCS(C)=O Amb22045140 [1,0,0,0,0,0|3,0,0]=4 451 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,0,0,0,0,0|2,0,1]=4 452 B5R0.1 CSC[C@H](C)O Amb24699036 [1,0,0,0,0,0|2,0,1]=4 453 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 454 B5R0.1 CSNC(N)=O Amb25810134 [1,0,0,0,0,0|3,0,0]=4 455 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [1,0,0,0,0,0|0,0,2]=3 456 B5R0.1 C[C@@H](Cl)CC=C Amb25123337 [1,0,0,0,0,0|2,0,1]=4 457 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [1,0,0,0,0,0|1,0,2]=4 458 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,0,0,0,0,0|1,0,2]=4 459 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,0,0,0,0,0|1,0,2]=4 460 B5R0.1 C[C@@H](O)CC=C Amb22225370 [1,0,0,0,0,0|1,0,2]=4 461 B5R0.1 C[C@@H](O)CC=O Amb24356009 [1,0,0,0,0,0|0,0,2]=3 462 B5R0.1 C[C@H](Cl)CC=C Amb24626620 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.1 C[C@H](N)CCO Amb19515998 [1,0,0,0,0,0|1,0,2]=4 464 B5R0.1 C[C@H](N)CCO Amb24055217 [1,0,0,0,0,0|1,0,2]=4 465 B5R0.1 C[C@H](O)CC=C Amb22226758 [1,0,0,0,0,0|1,0,2]=4 466 B5R0.1 C[NH+](C)CCO Amb22493791 [1,0,0,0,0,0|2,0,1]=4 467 B5R0.1 C[S+](C)CCO Amb24420852 [1,0,0,0,0,0|2,0,1]=4 468 B5R0.1 C[SiH](C)CC=C Amb19930034 [1,0,0,0,0,0|2,1,0]=4 469 B5R0.1 C[SiH](C)CCO Amb25184701 [1,0,0,0,0,0|1,1,1]=4 470 B5R0.1 C\C(=C/CO)\I Amb17616110 [1,0,0,0,0,0|1,0,2]=4 471 B5R0.1 C\C(\Br)=C\C=O Amb18124620 [1,0,0,0,0,0|1,0,1]=3 472 B5R0.1 C\C(\Cl)=C/C=O Amb18640408 [1,0,0,0,0,0|1,0,1]=3 473 B5R0.1 C\C(\Cl)=C\CO Amb25663061 [1,0,0,0,0,0|1,0,2]=4 474 B5R0.1 C\C(\I)=C/C=O Amb25095164 [1,0,0,0,0,0|1,0,1]=3 475 B5R0.1 C\C(\I)=C\C=O Amb24424054 [1,0,0,0,0,0|1,0,1]=3 476 B5R0.1 C\C(\N)=N\C=C Amb24448988 [1,0,0,0,0,0|3,0,0]=4 477 B5R0.1 C\C=C/B(O)O Amb24547752 [1,0,0,0,0,0|1,0,2]=4 478 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,1]=3 479 B5R0.1 C\C=C\C(C)=C Amb22733185 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.1 C\C=C\C(N)=N Amb25024644 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 C\C=C\C([O-])=O Amb22231404 [1,0,0,0,0,0|0,0,2]=3 482 B5R0.1 C\C=C\[C@H](C)O Amb25145549 [1,0,0,0,0,0|1,0,2]=4 483 B5R0.1 C\C=N\C(N)=S Amb25744557 [1,0,0,0,0,0|2,1,0]=4 484 B5R0.1 ClC(=O)CC#N Amb17593096 [1,0,0,0,0,0|2,0,1]=4 485 B5R0.1 N#CCC(O)=O Amb20247050 [1,0,0,0,0,0|1,0,1]=3 486 B5R0.1 N#CCS(O)=O Amb25232047 [1,0,0,0,0,0|2,0,1]=4 487 B5R0.1 N#C[13CH2][13C]([O-])=O Amb22054790 [1,0,0,0,0,0|1,0,2]=4 488 B5R0.1 NC(=N)CC=C Amb10066887 [1,0,0,0,0,0|2,0,1]=4 489 B5R0.1 NC(=O)C=NO Amb25147466 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,0,0,0,0|1,0,1]=3 491 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|1,0,0]=2 492 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,1]=4 493 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,1]=4 494 B5R0.1 NC(=O)CNO Amb25199017 [1,0,0,0,0,0|2,0,0]=3 495 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|2,0,1]=4 496 B5R0.1 NC(=O)OC=C Amb17621270 [1,0,0,0,0,0|2,0,1]=4 497 B5R0.1 NC(=O)OCO Amb25662384 [1,0,0,0,0,0|2,0,1]=4 498 B5R0.1 NC(=O)\C=C/Br Amb25715916 [1,0,0,0,0,0|2,0,1]=4 499 B5R0.1 NC(=O)\C=C\Cl Amb10552376 [1,0,0,0,0,0|2,0,1]=4 500 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,1]=4 501 B5R0.1 NCCC(=O)N Amb1137251 [1,0,0,0,0,0|2,0,1]=4 502 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,1]=3 503 B5R0.1 NCCP(O)=O Amb22168066 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 505 B5R0.1 NOCC(N)=O Amb22059481 [1,0,0,0,0,0|3,0,0]=4 506 B5R0.1 N\C=C/C(N)=O Amb22489591 [1,0,0,0,0,0|2,0,1]=4 507 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,0,0,0,0|2,0,1]=4 508 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,1]=4 509 B5R0.1 O=C(Br)CCCl Amb24474527 [1,0,0,0,0,0|2,0,1]=4 510 B5R0.1 O=C(Cl)\C=C/Br Amb24391538 [1,0,0,0,0,0|2,0,1]=4 511 B5R0.1 O=C(Cl)\C=C\Br Amb24512115 [1,0,0,0,0,0|2,0,1]=4 512 B5R0.1 O=C(Cl)\C=C\Cl Amb25025493 [1,0,0,0,0,0|2,0,1]=4 513 B5R0.1 O=C(I)CCCl Amb25146462 [1,0,0,0,0,0|2,0,1]=4 514 B5R0.1 O=C=CC(=O)C Amb10603952 [1,0,0,0,0,0|0,0,2]=3 515 B5R0.1 O=C=NC(=O)C Amb17231800 [1,0,0,0,0,0|1,0,1]=3 516 B5R0.1 O=C=NC(=O)Cl Amb22348016 [1,0,0,0,0,0|2,0,1]=4 517 B5R0.1 O=CC=C(Br)Br Amb25146355 [1,0,0,0,0,0|2,0,1]=4 518 B5R0.1 O=CC=C(Cl)Cl Amb24691205 [1,0,0,0,0,0|2,0,1]=4 519 B5R0.1 O=CCC(Br)Br Amb25026607 [1,0,0,0,0,0|2,0,1]=4 520 B5R0.1 O=CNC([S-])=S Amb24710140 [1,0,0,0,0,0|1,2,0]=4 521 B5R0.1 O=CNN(C)C Amb1930732 [1,0,0,0,0,0|3,0,0]=4 522 B5R0.1 OB(\C=C\C)O Amb2447259 [1,0,0,0,0,0|1,0,2]=4 523 B5R0.1 OC(=O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 524 B5R0.1 OC(=O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 525 B5R0.1 OC(=O)C#CI Amb25274128 [1,0,0,0,0,0|1,0,2]=4 526 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,0,0,0,0|0,0,2]=3 527 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,0,0,0,0|0,0,0]=1 528 B5R0.1 OC(=O)CCF Amb10603694 [1,0,0,0,0,0|1,0,1]=3 529 B5R0.1 OC(=O)CI=O Amb25146428 [1,0,0,0,0,0|1,0,0]=2 530 B5R0.1 OC(=O)CNBr Amb25053433 [1,0,0,0,0,0|2,0,0]=3 531 B5R0.1 OC(=O)CNCl Amb24653229 [1,0,0,0,0,0|2,0,0]=3 532 B5R0.1 OC(=O)CNI Amb25216175 [1,0,0,0,0,0|2,0,0]=3 533 B5R0.1 OC(=O)CSCl Amb24597301 [1,0,0,0,0,0|2,0,0]=3 534 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [1,0,0,0,0,0|2,0,0]=3 535 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,1]=3 536 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,0,0,0,0|1,0,1]=3 537 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,0,0,0,0|1,0,1]=3 538 B5R0.1 OC(O)CC=S Amb24478084 [1,0,0,0,0,0|0,1,2]=4 539 B5R0.1 OCCS(=O)=O Amb24474283 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,0,0,0,0|1,0,2]=4 541 B5R0.1 ONCC(O)=O Amb24120360 [1,0,0,0,0,0|1,0,1]=3 542 B5R0.1 OP(=O)CC=O Amb25706451 [1,0,0,0,0,0|1,0,0]=2 543 B5R0.1 OP(=O)CCBr Amb24634095 [1,0,0,0,0,0|2,0,1]=4 544 B5R0.1 OP(=O)CCCl Amb24465178 [1,0,0,0,0,0|2,0,1]=4 545 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,0,0,0,0|1,0,2]=4 546 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,0,0,0,0|1,0,2]=4 547 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [1,0,0,0,0,0|0,0,2]=3 548 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [1,0,0,0,0,0|0,0,2]=3 549 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [1,0,0,0,0,0|0,0,2]=3 550 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [1,0,0,0,0,0|1,0,1]=3 551 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [1,0,0,0,0,0|1,0,1]=3 552 B5R0.1 [2H]C(=O)OCC Amb22336312 [1,0,0,0,0,0|2,0,1]=4 553 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,0,0,0,0|2,0,1]=4 554 B5R0.1 [O-]C(=O)CCBr Amb22229633 [1,0,0,0,0,0|1,0,2]=4 555 B5R0.1 [O-]C(=O)CCCl Amb10604124 [1,0,0,0,0,0|1,0,2]=4 556 B5R0.1 [O-]C(=O)CCCl Amb22051669 [1,0,0,0,0,0|1,0,2]=4 557 B5R0.1 [O-]C(=O)CCO Amb22055495 [1,0,0,0,0,0|1,0,1]=3 558 B5R0.1 [O-]\C=C\C(=O)C Amb15772268 [1,0,0,0,0,0|0,0,2]=3 559 B5R0.1 [O-]\C=C\C(=O)C Amb2228039 [1,0,0,0,0,0|0,0,2]=3 560 B7R0.2 BrCC(=O)C=C(C)C Amb17594501 [0,1,0,0,0,0|2,0,1]=4 561 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [0,1,0,0,0,0|1,0,2]=4 562 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [0,1,0,0,0,0|0,0,3]=4 563 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [0,1,0,0,0,0|1,0,1]=3 564 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [0,1,0,0,0,0|1,0,1]=3 565 B7R0.2 C=C(Cl)CC(=O)C=C Amb24690688 [0,1,0,0,0,0|2,0,1]=4 566 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,1,0,0,0,0|1,0,2]=4 567 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,1,0,0,0,0|1,0,2]=4 568 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,1,0,0,0,0|1,0,2]=4 569 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,1,0,0,0,0|1,0,2]=4 570 B7R0.2 C=CC(O)CC(N)=O Amb25799663 [0,1,0,0,0,0|2,0,1]=4 571 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,1,0,0,0,0|0,0,3]=4 572 B7R0.2 C=CN(Br)CC(O)=O Amb24629979 [0,1,0,0,0,0|2,0,1]=4 573 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,1,0,0,0,0|0,0,3]=4 574 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,1,0,0,0,0|0,0,3]=4 575 B7R0.2 CC(=C)CC(=O)CN Amb24621765 [0,1,0,0,0,0|2,0,0]=3 576 B7R0.2 CC(=C)CC(=O)NC Amb24741594 [0,1,0,0,0,0|2,0,0]=3 577 B7R0.2 CC(=C)CC(N)CO Amb24665584 [0,1,0,0,0,0|2,0,1]=4 578 B7R0.2 CC(=C)CC(O)C#N Amb25837205 [0,1,0,0,0,0|2,0,1]=4 579 B7R0.2 CC(=C)CC(O)C=C Amb24062963 [0,1,0,0,0,0|2,0,1]=4 580 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [0,1,0,0,0,0|2,0,1]=4 581 B7R0.2 CC(=C)C[C@H](O)C#N Amb25257193 [0,1,0,0,0,0|2,0,1]=4 582 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,1,0,0,0,0|1,0,2]=4 583 B7R0.2 CC(=C)C\C(\Cl)=C/Cl Amb24467796 [0,1,0,0,0,0|3,0,0]=4 584 B7R0.2 CC(=C)NC(=O)C=C Amb25838805 [0,1,0,0,0,0|3,0,0]=4 585 B7R0.2 CC(=C)NC(=O)OC Amb24418498 [0,1,0,0,0,0|2,0,0]=3 586 B7R0.2 CC(=C)OC(=O)CCl Amb24599988 [0,1,0,0,0,0|3,0,0]=4 587 B7R0.2 CC(=CC(C)=O)NC Amb25850096 [0,1,0,0,0,0|2,0,1]=4 588 B7R0.2 CC(=CC(C)=O)OC Amb24583696 [0,1,0,0,0,0|1,0,1]=3 589 B7R0.2 CC(=CC(N)=O)C#N Amb25174853 [0,1,0,0,0,0|2,0,1]=4 590 B7R0.2 CC(=CC(N)=O)OC Amb25128053 [0,1,0,0,0,0|1,0,2]=4 591 B7R0.2 CC(=CC(O)=O)C#C Amb25687994 [0,1,0,0,0,0|1,0,1]=3 592 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [0,1,0,0,0,0|0,0,1]=2 593 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,1,0,0,0,0|0,0,2]=3 594 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [0,1,0,0,0,0|2,0,0]=3 595 B7R0.2 CC(=N)NC(=O)OC Amb25189033 [0,1,0,0,0,0|2,0,0]=3 596 B7R0.2 CC(=N)\C=C(\O)/CO Amb25307564 [0,1,0,0,0,0|1,0,2]=4 597 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [0,1,0,0,0,0|2,0,1]=4 598 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [0,1,0,0,0,0|2,0,1]=4 599 B7R0.2 CC(=O)C=C(N)OC Amb25174865 [0,1,0,0,0,0|1,0,1]=3 600 B7R0.2 CC(=O)CC(=C)C#C Amb25261143 [0,1,0,0,0,0|2,0,0]=3 601 B7R0.2 CC(=O)CC(=C)C#N Amb18641235 [0,1,0,0,0,0|2,0,0]=3 602 B7R0.2 CC(=O)CC(=C)CCl Amb25092223 [0,1,0,0,0,0|2,0,0]=3 603 B7R0.2 CC(=O)CC(=N)CF Amb25087799 [0,1,0,0,0,0|2,0,0]=3 604 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [0,1,0,0,0,0|2,0,0]=3 605 B7R0.2 CC(=O)CC(=O)C#N Amb25328629 [0,1,0,0,0,0|1,0,0]=2 606 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [0,1,0,0,0,0|1,0,0]=2 607 B7R0.2 CC(=O)CC(=O)NN Amb24677298 [0,1,0,0,0,0|1,0,0]=2 608 B7R0.2 CC(=O)CC(=O)NO Amb24096625 [0,1,0,0,0,0|0,0,0]=1 609 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,1,0,0,0,0|0,1,0]=2 610 B7R0.2 CC(=O)CC(=S)C=O Amb25142738 [0,1,0,0,0,0|0,1,0]=2 611 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [0,1,0,0,0,0|1,1,0]=3 612 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [0,1,0,0,0,0|1,1,0]=3 613 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,1,0,0,0,0|0,1,0]=2 614 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [0,1,0,0,0,0|2,0,1]=4 615 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [0,1,0,0,0,0|1,0,1]=3 616 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [0,1,0,0,0,0|1,0,1]=3 617 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [0,1,0,0,0,0|0,0,1]=2 618 B7R0.2 CC(=O)CC(O)CO Amb25304727 [0,1,0,0,0,0|0,0,2]=3 619 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [0,1,0,0,0,0|0,1,1]=3 620 B7R0.2 CC(=O)CN(C)C=O Amb25134136 [0,1,0,0,0,0|2,0,0]=3 621 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [0,1,0,0,0,0|0,0,2]=3 622 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [0,1,0,0,0,0|1,0,1]=3 623 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [0,1,0,0,0,0|1,0,1]=3 624 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [0,1,0,0,0,0|2,0,0]=3 625 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [0,1,0,0,0,0|2,0,0]=3 626 B7R0.2 CC(=O)C\C(\Cl)=C\Cl Amb24736103 [0,1,0,0,0,0|2,0,0]=3 627 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [0,1,0,0,0,0|3,0,0]=4 628 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [0,1,0,0,0,0|2,0,0]=3 629 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [0,1,0,0,0,0|2,0,0]=3 630 B7R0.2 CC(=O)NC(=O)CS Amb24483055 [0,1,0,0,0,0|1,1,0]=3 631 B7R0.2 CC(=O)NC(=O)NCl Amb25743042 [0,1,0,0,0,0|2,0,0]=3 632 B7R0.2 CC(=O)NC(=O)NN Amb25695996 [0,1,0,0,0,0|2,0,0]=3 633 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [0,1,0,0,0,0|1,0,0]=2 634 B7R0.2 CC(=O)NC(=O)SC Amb24481559 [0,1,0,0,0,0|1,1,0]=3 635 B7R0.2 CC(=O)NC(=O)SN Amb25662667 [0,1,0,0,0,0|1,1,0]=3 636 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [0,1,0,0,0,0|2,1,0]=4 637 B7R0.2 CC(=O)NC(=S)NC Amb24746594 [0,1,0,0,0,0|2,1,0]=4 638 B7R0.2 CC(=O)OC(=C)C#N Amb22227833 [0,1,0,0,0,0|3,0,0]=4 639 B7R0.2 CC(=O)OC(=C)C=C Amb25694419 [0,1,0,0,0,0|3,0,0]=4 640 B7R0.2 CC(=O)OC(=C)C=O Amb25695435 [0,1,0,0,0,0|2,0,0]=3 641 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [0,1,0,0,0,0|3,0,0]=4 642 B7R0.2 CC(=O)OC(=C)CCl Amb25378300 [0,1,0,0,0,0|3,0,0]=4 643 B7R0.2 CC(=O)OC(=O)C=C Amb25770477 [0,1,0,0,0,0|2,0,0]=3 644 B7R0.2 CC(=O)OC(=O)CBr Amb24524284 [0,1,0,0,0,0|2,0,0]=3 645 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [0,1,0,0,0,0|2,0,0]=3 646 B7R0.2 CC(=O)SC(=N)NC Amb24694348 [0,1,0,0,0,0|3,0,0]=4 647 B7R0.2 CC(=O)SC(Cl)=CCl Amb25725021 [0,1,0,0,0,0|3,0,0]=4 648 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [0,1,0,0,0,0|2,0,1]=4 649 B7R0.2 CC(=O)\C=C(/Cl)\C=C Amb25236926 [0,1,0,0,0,0|2,0,1]=4 650 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [0,1,0,0,0,0|2,0,1]=4 651 B7R0.2 CC(=O)\C=C(/O)\C=C Amb24339287 [0,1,0,0,0,0|1,0,1]=3 652 B7R0.2 CC(=O)\C=C(/O)\CF Amb25134101 [0,1,0,0,0,0|1,0,1]=3 653 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [0,1,0,0,0,0|1,0,2]=4 654 B7R0.2 CC(=O)\C=C(\Br)/C=C Amb24505183 [0,1,0,0,0,0|2,0,1]=4 655 B7R0.2 CC(=O)\C=C(\Br)/CCl Amb24433130 [0,1,0,0,0,0|2,0,1]=4 656 B7R0.2 CC(=O)\C=C(\C)/C=O Amb18641689 [0,1,0,0,0,0|1,0,1]=3 657 B7R0.2 CC(=O)\C=C(\O)/C=C Amb24553056 [0,1,0,0,0,0|1,0,1]=3 658 B7R0.2 CC(=O)\N=C(/N)\NC Amb24120628 [0,1,0,0,0,0|3,0,0]=4 659 B7R0.2 CC(Br)CC(=O)CCl Amb24621526 [0,1,0,0,0,0|2,0,1]=4 660 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,1,0,0,0,0|1,0,1]=3 661 B7R0.2 CC(C)=CC(=O)C=C Amb21962941 [0,1,0,0,0,0|2,0,1]=4 662 B7R0.2 CC(C)=CC(=O)C=O Amb24418075 [0,1,0,0,0,0|1,0,2]=4 663 B7R0.2 CC(C)=CC(=O)CC Amb25715052 [0,1,0,0,0,0|2,0,1]=4 664 B7R0.2 CC(C)=CC(=O)CN Amb25727127 [0,1,0,0,0,0|2,0,1]=4 665 B7R0.2 CC(C)=CC(=O)NN Amb25688561 [0,1,0,0,0,0|2,0,1]=4 666 B7R0.2 CC(C)=CC(C)=NO Amb25801047 [0,1,0,0,0,0|2,0,1]=4 667 B7R0.2 CC(C)CC(=C)C=O Amb24481535 [0,1,0,0,0,0|2,0,1]=4 668 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [0,1,0,0,0,0|1,0,2]=4 669 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [0,1,0,0,0,0|2,0,1]=4 670 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [0,1,0,0,0,0|2,0,1]=4 671 B7R0.2 CC(C)CC(=O)CF Amb23454719 [0,1,0,0,0,0|2,0,1]=4 672 B7R0.2 CC(C)CC(=O)CN Amb18641847 [0,1,0,0,0,0|2,0,1]=4 673 B7R0.2 CC(C)CC(=O)CO Amb18559774 [0,1,0,0,0,0|1,0,1]=3 674 B7R0.2 CC(C)C[C@@H](O)C=O Amb25104909 [0,1,0,0,0,0|1,0,2]=4 675 B7R0.2 CC(C)C\C(\C)=N\O Amb22729223 [0,1,0,0,0,0|2,0,1]=4 676 B7R0.2 CC(C=O)NC(C)=O Amb18641830 [0,1,0,0,0,0|2,0,1]=4 677 B7R0.2 CC(C=O)OC(C)=O Amb18641863 [0,1,0,0,0,0|2,0,1]=4 678 B7R0.2 CC(CBr)=CC(=O)Cl Amb24519437 [0,1,0,0,0,0|2,0,1]=4 679 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [0,1,0,0,0,0|2,0,1]=4 680 B7R0.2 CC(CC(=C)Br)C=O Amb24380828 [0,1,0,0,0,0|2,0,1]=4 681 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [0,1,0,0,0,0|2,0,1]=4 682 B7R0.2 CC(CC(C)=C)C=O Amb18641711 [0,1,0,0,0,0|2,0,1]=4 683 B7R0.2 CC(CC(C)=O)=CCl Amb25685302 [0,1,0,0,0,0|2,0,0]=3 684 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [0,1,0,0,0,0|2,0,0]=3 685 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [0,1,0,0,0,0|2,0,1]=4 686 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [0,1,0,0,0,0|2,0,1]=4 687 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [0,1,0,0,0,0|1,0,1]=3 688 B7R0.2 CC(CC(N)=O)=CCl Amb25663357 [0,1,0,0,0,0|2,0,0]=3 689 B7R0.2 CC(CC(N)=O)CN Amb18641899 [0,1,0,0,0,0|2,0,1]=4 690 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [0,1,0,0,0,0|1,0,0]=2 691 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [0,1,0,0,0,0|1,0,0]=2 692 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,1,0,0,0,0|1,0,1]=3 693 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,1,0,0,0,0|0,0,1]=2 694 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,1,0,0,0,0|0,0,2]=3 695 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,1,0,0,0,0|0,1,1]=3 696 B7R0.2 CC(CC)=CC(N)=O Amb24640827 [0,1,0,0,0,0|2,0,1]=4 697 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,1,0,0,0,0|2,0,1]=4 698 B7R0.2 CC(CN)CC(C)=O Amb18251072 [0,1,0,0,0,0|2,0,1]=4 699 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,1,0,0,0,0|1,0,1]=3 700 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,1,0,0,0,0|1,0,1]=3 701 B7R0.2 CC(CN)CP(O)=O Amb25757942 [0,1,0,0,0,0|2,0,1]=4 702 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,1,0,0,0,0|0,0,2]=3 703 B7R0.2 CC(CO)CC(C)=O Amb24606485 [0,1,0,0,0,0|1,0,1]=3 704 B7R0.2 CC(CO)CC(N)=O Amb24452895 [0,1,0,0,0,0|1,0,2]=4 705 B7R0.2 CC(CO)OC(C)=O Amb25144303 [0,1,0,0,0,0|2,0,1]=4 706 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,1,0,0,0,0|0,1,1]=3 707 B7R0.2 CC(N)=CC(=O)NC Amb19514534 [0,1,0,0,0,0|2,0,1]=4 708 B7R0.2 CC(NC)CC(=O)N Amb17231826 [0,1,0,0,0,0|2,0,1]=4 709 B7R0.2 CC(O)=CC(=O)CCl Amb24667937 [0,1,0,0,0,0|1,0,1]=3 710 B7R0.2 CC(O)=CC(=O)CF Amb25810309 [0,1,0,0,0,0|1,0,1]=3 711 B7R0.2 CC(O)CC(=O)C=O Amb24666713 [0,1,0,0,0,0|0,0,3]=4 712 B7R0.2 CC(O)CC(=O)CO Amb25116562 [0,1,0,0,0,0|0,0,2]=3 713 B7R0.2 CC(O)CC(=O)N[O-] Amb25345095 [0,1,0,0,0,0|0,0,3]=4 714 B7R0.2 CC(O)CC(C)=NO Amb24475817 [0,1,0,0,0,0|1,0,2]=4 715 B7R0.2 CC(O)C\C(\C)=C\Br Amb24415427 [0,1,0,0,0,0|2,0,1]=4 716 B7R0.2 CC(O)OC(=O)CS Amb24698028 [0,1,0,0,0,0|2,0,1]=4 717 B7R0.2 CC([O-])=CC(=O)CC Amb22474100 [0,1,0,0,0,0|1,0,2]=4 718 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,1,0,0,0,0|1,0,0]=2 719 B7R0.2 CCC(=O)CC(C)Br Amb24483088 [0,1,0,0,0,0|2,0,1]=4 720 B7R0.2 CCC(=O)CC(C)C Amb17138363 [0,1,0,0,0,0|2,0,1]=4 721 B7R0.2 CCC(=O)CC(C)Cl Amb25275986 [0,1,0,0,0,0|2,0,1]=4 722 B7R0.2 CCC(=O)CC(C)N Amb24679340 [0,1,0,0,0,0|2,0,1]=4 723 B7R0.2 CCC(=O)CC(C)O Amb25113617 [0,1,0,0,0,0|1,0,1]=3 724 B7R0.2 CCC(=O)CC(C)S Amb24647716 [0,1,0,0,0,0|1,1,1]=4 725 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,1,0,0,0,0|0,0,0]=1 726 B7R0.2 CCC(=O)CN(C)C Amb25781387 [0,1,0,0,0,0|3,0,0]=4 727 B7R0.2 CCC(=O)C[C@H](C)O Amb25746635 [0,1,0,0,0,0|1,0,1]=3 728 B7R0.2 CCC(=O)C[N+]([O-])=O Amb21857551 [0,1,0,0,0,0|1,0,1]=3 729 B7R0.2 CCC(=O)NC(N)=N Amb19148005 [0,1,0,0,0,0|3,0,0]=4 730 B7R0.2 CCC(=O)OC(C)O Amb25234635 [0,1,0,0,0,0|2,0,1]=4 731 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,1,0,0,0,0|1,0,1]=3 732 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,1,0,0,0,0|2,0,1]=4 733 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,1,0,0,0,0|2,0,1]=4 734 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,1,0,0,0,0|1,0,1]=3 735 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,1,0,0,0,0|0,0,2]=3 736 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [0,1,0,0,0,0|2,0,1]=4 737 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,1,0,0,0,0|1,0,1]=3 738 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,1,0,0,0,0|2,0,1]=4 739 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,1,0,0,0,0|2,0,1]=4 740 B7R0.2 CCC(O)CC(C)=C Amb24062975 [0,1,0,0,0,0|2,0,1]=4 741 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,1,0,0,0,0|1,0,1]=3 742 B7R0.2 CCC(O)CC(N)=O Amb24616660 [0,1,0,0,0,0|1,0,2]=4 743 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,1,0,0,0,0|0,0,2]=3 744 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,1,0,0,0,0|0,1,1]=3 745 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,1,0,0,0,0|2,0,0]=3 746 B7R0.2 CCS(=O)CC(=C)Cl Amb25052718 [0,1,0,0,0,0|3,0,0]=4 747 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,1,0,0,0,0|1,0,0]=2 748 B7R0.2 CCS(=O)CC(C)O Amb25687853 [0,1,0,0,0,0|2,0,1]=4 749 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,1,0,0,0,0|1,0,1]=3 750 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,1,0,0,0,0|2,0,1]=4 751 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,1,0,0,0,0|2,0,1]=4 752 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,1,0,0,0,0|1,0,1]=3 753 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [0,1,0,0,0,0|2,0,1]=4 754 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,1,0,0,0,0|1,0,1]=3 755 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,1,0,0,0,0|0,1,1]=3 756 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,1,0,0,0,0|2,0,1]=4 757 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,1,0,0,0,0|1,0,1]=3 758 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,1,0,0,0,0|2,0,0]=3 759 B7R0.2 CC\C(\N)=C/C(N)=O Amb24624408 [0,1,0,0,0,0|2,0,1]=4 760 B7R0.2 CN(C)CC(=N)NO Amb21858419 [0,1,0,0,0,0|3,0,0]=4 761 B7R0.2 CN(C)CC(=O)C=C Amb25733522 [0,1,0,0,0,0|3,0,0]=4 762 B7R0.2 CN(C)CC(=O)C=O Amb25348685 [0,1,0,0,0,0|2,0,1]=4 763 B7R0.2 CN(C)CC(=O)NN Amb19930184 [0,1,0,0,0,0|3,0,0]=4 764 B7R0.2 CN(C)CC(=O)NO Amb25369208 [0,1,0,0,0,0|2,0,0]=3 765 B7R0.2 CN(C)CC(O)C=O Amb25233179 [0,1,0,0,0,0|2,0,1]=4 766 B7R0.2 CN(CC(N)=O)C#N Amb24457322 [0,1,0,0,0,0|3,0,0]=4 767 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [0,1,0,0,0,0|2,0,0]=3 768 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [0,1,0,0,0,0|1,0,0]=2 769 B7R0.2 CNC(=N)NC(N)=O Amb25374784 [0,1,0,0,0,0|3,0,0]=4 770 B7R0.2 CNC(=O)C=S(=O)=O Amb22230907 [0,1,0,0,0,0|1,0,2]=4 771 B7R0.2 CNC(=O)CC(=S)N Amb1980804 [0,1,0,0,0,0|1,1,0]=3 772 B7R0.2 CNC(=O)CC(C)Br Amb25724971 [0,1,0,0,0,0|2,0,1]=4 773 B7R0.2 CNC(=O)CC(C)N Amb18949898 [0,1,0,0,0,0|2,0,1]=4 774 B7R0.2 CNC(=O)CC(C)N Amb21959391 [0,1,0,0,0,0|2,0,1]=4 775 B7R0.2 CNC(=O)CC(C)O Amb24525315 [0,1,0,0,0,0|1,0,1]=3 776 B7R0.2 CNC(=O)CC(N)=N Amb19516898 [0,1,0,0,0,0|2,0,0]=3 777 B7R0.2 CNC(=O)CC(N)=N Amb22587420 [0,1,0,0,0,0|2,0,0]=3 778 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,1,0,0,0,0|1,0,0]=2 779 B7R0.2 CNC(=O)CN(C)C Amb19978831 [0,1,0,0,0,0|3,0,0]=4 780 B7R0.2 CNC(=O)C[C@@H](C)N Amb24428006 [0,1,0,0,0,0|2,0,1]=4 781 B7R0.2 CNC(=O)C[N+]([O-])=O Amb22055805 [0,1,0,0,0,0|1,0,1]=3 782 B7R0.2 CNC(=O)N=C(N)N Amb25808957 [0,1,0,0,0,0|3,0,0]=4 783 B7R0.2 CNC(=O)NC(N)=S Amb24592576 [0,1,0,0,0,0|2,1,0]=4 784 B7R0.2 CNC(=S)CC(=S)N Amb1980798 [0,1,0,0,0,0|1,2,0]=4 785 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,1,0,0,0,0|2,0,1]=4 786 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,1,0,0,0,0|1,0,1]=3 787 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,1,0,0,0,0|1,0,1]=3 788 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,1,0,0,0,0|1,0,1]=3 789 B7R0.2 CN\C(=C/C(=O)C)\C Amb15691784 [0,1,0,0,0,0|2,0,1]=4 790 B7R0.2 COC(=N)CN(C)C Amb23538532 [0,1,0,0,0,0|3,0,0]=4 791 B7R0.2 COC(=O)C=C(F)F Amb10838757 [0,1,0,0,0,0|2,0,1]=4 792 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,1,0,0,0,0|0,0,0]=1 793 B7R0.2 COC(=O)CC(Br)C Amb10603675 [0,1,0,0,0,0|1,0,1]=3 794 B7R0.2 COC(=O)CC(C)S Amb19515267 [0,1,0,0,0,0|0,1,1]=3 795 B7R0.2 COC(=O)CC(Cl)Cl Amb25227821 [0,1,0,0,0,0|2,0,1]=4 796 B7R0.2 COC(=O)CC(N)=N Amb18831173 [0,1,0,0,0,0|2,0,0]=3 797 B7R0.2 COC(=O)CC(N)=N Amb19516886 [0,1,0,0,0,0|2,0,0]=3 798 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,1,0,0,0,0|1,0,0]=2 799 B7R0.2 COC(=O)CC(N)C Amb2371489 [0,1,0,0,0,0|1,0,1]=3 800 B7R0.2 COC(=O)CC(N)F Amb25267953 [0,1,0,0,0,0|2,0,1]=4 801 B7R0.2 COC(=O)CN(=O)=O Amb20621013 [0,1,0,0,0,0|1,0,1]=3 802 B7R0.2 COC(=O)CN(C)C Amb22167138 [0,1,0,0,0,0|2,0,0]=3 803 B7R0.2 COC(=O)CS(C)=O Amb20626166 [0,1,0,0,0,0|1,0,0]=2 804 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [0,1,0,0,0,0|1,0,1]=3 805 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [0,1,0,0,0,0|1,0,1]=3 806 B7R0.2 COC(=O)NC(=O)Cl Amb24483069 [0,1,0,0,0,0|2,0,0]=3 807 B7R0.2 COC(=O)NC(C)C Amb17861698 [0,1,0,0,0,0|2,0,1]=4 808 B7R0.2 COC(=O)NC(C)O Amb25705192 [0,1,0,0,0,0|1,0,2]=4 809 B7R0.2 COC(=O)NC(N)=S Amb25662607 [0,1,0,0,0,0|2,1,0]=4 810 B7R0.2 COC(=O)NN(C)C Amb25173600 [0,1,0,0,0,0|3,0,0]=4 811 B7R0.2 COC(=O)OC(C)C Amb22049510 [0,1,0,0,0,0|2,0,1]=4 812 B7R0.2 COC(=O)\C=C(\N)/C Amb1157857 [0,1,0,0,0,0|1,0,1]=3 813 B7R0.2 CON(C)CC(C)=C Amb25198060 [0,1,0,0,0,0|3,0,0]=4 814 B7R0.2 CON(C)CC(N)=O Amb24447118 [0,1,0,0,0,0|2,0,1]=4 815 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,1,0,0,0,0|0,0,2]=3 816 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [0,1,0,0,0,0|0,0,2]=3 817 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,1,0,0,0,0|2,0,1]=4 818 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [0,1,0,0,0,0|2,0,1]=4 819 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [0,1,0,0,0,0|2,0,1]=4 820 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [0,1,0,0,0,0|2,0,1]=4 821 B7R0.2 CSC(=O)CC(C)C Amb22168305 [0,1,0,0,0,0|1,1,1]=4 822 B7R0.2 CSC(=O)NC(N)=S Amb24739600 [0,1,0,0,0,0|2,1,0]=4 823 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,1,0,0,0,0|1,1,1]=4 824 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,1,0,0,0,0|0,1,1]=3 825 B7R0.2 CSC(N)=NC(N)=O Amb25757974 [0,1,0,0,0,0|3,0,0]=4 826 B7R0.2 CS\C(=N\C(=O)C)\N Amb1091801 [0,1,0,0,0,0|2,1,0]=4 827 B7R0.2 C[C@@H](C=O)OC(C)=O Amb24724866 [0,1,0,0,0,0|2,0,1]=4 828 B7R0.2 C[C@@H](CC(=C)Br)C=O Amb25325003 [0,1,0,0,0,0|2,0,1]=4 829 B7R0.2 C[C@@H](CC(C)=C)C=O Amb24375353 [0,1,0,0,0,0|2,0,1]=4 830 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [0,1,0,0,0,0|2,0,1]=4 831 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [0,1,0,0,0,0|1,0,1]=3 832 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,1,0,0,0,0|0,0,2]=3 833 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [0,1,0,0,0,0|2,0,1]=4 834 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [0,1,0,0,0,0|1,0,1]=3 835 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [0,1,0,0,0,0|2,0,1]=4 836 B7R0.2 C[C@@H](O)\C=C(/C)\C=O Amb25827172 [0,1,0,0,0,0|1,0,2]=4 837 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,1,0,0,0,0|1,0,1]=3 838 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [0,1,0,0,0,0|2,0,1]=4 839 B7R0.2 C[C@H](O)CC(C)=C=C Amb25346210 [0,1,0,0,0,0|2,0,1]=4 840 B7R0.2 C\C(=C/C(C)=O)\NN Amb25718654 [0,1,0,0,0,0|2,0,1]=4 841 B7R0.2 C\C(=C/C(C)=O)\OC Amb24332557 [0,1,0,0,0,0|1,0,1]=3 842 B7R0.2 C\C(=C/C(N)=O)\C#N Amb24507835 [0,1,0,0,0,0|2,0,1]=4 843 B7R0.2 C\C(=C/C(N)=O)\C=C Amb24523763 [0,1,0,0,0,0|2,0,1]=4 844 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [0,1,0,0,0,0|0,0,1]=2 845 B7R0.2 C\C(=C\C(=C)O)\OC Amb24481460 [0,1,0,0,0,0|1,0,2]=4 846 B7R0.2 C\C(=C\C(C)=O)\C#C Amb24760457 [0,1,0,0,0,0|2,0,1]=4 847 B7R0.2 C\C(=C\C(C)=O)\O[K] Amb22353109 [0,1,0,0,0,0|1,0,1]=3 848 B7R0.2 C\C(=C\C(C)=O)\O[Rb] Amb22337868 [0,1,0,0,0,0|1,0,1]=3 849 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22167430 [0,1,0,0,0,0|1,0,1]=3 850 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22167433 [0,1,0,0,0,0|1,0,1]=3 851 B7R0.2 C\C(=C\C(C)=O)\O[Rh] Amb22350497 [0,1,0,0,0,0|1,0,1]=3 852 B7R0.2 C\C(=C\C(C)=O)\O[Tl] Amb22351612 [0,1,0,0,0,0|1,0,1]=3 853 B7R0.2 C\C(=C\C(O)=O)\C=C Amb18641686 [0,1,0,0,0,0|1,0,1]=3 854 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [0,1,0,0,0,0|0,0,1]=2 855 B7R0.2 C\C(=C\C)\NC(C)=O Amb24468210 [0,1,0,0,0,0|3,0,0]=4 856 B7R0.2 C\C(\Br)=C\C(=O)CC Amb24356848 [0,1,0,0,0,0|2,0,1]=4 857 B7R0.2 C\C(\C=C)=C/C(C)=O Amb25234874 [0,1,0,0,0,0|2,0,1]=4 858 B7R0.2 C\C(\C=O)=C\C(C)=C Amb18641616 [0,1,0,0,0,0|2,0,1]=4 859 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,1,0,0,0,0|1,0,1]=3 860 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [0,1,0,0,0,0|2,0,0]=3 861 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [0,1,0,0,0,0|2,0,0]=3 862 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [0,1,0,0,0,0|1,0,0]=2 863 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [0,1,0,0,0,0|2,0,0]=3 864 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,1,0,0,0,0|1,0,0]=2 865 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,1,0,0,0,0|0,0,1]=2 866 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,1,0,0,0,0|1,0,1]=3 867 B7R0.2 C\C(\CCl)=C\C(C)=O Amb25340485 [0,1,0,0,0,0|2,0,1]=4 868 B7R0.2 C\C(\CN)=C\C(C)=O Amb20621518 [0,1,0,0,0,0|2,0,1]=4 869 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,1,0,0,0,0|1,0,1]=3 870 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,1,0,0,0,0|0,0,2]=3 871 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,1,0,0,0,0|1,0,1]=3 872 B7R0.2 C\C(\Cl)=C/C(=O)C=C Amb25087168 [0,1,0,0,0,0|2,0,1]=4 873 B7R0.2 C\C(\Cl)=C/C(=O)CC Amb24434564 [0,1,0,0,0,0|2,0,1]=4 874 B7R0.2 C\C(\F)=C\C(=O)OC Amb22235113 [0,1,0,0,0,0|1,0,1]=3 875 B7R0.2 C\C(\N)=C\C(=N)OC Amb24617308 [0,1,0,0,0,0|2,0,1]=4 876 B7R0.2 C\C(\O)=C/C(=O)CF Amb25662370 [0,1,0,0,0,0|1,0,1]=3 877 B7R0.2 C\C(\O)=C\C(=O)CCl Amb25198036 [0,1,0,0,0,0|1,0,1]=3 878 B7R0.2 C\C(\O)=C\C(=S)NC Amb24470603 [0,1,0,0,0,0|1,1,1]=4 879 B7R0.2 C\C(\[O-])=C/C(=O)OC Amb22369282 [0,1,0,0,0,0|0,0,2]=3 880 B7R0.2 C\C(\[O-])=C\C(=O)OC Amb22353144 [0,1,0,0,0,0|0,0,2]=3 881 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,1,0,0,0,0|1,0,0]=2 882 B7R0.2 C\[N+](\CC(N)=O)=N\[O-] Amb25131183 [0,1,0,0,0,0|2,0,1]=4 883 B7R0.2 ClCC(=O)CC(=O)Cl Amb17593874 [0,1,0,0,0,0|1,0,0]=2 884 B7R0.2 NC(=N)SC(=O)CCl Amb25242631 [0,1,0,0,0,0|3,0,0]=4 885 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,1,0,0,0,0|1,0,2]=4 886 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [0,1,0,0,0,0|1,0,2]=4 887 B7R0.2 NC(=O)NC(=O)C=C Amb13951205 [0,1,0,0,0,0|2,0,1]=4 888 B7R0.2 NC(=O)NC(=O)CBr Amb24104085 [0,1,0,0,0,0|2,0,0]=3 889 B7R0.2 NC(=O)NC(=O)CI Amb25719978 [0,1,0,0,0,0|2,0,0]=3 890 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [0,1,0,0,0,0|2,0,1]=4 891 B7R0.2 NC(CF)CC(O)=O Amb24428065 [0,1,0,0,0,0|1,0,1]=3 892 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,1,0,0,0,0|1,0,1]=3 893 B7R0.2 NC(CO)CC(N)=O Amb24384089 [0,1,0,0,0,0|2,0,1]=4 894 B7R0.2 NC(CS)CC(O)=O Amb25090412 [0,1,0,0,0,0|1,0,1]=3 895 B7R0.2 NC(N)=NC(=O)CN Amb25339382 [0,1,0,0,0,0|3,0,0]=4 896 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,1,0,0,0,0|1,0,1]=3 897 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,1,0,0,0,0|1,0,1]=3 898 B7R0.2 NCC(F)CC(O)=O Amb24550169 [0,1,0,0,0,0|1,0,1]=3 899 B7R0.2 NCC(N)=NS(O)=O Amb24629109 [0,1,0,0,0,0|3,0,0]=4 900 B7R0.2 NCC(N)CC(O)=O Amb19515145 [0,1,0,0,0,0|1,0,1]=3 901 B7R0.2 NCC(N)CC(O)=O Amb21858324 [0,1,0,0,0,0|1,0,1]=3 902 B7R0.2 NCC(N)CC(O)=O Amb22751661 [0,1,0,0,0,0|1,0,1]=3 903 B7R0.2 NCC(O)CC(N)=O Amb18641952 [0,1,0,0,0,0|1,0,2]=4 904 B7R0.2 NCC(O)CP(O)=O Amb24714285 [0,1,0,0,0,0|1,0,2]=4 905 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [0,1,0,0,0,0|2,0,1]=4 906 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [0,1,0,0,0,0|1,0,1]=3 907 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [0,1,0,0,0,0|1,0,1]=3 908 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [0,1,0,0,0,0|1,0,1]=3 909 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [0,1,0,0,0,0|2,0,1]=4 910 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [0,1,0,0,0,0|1,0,1]=3 911 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [0,1,0,0,0,0|1,0,2]=4 912 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,1,0,0,0,0|1,0,1]=3 913 B7R0.2 NNC(=O)CC(=O)N Amb1980864 [0,1,0,0,0,0|2,0,0]=3 914 B7R0.2 NNC(=O)CC(C)C Amb1154207 [0,1,0,0,0,0|2,0,1]=4 915 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,1,0,0,0,0|1,0,0]=2 916 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [0,1,0,0,0,0|2,0,1]=4 917 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [0,1,0,0,0,0|1,0,2]=4 918 B7R0.2 N[C@@H](CC([O-])=O)C=O Amb22800169 [0,1,0,0,0,0|1,0,2]=4 919 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [0,1,0,0,0,0|2,0,1]=4 920 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,1,0,0,0,0|1,0,1]=3 921 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [0,1,0,0,0,0|1,0,1]=3 922 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [0,1,0,0,0,0|2,0,1]=4 923 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,1,0,0,0,0|2,0,0]=3 924 B7R0.2 O=C(CBr)C=C(Cl)Cl Amb24482991 [0,1,0,0,0,0|2,0,1]=4 925 B7R0.2 O=C(CBr)CC(F)F Amb24583262 [0,1,0,0,0,0|2,0,1]=4 926 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [0,1,0,0,0,0|2,0,1]=4 927 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [0,1,0,0,0,0|1,0,0]=2 928 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,1,0,0,0,0|0,0,0]=1 929 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,1,0,0,0,0|1,0,0]=2 930 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [0,1,0,0,0,0|1,0,1]=3 931 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [0,1,0,0,0,0|1,0,1]=3 932 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,1,0,0,0,0|1,0,1]=3 933 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [0,1,0,0,0,0|2,0,0]=3 934 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [0,1,0,0,0,0|2,0,0]=3 935 B7R0.2 OC(=O)\C=C(/Cl)\C=O Amb24452824 [0,1,0,0,0,0|1,0,1]=3 936 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,1,0,0,0,0|1,0,1]=3 937 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,1,0,0,0,0|1,0,1]=3 938 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [0,1,0,0,0,0|1,0,2]=4 939 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [0,1,0,0,0,0|0,0,2]=3 940 B7R0.2 OCC(O)CP(O)=O Amb25316128 [0,1,0,0,0,0|1,0,2]=4 941 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [0,1,0,0,0,0|1,0,1]=3 942 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [0,1,0,0,0,0|0,0,2]=3 943 B7R0.2 ON=C(CN(C)C)N Amb13777254 [0,1,0,0,0,0|3,0,0]=4 944 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [0,1,0,0,0,0|0,0,2]=3 945 B7R0.2 [2H]OC(=O)CN([2H])[2H] Amb22363166 [0,1,0,0,0,0|3,0,0]=4 946 B7R0.2 [Li]O\C(\C)=C/C(C)=O Amb22366981 [0,1,0,0,0,0|1,0,1]=3 947 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [0,1,0,0,0,0|1,0,1]=3 948 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [0,1,0,0,0,0|0,0,3]=4 949 B7R0.2 [O-][N+](=O)CC(=O)NN Amb1102120 [0,1,0,0,0,0|2,0,1]=4 950 B7R0.2 [O-][N+](=O)CC(=O)OC Amb1101938 [0,1,0,0,0,0|1,0,1]=3 951 B7R0.2 [O-][N+](=O)OC(=O)CCl Amb25224774 [0,1,0,0,0,0|2,0,1]=4 952 B7R0.9 CC(=C)CC(C)(C)O Amb22052674 [0,1,0,0,0,0|2,0,1]=4 953 B7R0.9 CC(=C)CS(=O)(=O)Cl Amb23511765 [0,1,0,0,0,0|2,0,1]=4 954 B7R0.9 CC(=C)CS([O-])(=O)=O Amb22168925 [0,1,0,0,0,0|2,0,1]=4 955 B7R0.9 CC(=O)CC(C)(C)F Amb25758912 [0,1,0,0,0,0|2,0,1]=4 956 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [0,1,0,0,0,0|2,0,1]=4 957 B7R0.9 CC(=O)CC(C)(S)S Amb25767704 [0,1,0,0,0,0|0,2,1]=4 958 B7R0.9 CC(=O)CC(Cl)(Cl)Cl Amb24750259 [0,1,0,0,0,0|2,0,1]=4 959 B7R0.9 CC(=O)CC(S)(C)C Amb17593394 [0,1,0,0,0,0|1,1,1]=4 960 B7R0.9 CC(=O)CP(C)(C)=O Amb25370726 [0,1,0,0,0,0|2,0,0]=3 961 B7R0.9 CC(=O)CP(O)(O)=O Amb24706713 [0,1,0,0,0,0|1,0,0]=2 962 B7R0.9 CC(=O)CS(O)(=O)=O Amb24751070 [0,1,0,0,0,0|1,0,0]=2 963 B7R0.9 CC(=O)C[Si](C)(C)C Amb24411725 [0,1,0,0,0,0|2,1,0]=4 964 B7R0.9 CC(=O)OP(O)(O)=O Amb17673331 [0,1,0,0,0,0|2,0,0]=3 965 B7R0.9 CC(=O)OP(O)(O)=O Amb22733227 [0,1,0,0,0,0|2,0,0]=3 966 B7R0.9 CC(C)(C)CS(O)=O Amb24614665 [0,1,0,0,0,0|2,0,1]=4 967 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,0,0|2,0,1]=4 968 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,0,0|2,0,1]=4 969 B7R0.9 CC(C)(N)CC(O)=O Amb19267108 [0,1,0,0,0,0|1,0,1]=3 970 B7R0.9 CC(C)(O)CC([O-])=O Amb17678748 [0,1,0,0,0,0|0,0,3]=4 971 B7R0.9 CC(C)(O)CC([O-])=O Amb22729769 [0,1,0,0,0,0|0,0,3]=4 972 B7R0.9 CC(CS(=O)(=O)O)O Amb17593541 [0,1,0,0,0,0|1,0,2]=4 973 B7R0.9 CC(Cl)CP(O)(O)=O Amb25169519 [0,1,0,0,0,0|2,0,1]=4 974 B7R0.9 CC(N)=NP(O)(O)=O Amb25339526 [0,1,0,0,0,0|3,0,0]=4 975 B7R0.9 CC(N)CP(C)(O)=O Amb24482995 [0,1,0,0,0,0|2,0,1]=4 976 B7R0.9 CC(O)CS(C)(=O)=O Amb21988449 [0,1,0,0,0,0|2,0,1]=4 977 B7R0.9 CC(S)CS(O)(=O)=O Amb24543740 [0,1,0,0,0,0|1,1,1]=4 978 B7R0.9 CN(C)(C)CC(O)=O Amb22343422 [0,1,0,0,0,0|2,0,0]=3 979 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [0,1,0,0,0,0|1,0,0]=2 980 B7R0.9 CS(=O)(=O)CC(N)=N Amb20625678 [0,1,0,0,0,0|3,0,0]=4 981 B7R0.9 CS(=O)(=O)CC(N)=N Amb22058742 [0,1,0,0,0,0|3,0,0]=4 982 B7R0.9 CS(=O)(=O)C[N+]([O-])=O Amb25119559 [0,1,0,0,0,0|2,0,1]=4 983 B7R0.9 CS(=O)(=O)NC(N)=O Amb22039456 [0,1,0,0,0,0|3,0,0]=4 984 B7R0.9 CS(C)(=O)=NC(=O)Cl Amb25130459 [0,1,0,0,0,0|3,0,0]=4 985 B7R0.9 CS(C)(Br)CC(O)=O Amb25829058 [0,1,0,0,0,0|2,0,0]=3 986 B7R0.9 C[As+](C)(C)CC([O-])=O Amb22347917 [0,1,0,0,0,0|2,0,1]=4 987 B7R0.9 C[C@@H](N)CP(C)(O)=O Amb24460368 [0,1,0,0,0,0|2,0,1]=4 988 B7R0.9 C[C@@H](N)CP(O)(O)=O Amb25338674 [0,1,0,0,0,0|2,0,1]=4 989 B7R0.9 C[C@@H](N)CS(O)(=O)=O Amb24670475 [0,1,0,0,0,0|2,0,1]=4 990 B7R0.9 C[C@@H](O)CP(O)(O)=O Amb24334038 [0,1,0,0,0,0|1,0,2]=4 991 B7R0.9 C[C@H](N)CS(O)(=O)=O Amb25760668 [0,1,0,0,0,0|2,0,1]=4 992 B7R0.9 C[C@H](O)CP(O)(O)=O Amb25715996 [0,1,0,0,0,0|1,0,2]=4 993 B7R0.9 C[N+](C)(C)CC(O)=O Amb22734051 [0,1,0,0,0,0|2,0,0]=3 994 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22002454 [0,1,0,0,0,0|2,0,1]=4 995 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22167465 [0,1,0,0,0,0|2,0,1]=4 996 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22584414 [0,1,0,0,0,0|2,0,1]=4 997 B7R0.9 C[N+](C)(N)CC(N)=O Amb25361686 [0,1,0,0,0,0|3,0,0]=4 998 B7R0.9 C[P+](C)(C)CC(O)=O Amb24753800 [0,1,0,0,0,0|2,0,0]=3 999 B7R0.9 C[Si](C)(C)CC(N)=O Amb24574114 [0,1,0,0,0,0|2,1,0]=4 1000 B7R0.9 C[Si](C)(C)CC(O)=O Amb19894126 [0,1,0,0,0,0|1,1,0]=3 1001 B7R0.9 NC(=O)CP(O)(O)=O Amb24481466 [0,1,0,0,0,0|2,0,0]=3 1002 B7R0.9 NC(=O)CS(N)(=O)=O Amb25081925 [0,1,0,0,0,0|2,0,1]=4 1003 B7R0.9 NC(=O)OP(O)(O)=O Amb22352542 [0,1,0,0,0,0|3,0,0]=4 1004 B7R0.9 O=C(Cl)CP(=O)(Cl)Cl Amb24568686 [0,1,0,0,0,0|3,0,0]=4 1005 B7R0.9 OC(=O)CC(F)(F)Br Amb24373833 [0,1,0,0,0,0|2,0,1]=4 1006 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [0,1,0,0,0,0|0,0,2]=3 1007 B7R0.9 OC(=O)CS(=O)(=O)O Amb16232248 [0,1,0,0,0,0|2,0,0]=3 1008 B7R0.9 OC(=O)C[As+](C)(C)C Amb17608518 [0,1,0,0,0,0|2,0,0]=3 1009 B7R0.9 [2H]C([2H])([2H])CC(C)=O Amb22351764 [0,1,0,0,0,0|2,0,1]=4 1010 B7R0.9 [2H]C([2H])([2H])CC(O)=O Amb22338080 [0,1,0,0,0,0|2,0,1]=4 1011 B7R0.9 [O-]C(=O)C[As]([O-])(O)=O Amb21618903 [0,1,0,0,0,0|2,0,0]=3 1012 B7R0.9 [O-]C(=O)C[As]([O-])([O-])=O Amb22731052 [0,1,0,0,0,0|2,0,1]=4 1013 B7R0.9 [O-]C(=O)C[N+](C)(C)C Amb10843741 [0,1,0,0,0,0|2,0,1]=4 1014 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [0,1,0,0,0,0|2,0,1]=4 1015 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,1,0,0,0,0|1,0,0]=2 1016 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,1,0,0,0,0|1,0,1]=3 1017 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,1,0,0,0,0|1,0,1]=3 1018 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,1,0,0,0,0|1,0,1]=3 1019 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,1,0,0,0,0|1,0,1]=3 1020 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,1,0,0,0,0|1,0,1]=3 1021 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,1,0,0,0,0|1,0,1]=3 1022 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,1,0,0,0,0|1,0,1]=3 1023 B7R0.16 CC(=C(C)C)C(=O)C Amb17593162 [0,1,0,0,0,0|2,0,1]=4 1024 B7R0.16 CC(=C(C)N)C(C)=O Amb25232464 [0,1,0,0,0,0|2,0,1]=4 1025 B7R0.16 CC(=C(N)N)C(C)=O Amb25168636 [0,1,0,0,0,0|2,0,1]=4 1026 B7R0.16 CC(=C(N)O)C(C)=O Amb24741192 [0,1,0,0,0,0|1,0,1]=3 1027 B7R0.16 CC(=C)C(=C)C(C)=O Amb24481403 [0,1,0,0,0,0|2,0,1]=4 1028 B7R0.16 CC(=C)C(=C)C(N)=O Amb25857156 [0,1,0,0,0,0|2,0,1]=4 1029 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,1,0,0,0,0|1,0,0]=2 1030 B7R0.16 CC(=C)C(Cl)C(C)=C Amb24725733 [0,1,0,0,0,0|3,0,0]=4 1031 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,1,0,0,0,0|1,0,0]=2 1032 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,1,0,0,0,0|1,0,0]=2 1033 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,1,0,0,0,0|2,0,0]=3 1034 B7R0.16 CC(=N)C(=N)C(N)=O Amb24357519 [0,1,0,0,0,0|2,0,1]=4 1035 B7R0.16 CC(=N)C(C)C(N)=S Amb25326603 [0,1,0,0,0,0|2,1,0]=4 1036 B7R0.16 CC(=O)C(=C)S(C)=O Amb25853035 [0,1,0,0,0,0|2,0,1]=4 1037 B7R0.16 CC(=O)C(=O)C(C)O Amb25173440 [0,1,0,0,0,0|1,0,2]=4 1038 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,1,0,0,0,0|0,0,1]=2 1039 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,1,0,0,0,0|1,0,1]=3 1040 B7R0.16 CC(=O)C(Br)C(C)=C Amb24533829 [0,1,0,0,0,0|2,0,0]=3 1041 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,0,0|1,0,0]=2 1042 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,1,0,0,0,0|1,0,0]=2 1043 B7R0.16 CC(=O)C(C)C(=O)S Amb25094430 [0,1,0,0,0,0|0,1,0]=2 1044 B7R0.16 CC(=O)C(C)C(=S)Cl Amb24432212 [0,1,0,0,0,0|1,1,0]=3 1045 B7R0.16 CC(=O)C(C)C(N)=N Amb24629832 [0,1,0,0,0,0|2,0,0]=3 1046 B7R0.16 CC(=O)C(Cl)=C(C)N Amb24564321 [0,1,0,0,0,0|2,0,1]=4 1047 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,1,0,0,0,0|1,0,0]=2 1048 B7R0.16 CC(=O)C(F)=C(F)F Amb25116561 [0,1,0,0,0,0|2,0,1]=4 1049 B7R0.16 CC(=O)C(F)C(C)=O Amb19889779 [0,1,0,0,0,0|1,0,0]=2 1050 B7R0.16 CC(=O)C(F)C(F)F Amb25697000 [0,1,0,0,0,0|2,0,1]=4 1051 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,1,0,0,0,0|0,0,0]=1 1052 B7R0.16 CC(=O)C(O)C(C)=C Amb24614054 [0,1,0,0,0,0|2,0,0]=3 1053 B7R0.16 CC(=O)C(S)=C(C)O Amb25327947 [0,1,0,0,0,0|1,0,1]=3 1054 B7R0.16 CC(=O)N(C)C(N)=O Amb24621834 [0,1,0,0,0,0|2,0,0]=3 1055 B7R0.16 CC(=O)N(C)C(N)=S Amb25337074 [0,1,0,0,0,0|2,1,0]=4 1056 B7R0.16 CC(=O)N(Cl)C(N)=O Amb24481411 [0,1,0,0,0,0|2,0,0]=3 1057 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,1,0,0,0,0|2,0,0]=3 1058 B7R0.16 CC(=O)\C(\Br)=C(\C)/N Amb25310939 [0,1,0,0,0,0|2,0,1]=4 1059 B7R0.16 CC(=O)\C(\Cl)=C(\C)/N Amb24581140 [0,1,0,0,0,0|2,0,1]=4 1060 B7R0.16 CC(=O)\C(\F)=C(\C)/O Amb24571214 [0,1,0,0,0,0|1,0,1]=3 1061 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,1,0,0,0,0|1,0,2]=4 1062 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,1,0,0,0,0|1,0,1]=3 1063 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,1,0,0,0,0|1,0,1]=3 1064 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,1,0,0,0,0|1,0,2]=4 1065 B7R0.16 CC(C(=O)C)C(=O)C Amb1152249 [0,1,0,0,0,0|1,0,0]=2 1066 B7R0.16 CC(C(=O)Cl)C(=O)Cl Amb22232260 [0,1,0,0,0,0|2,0,0]=3 1067 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,1,0,0,0,0|1,0,0]=2 1068 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,1,0,0,0,0|0,0,0]=1 1069 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,1,0,0,0,0|1,0,1]=3 1070 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [0,1,0,0,0,0|2,0,1]=4 1071 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,1,0,0,0,0|1,0,1]=3 1072 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,1,0,0,0,0|0,0,2]=3 1073 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,1,0,0,0,0|0,0,2]=3 1074 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,1,0,0,0,0|0,0,2]=3 1075 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,1,0,0,0,0|1,0,1]=3 1076 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,1,0,0,0,0|0,1,1]=3 1077 B7R0.16 CC(C(C)=O)=C(C)Cl Amb25326830 [0,1,0,0,0,0|2,0,1]=4 1078 B7R0.16 CC(C(C)=O)=C(C)F Amb25233562 [0,1,0,0,0,0|2,0,1]=4 1079 B7R0.16 CC(C(C)=O)S(C)=O Amb24481498 [0,1,0,0,0,0|2,0,0]=3 1080 B7R0.16 CC(C(C)=O)[N+]([O-])=O Amb24559893 [0,1,0,0,0,0|1,0,1]=3 1081 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,1,0,0,0,0|1,0,1]=3 1082 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,1,0,0,0,0|2,0,1]=4 1083 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,1,0,0,0,0|2,0,1]=4 1084 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,1,0,0,0,0|1,0,1]=3 1085 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,1,0,0,0,0|1,0,2]=4 1086 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,1,0,0,0,0|0,1,1]=3 1087 B7R0.16 CC(C(N)=O)=C(C)Cl Amb24517373 [0,1,0,0,0,0|2,0,1]=4 1088 B7R0.16 CC(C(N)=O)C(N)=S Amb22229181 [0,1,0,0,0,0|2,1,0]=4 1089 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,1,0,0,0,0|3,0,0]=4 1090 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,1,0,0,0,0|1,1,0]=3 1091 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,1,0,0,0,0|1,0,1]=3 1092 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,1,0,0,0,0|1,0,1]=3 1093 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,1,0,0,0,0|1,0,1]=3 1094 B7R0.16 CC(C(O)=O)=C(Cl)Cl Amb24373832 [0,1,0,0,0,0|2,0,1]=4 1095 B7R0.16 CC(C(O)=O)=C(F)F Amb24702881 [0,1,0,0,0,0|2,0,1]=4 1096 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,1,0,0,0,0|2,0,0]=3 1097 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,1,0,0,0,0|2,0,0]=3 1098 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,1,0,0,0,0|2,0,0]=3 1099 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,1,0,0,0,0|1,0,1]=3 1100 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,1,0,0,0,0|1,0,0]=2 1101 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,1,0,0,0,0|2,0,0]=3 1102 B7R0.16 CC(C)=C(Br)C(C)=O Amb25792957 [0,1,0,0,0,0|2,0,1]=4 1103 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,1,0,0,0,0|1,0,1]=3 1104 B7R0.16 CC(C)=C(F)C(N)=O Amb25075288 [0,1,0,0,0,0|2,0,1]=4 1105 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,1,0,0,0,0|1,0,1]=3 1106 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,1,0,0,0,0|1,0,1]=3 1107 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,1,0,0,0,0|1,0,2]=4 1108 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [0,1,0,0,0,0|2,0,1]=4 1109 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,1,0,0,0,0|2,0,1]=4 1110 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,1,0,0,0,0|2,0,1]=4 1111 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,0,0|2,0,1]=4 1112 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [0,1,0,0,0,0|2,0,1]=4 1113 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [0,1,0,0,0,0|2,0,1]=4 1114 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [0,1,0,0,0,0|2,0,1]=4 1115 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [0,1,0,0,0,0|2,0,1]=4 1116 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,1,0,0,0,0|1,0,1]=3 1117 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,1,0,0,0,0|1,1,1]=4 1118 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,1,0,0,0,0|2,0,1]=4 1119 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,0,0|2,0,1]=4 1120 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,1,0,0,0,0|1,0,1]=3 1121 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [0,1,0,0,0,0|2,0,1]=4 1122 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [0,1,0,0,0,0|2,0,1]=4 1123 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [0,1,0,0,0,0|2,0,1]=4 1124 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,1,0,0,0,0|1,0,1]=3 1125 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,1,0,0,0,0|1,0,1]=3 1126 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,1,0,0,0,0|1,0,1]=3 1127 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [0,1,0,0,0,0|2,0,1]=4 1128 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,1,0,0,0,0|2,0,1]=4 1129 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,1,0,0,0,0|1,0,1]=3 1130 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,1,0,0,0,0|1,0,1]=3 1131 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,1,0,0,0,0|2,0,1]=4 1132 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,0,0|2,0,1]=4 1133 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,0,0|2,0,1]=4 1134 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,1,0,0,0,0|1,0,1]=3 1135 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [0,1,0,0,0,0|2,0,1]=4 1136 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,1,0,0,0,0|1,0,1]=3 1137 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,1,0,0,0,0|2,0,1]=4 1138 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,1,0,0,0,0|1,1,1]=4 1139 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,1,0,0,0,0|1,0,1]=3 1140 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,1,0,0,0,0|1,0,1]=3 1141 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [0,1,0,0,0,0|2,0,1]=4 1142 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [0,1,0,0,0,0|2,0,1]=4 1143 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,1,0,0,0,0|1,0,1]=3 1144 B7R0.16 CC(Cl)=C(Cl)C(O)=O Amb25272743 [0,1,0,0,0,0|1,0,1]=3 1145 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,1,0,0,0,0|1,0,2]=4 1146 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [0,1,0,0,0,0|2,0,1]=4 1148 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,1,0,0,0,0|1,0,1]=3 1150 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,1,0,0,0,0|1,0,1]=3 1151 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,1,0,0,0,0|1,0,1]=3 1152 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,1,0,0,0,0|1,0,1]=3 1153 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,1,0,0,0,0|1,0,1]=3 1154 B7R0.16 CC(N)=C(C)C(N)=O Amb24568296 [0,1,0,0,0,0|2,0,1]=4 1155 B7R0.16 CC(N)=C(Cl)C(N)=O Amb24760958 [0,1,0,0,0,0|2,0,1]=4 1156 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,1,0,0,0,0|1,0,1]=3 1157 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,1,0,0,0,0|1,0,1]=3 1158 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,1,0,0,0,0|1,0,1]=3 1159 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,1,0,0,0,0|1,0,1]=3 1160 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,1,0,0,0,0|0,0,3]=4 1161 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,1,0,0,0,0|1,0,1]=3 1162 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,0,0|1,0,2]=4 1163 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,1,0,0,0,0|1,0,2]=4 1164 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,1,0,0,0,0|0,0,2]=3 1165 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,1,0,0,0,0|1,0,2]=4 1166 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,1,0,0,0,0|0,0,2]=3 1167 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [0,1,0,0,0,0|1,1,1]=4 1168 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,1,0,0,0,0|0,1,1]=3 1169 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,1,0,0,0,0|0,1,1]=3 1170 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,1,0,0,0,0|1,0,1]=3 1171 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [0,1,0,0,0,0|2,0,1]=4 1172 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [0,1,0,0,0,0|2,0,1]=4 1173 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,1,0,0,0,0|2,0,0]=3 1174 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,1,0,0,0,0|1,0,1]=3 1175 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,1,0,0,0,0|3,0,0]=4 1176 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,1,0,0,0,0|2,0,0]=3 1177 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,1,0,0,0,0|2,0,0]=3 1178 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,1,0,0,0,0|1,0,1]=3 1179 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,1,0,0,0,0|1,0,1]=3 1180 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,1,0,0,0,0|1,0,1]=3 1181 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,1,0,0,0,0|1,0,1]=3 1182 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,1,0,0,0,0|1,0,1]=3 1183 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,1,0,0,0,0|1,0,1]=3 1184 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,1,0,0,0,0|0,0,2]=3 1185 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,1,0,0,0,0|0,0,2]=3 1186 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,1,0,0,0,0|0,0,2]=3 1187 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,1,0,0,0,0|1,0,1]=3 1188 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,1,0,0,0,0|1,0,1]=3 1189 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,1,0,0,0,0|0,0,2]=3 1190 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,0,0|1,0,2]=4 1191 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,1,0,0,0,0|0,0,2]=3 1192 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,1,0,0,0,0|1,0,1]=3 1193 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,1,0,0,0,0|0,0,2]=3 1194 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,1,0,0,0,0|0,1,1]=3 1195 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,1,0,0,0,0|0,1,1]=3 1196 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,1,0,0,0,0|0,1,1]=3 1197 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,1,0,0,0,0|1,0,1]=3 1198 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,1,0,0,0,0|0,0,2]=3 1199 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,1,0,0,0,0|2,0,1]=4 1200 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,1,0,0,0,0|1,0,1]=3 1201 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,1,0,0,0,0|1,0,1]=3 1202 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,1,0,0,0,0|3,0,0]=4 1203 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,1,0,0,0,0|2,0,0]=3 1204 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,1,0,0,0,0|1,0,1]=3 1205 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,1,0,0,0,0|1,0,2]=4 1206 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [0,1,0,0,0,0|2,0,1]=4 1207 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,1,0,0,0,0|1,0,1]=3 1208 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,1,0,0,0,0|1,0,1]=3 1210 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,1,0,0,0,0|1,0,1]=3 1211 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [0,1,0,0,0,0|2,0,1]=4 1212 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,1,0,0,0,0|1,0,1]=3 1213 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,1,0,0,0,0|1,0,1]=3 1214 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,1,0,0,0,0|1,0,1]=3 1215 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,1,0,0,0,0|0,0,2]=3 1216 B7R0.16 C[C@H](O)[C@@H](O)C(C)=C Amb24719527 [0,1,0,0,0,0|2,0,1]=4 1217 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,1,0,0,0,0|0,0,2]=3 1218 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,1,0,0,0,0|1,0,2]=4 1219 B7R0.16 C[C@H](O)[C@H](O)C(C)=C Amb24688259 [0,1,0,0,0,0|2,0,1]=4 1220 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,1,0,0,0,0|0,1,1]=3 1221 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,1,0,0,0,0|1,0,2]=4 1222 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,1,0,0,0,0|0,0,2]=3 1223 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,1,0,0,0,0|1,0,1]=3 1225 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,1,0,0,0,0|1,0,1]=3 1226 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,1,0,0,0,0|0,0,2]=3 1227 B7R0.16 C[C@H]([C@H](C)O)S(C)=O Amb24332098 [0,1,0,0,0,0|2,0,1]=4 1228 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,1,0,0,0,0|0,1,1]=3 1229 B7R0.16 C\C(=C(\C)/N)\C(C)=O Amb24332752 [0,1,0,0,0,0|2,0,1]=4 1230 B7R0.16 C\C(\C(C)=O)=C(/C)\Cl Amb24722797 [0,1,0,0,0,0|2,0,1]=4 1231 B7R0.16 C\C(\C(C)=O)=C(\C)/Cl Amb25801180 [0,1,0,0,0,0|2,0,1]=4 1232 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,1,0,0,0,0|1,0,1]=3 1233 B7R0.16 C\C(\F)=C(/F)\C(C)=O Amb24645401 [0,1,0,0,0,0|2,0,1]=4 1234 B7R0.16 C\C(\N)=C(\C)/C(N)=O Amb25293132 [0,1,0,0,0,0|2,0,1]=4 1235 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,1,0,0,0,0|0,0,2]=3 1236 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,1,0,0,0,0|1,0,1]=3 1237 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,1,0,0,0,0|1,0,1]=3 1238 B7R0.16 NC(=O)C(=O)C(O)=O Amb25344375 [0,1,0,0,0,0|1,0,1]=3 1239 B7R0.16 NC(=O)C(Br)C(N)=O Amb23504430 [0,1,0,0,0,0|2,0,0]=3 1240 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,1,0,0,0,0|1,0,0]=2 1241 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,1,0,0,0,0|1,0,0]=2 1242 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,1,0,0,0,0|1,0,0]=2 1243 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,1,0,0,0,0|1,0,0]=2 1244 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|1,0,0]=2 1245 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,1,0,0,0,0|2,0,1]=4 1246 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,1,0,0,0,0|2,0,1]=4 1247 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,1,0,0,0,0|2,0,0]=3 1248 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,1,0,0,0,0|1,0,2]=4 1249 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,1,0,0,0,0|2,0,1]=4 1250 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,1,0,0,0,0|2,0,1]=4 1251 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,1,0,0,0,0|2,0,1]=4 1252 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,1,0,0,0,0|2,0,1]=4 1253 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,1,0,0,0,0|2,0,1]=4 1254 B7R0.16 O=C(C(=O)C)C(=O)C Amb17593178 [0,1,0,0,0,0|1,0,1]=3 1255 B7R0.16 O=C(Cl)C(Br)C(=O)Cl Amb24482983 [0,1,0,0,0,0|2,0,0]=3 1256 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,1,0,0,0,0|1,0,1]=3 1257 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,1,0,0,0,0|1,0,1]=3 1258 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,1,0,0,0,0|1,0,1]=3 1259 B7R0.16 OC(=O)C(=S)C(S)=S Amb24635391 [0,1,0,0,0,0|1,1,1]=4 1260 B7R0.16 OC(=O)C(Cl)=C(Cl)Br Amb25365980 [0,1,0,0,0,0|2,0,1]=4 1261 B7R0.16 OC(=O)C(Cl)=C(F)F Amb24758750 [0,1,0,0,0,0|2,0,1]=4 1262 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,1,0,0,0,0|1,0,0]=2 1264 B7R0.16 OC(=O)C(F)=C(Cl)Cl Amb25732891 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.16 OC(=O)C(F)=C(F)Cl Amb24628494 [0,1,0,0,0,0|2,0,1]=4 1266 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,1,0,0,0,0|1,0,0]=2 1267 B7R0.16 OC(=O)\C(\F)=C(/F)\Cl Amb25265638 [0,1,0,0,0,0|2,0,1]=4 1268 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,1,0,0,0,0|1,0,0]=2 1269 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,1,0,0,0,0|1,0,1]=3 1270 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,1,0,0,0,0|2,0,1]=4 1271 B7R0.16 OC(C(O)=O)S(O)=O Amb24551214 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,1,0,0,0,0|1,0,1]=3 1273 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,1,0,0,0,0|0,0,2]=3 1274 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,1,0,0,0,0|1,0,1]=3 1275 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,1,0,0,0,0|0,0,2]=3 1276 B7R0.16 [O-]C(=O)C(=O)C([O-])=O Amb22234835 [0,1,0,0,0,0|1,0,2]=4 1277 B7R1.2 BrC1=CC(=O)OC1 Amb10067500 [0,0,0,1,0,0|1,0,1]=3 1278 B7R1.2 C=C1CC(=O)C=C1 Amb24553656 [0,0,0,1,0,0|2,0,1]=4 1279 B7R1.2 C=C1CC(=O)NC1 Amb25767177 [0,0,0,1,0,0|2,0,0]=3 1280 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [0,0,0,1,0,0|1,0,0]=2 1281 B7R1.2 C=C1CC(O)CC1 Amb25246529 [0,0,0,1,0,0|2,0,1]=4 1282 B7R1.2 C=C1COC(=O)N1 Amb24541155 [0,0,0,1,0,0|2,0,0]=3 1283 B7R1.2 C=C1COC(=O)O1 Amb20248769 [0,0,0,1,0,0|2,0,0]=3 1284 B7R1.2 CC1=CC(=O)C=C1 Amb24364191 [0,0,0,1,0,0|2,0,1]=4 1285 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,0,0,1,0,0|1,0,1]=3 1286 B7R1.2 CC1=CC(=O)N=N1 Amb20621717 [0,0,0,1,0,0|2,0,1]=4 1287 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [0,0,0,1,0,0|2,0,1]=4 1288 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [0,0,0,1,0,0|1,0,2]=4 1289 B7R1.2 CC1=CC(=S)CO1 Amb25026404 [0,0,0,1,0,0|1,1,1]=4 1290 B7R1.2 CC1=CCC(=O)N1 Amb24119179 [0,0,0,1,0,0|3,0,0]=4 1291 B7R1.2 CC1=CNC(=O)N1 Amb20667076 [0,0,0,1,0,0|3,0,0]=4 1292 B7R1.2 CC1=CNC(=O)O1 Amb22298623 [0,0,0,1,0,0|3,0,0]=4 1293 B7R1.2 CC1=COC(=N)N1 Amb20637145 [0,0,0,1,0,0|3,0,0]=4 1294 B7R1.2 CC1=COC(=O)O1 Amb24693155 [0,0,0,1,0,0|2,0,0]=3 1295 B7R1.2 CC1=CSC(=O)N1 Amb19372452 [0,0,0,1,0,0|2,1,0]=4 1296 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [0,0,0,1,0,0|3,0,0]=4 1297 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [0,0,0,1,0,0|2,1,0]=4 1298 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,0,0,1,0,0|1,1,1]=4 1299 B7R1.2 CC1CC(=O)NC1 Amb10608004 [0,0,0,1,0,0|2,0,1]=4 1300 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,0,0,1,0,0|1,0,1]=3 1301 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,0,0,1,0,0|2,0,1]=4 1302 B7R1.2 CC1CSC(=O)C1 Amb25136024 [0,0,0,1,0,0|1,1,1]=4 1303 B7R1.2 CC1NNC(=O)C1 Amb2371659 [0,0,0,1,0,0|2,0,1]=4 1304 B7R1.2 CC1[N-]OC(=O)N1 Amb24481515 [0,0,0,1,0,0|2,0,1]=4 1305 B7R1.2 CC=1C=NC(=O)N1 Amb24754157 [0,0,0,1,0,0|3,0,0]=4 1306 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [0,0,0,1,0,0|2,0,0]=3 1307 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [0,0,0,1,0,0|1,0,0]=2 1308 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [0,0,0,1,0,0|2,0,1]=4 1309 B7R1.2 CC=1COC(=O)C1 Amb22002703 [0,0,0,1,0,0|1,0,1]=3 1310 B7R1.2 CC=1NC(=S)ON1 Amb19309843 [0,0,0,1,0,0|2,1,0]=4 1311 B7R1.2 CC=1NOC(=O)N1 Amb22491279 [0,0,0,1,0,0|2,0,0]=3 1312 B7R1.2 CN1CC(=O)CC1 Amb22236123 [0,0,0,1,0,0|3,0,0]=4 1313 B7R1.2 CN1CNC(=O)C1 Amb24733801 [0,0,0,1,0,0|3,0,0]=4 1314 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [0,0,0,1,0,0|2,0,1]=4 1315 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,0,0,1,0,0|2,0,1]=4 1316 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,0,0,1,0,0|2,0,1]=4 1317 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,0,0,1,0,0|1,0,1]=3 1318 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,0,0,1,0,0|2,0,1]=4 1319 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [0,0,0,1,0,0|2,0,1]=4 1320 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,0,0,1,0,0|1,0,1]=3 1321 B7R1.2 C[N+]=1[CH-]C(=O)ON1 Amb21876186 [0,0,0,1,0,0|2,0,1]=4 1322 B7R1.2 Cc1[nH]cc(O)[n]1 Amb25141134 [0,0,0,1,0,0|3,0,0]=4 1323 B7R1.2 Cc1[n][n]c(O)[s]1 Amb19516965 [0,0,0,1,0,0|3,0,0]=4 1324 B7R1.2 Cc1[n]c(Cl)o[n]1 Amb24081473 [0,0,0,1,0,0|3,0,0]=4 1325 B7R1.2 Cc1[n]c(O)[s][n]1 Amb25321418 [0,0,0,1,0,0|2,1,0]=4 1326 B7R1.2 Cc1[n]c(O)o[n]1 Amb19373400 [0,0,0,1,0,0|2,0,1]=4 1327 B7R1.2 Cc1[n]c(S)o[n]1 Amb20641872 [0,0,0,1,0,0|2,1,0]=4 1328 B7R1.2 Cc1[n]oc(C)[n]1 Amb24423387 [0,0,0,1,0,0|3,0,0]=4 1329 B7R1.2 Cc1cc(Br)o[n]1 Amb18190948 [0,0,0,1,0,0|2,0,1]=4 1330 B7R1.2 Cc1cc(C)on1 Amb17685548 [0,0,0,1,0,0|2,0,1]=4 1331 B7R1.2 Cc1cc(I)o[n]1 Amb22754616 [0,0,0,1,0,0|2,0,1]=4 1332 B7R1.2 Cc1cc(O)[s][n]1 Amb25132333 [0,0,0,1,0,0|1,1,1]=4 1333 B7R1.2 Cc1cc(O)[s]c1 Amb20617904 [0,0,0,1,0,0|1,1,1]=4 1334 B7R1.2 Cc1cc(O)c[s]1 Amb24523671 [0,0,0,1,0,0|1,1,1]=4 1335 B7R1.2 Cc1cc(O)co1 Amb24708163 [0,0,0,1,0,0|1,0,2]=4 1336 B7R1.2 Cc1cc(O)o[n]1 Amb22337742 [0,0,0,1,0,0|1,0,2]=4 1337 B7R1.2 Cc1cc([O-])o[n]1 Amb22264776 [0,0,0,1,0,0|1,0,2]=4 1338 B7R1.2 Cc1ccc(s1)O Amb17593190 [0,0,0,1,0,0|3,0,0]=4 1339 B7R1.2 Cc1cnc(s1)O Amb13884319 [0,0,0,1,0,0|3,0,0]=4 1340 B7R1.2 Cc1coc(Br)[n]1 Amb19958804 [0,0,0,1,0,0|3,0,0]=4 1341 B7R1.2 Cc1coc(C)c1 Amb22049832 [0,0,0,1,0,0|2,0,1]=4 1342 B7R1.2 Cc1coc(Cl)[n]1 Amb22728834 [0,0,0,1,0,0|3,0,0]=4 1343 B7R1.2 Cc1coc(S)[n]1 Amb24121247 [0,0,0,1,0,0|2,1,0]=4 1344 B7R1.2 Cc1coc(c1)Br Amb10600631 [0,0,0,1,0,0|2,0,1]=4 1345 B7R1.2 Cc1coc(c1)N Amb10600632 [0,0,0,1,0,0|2,0,1]=4 1346 B7R1.2 Cc1coc(n1)N Amb2455669 [0,0,0,1,0,0|3,0,0]=4 1347 B7R1.2 Cc1csc(n1)O Amb17593194 [0,0,0,1,0,0|2,1,0]=4 1348 B7R1.2 Cc1nnc(o1)O Amb15701519 [0,0,0,1,0,0|3,0,0]=4 1349 B7R1.2 Cc1noc(c1)N Amb1156064 [0,0,0,1,0,0|2,0,1]=4 1350 B7R1.2 Cc1occ(n1)C Amb15692404 [0,0,0,1,0,0|3,0,0]=4 1351 B7R1.2 Cc1onc(c1)C Amb1150307 [0,0,0,1,0,0|2,0,1]=4 1352 B7R1.2 ClC1COC(=O)O1 Amb10842117 [0,0,0,1,0,0|2,0,1]=4 1353 B7R1.2 FC1COC(=O)O1 Amb10841016 [0,0,0,1,0,0|2,0,1]=4 1354 B7R1.2 IC1=CC(=O)OC1 Amb2455617 [0,0,0,1,0,0|1,0,1]=3 1355 B7R1.2 N=C1CCC(=O)N1 Amb10552414 [0,0,0,1,0,0|3,0,0]=4 1356 B7R1.2 N=C1CSC(=O)N1 Amb2537154 [0,0,0,1,0,0|2,1,0]=4 1357 B7R1.2 NC1=CC(=O)CN1 Amb25268710 [0,0,0,1,0,0|2,0,1]=4 1358 B7R1.2 NC1=CC(=O)CO1 Amb24516411 [0,0,0,1,0,0|1,0,1]=3 1359 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,0,0,1,0,0|1,1,1]=4 1360 B7R1.2 NC1=CC(=O)NO1 Amb20103209 [0,0,0,1,0,0|2,0,1]=4 1361 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [0,0,0,1,0,0|3,0,0]=4 1362 B7R1.2 NC1=NC(=O)NO1 Amb24060371 [0,0,0,1,0,0|3,0,0]=4 1363 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [0,0,0,1,0,0|3,0,0]=4 1364 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [0,0,0,1,0,0|3,0,0]=4 1365 B7R1.2 NC1CC(=O)CC1 Amb22236085 [0,0,0,1,0,0|2,0,1]=4 1366 B7R1.2 NC1CC(=O)CC1 Amb22494268 [0,0,0,1,0,0|2,0,1]=4 1367 B7R1.2 NC1CC(=O)CS1 Amb25090377 [0,0,0,1,0,0|1,1,1]=4 1368 B7R1.2 NC1CC(=O)NO1 Amb24640844 [0,0,0,1,0,0|2,0,1]=4 1369 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,0,0,1,0,0|2,0,1]=4 1370 B7R1.2 NC1COC(=O)N1 Amb23590649 [0,0,0,1,0,0|2,0,1]=4 1371 B7R1.2 NC1NC(=O)CO1 Amb25709500 [0,0,0,1,0,0|2,0,1]=4 1372 B7R1.2 NC=1CNC(=O)N1 Amb22059492 [0,0,0,1,0,0|3,0,0]=4 1373 B7R1.2 NC=1COC(=O)N1 Amb24576517 [0,0,0,1,0,0|2,0,0]=3 1374 B7R1.2 NC=1NC(=O)CN1 Amb21964674 [0,0,0,1,0,0|3,0,0]=4 1375 B7R1.2 NC=1NCC(=O)N1 Amb18639307 [0,0,0,1,0,0|3,0,0]=4 1376 B7R1.2 NC=1NOC(=O)N1 Amb24060381 [0,0,0,1,0,0|3,0,0]=4 1377 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,0,0,1,0,0|2,0,1]=4 1378 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,0,0,1,0,0|2,0,1]=4 1379 B7R1.2 N[C@@H]1COS(=O)C1 Amb24612429 [0,0,0,1,0,0|2,0,1]=4 1380 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [0,0,0,1,0,0|1,0,1]=3 1381 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,0,0,1,0,0|2,0,1]=4 1382 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,0,0,1,0,0|1,0,1]=3 1383 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,0,0,1,0,0|1,0,1]=3 1384 B7R1.2 O=C1C=C(Br)CN1 Amb23400584 [0,0,0,1,0,0|2,0,1]=4 1385 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [0,0,0,1,0,0|2,0,1]=4 1386 B7R1.2 O=C1C=C(Br)CS1 Amb25026198 [0,0,0,1,0,0|1,1,1]=4 1387 B7R1.2 O=C1C=C(Cl)CO1 Amb25241116 [0,0,0,1,0,0|1,0,1]=3 1388 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [0,0,0,1,0,0|2,0,1]=4 1389 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,0,0,1,0,0|2,0,1]=4 1390 B7R1.2 O=C1C=CC(=O)O1 Amb22369065 [0,0,0,1,0,0|2,0,1]=4 1391 B7R1.2 O=C1C=CC(=O)S1 Amb24603022 [0,0,0,1,0,0|2,0,1]=4 1392 B7R1.2 O=C1C=C[13C](=O)O1 Amb22367487 [0,0,0,1,0,0|2,0,1]=4 1393 B7R1.2 O=C1CC(=O)C=C1 Amb22338203 [0,0,0,1,0,0|1,0,1]=3 1394 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [0,0,0,1,0,0|2,0,1]=4 1395 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [0,0,0,1,0,0|1,0,1]=3 1396 B7R1.2 O=C1CC(Cl)=NN1 Amb25364597 [0,0,0,1,0,0|3,0,0]=4 1397 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [0,0,0,1,0,0|1,0,1]=3 1398 B7R1.2 O=C1CC(F)CC1 Amb21963553 [0,0,0,1,0,0|2,0,1]=4 1399 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,0,0,1,0,0|1,0,1]=3 1400 B7R1.2 O=C1CC(I)CC1 Amb22001809 [0,0,0,1,0,0|2,0,1]=4 1401 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,0,0,1,0,0|1,1,1]=4 1402 B7R1.2 O=C1CCC(=O)[15NH]1 Amb22338306 [0,0,0,1,0,0|2,0,0]=3 1403 B7R1.2 O=C1CCC(Br)=C1 Amb23399816 [0,0,0,1,0,0|2,0,1]=4 1404 B7R1.2 O=C1CCC(Cl)=N1 Amb24712377 [0,0,0,1,0,0|3,0,0]=4 1405 B7R1.2 O=C1CCC(I)=C1 Amb25811714 [0,0,0,1,0,0|2,0,1]=4 1406 B7R1.2 O=C1CN(Br)CN1 Amb25112148 [0,0,0,1,0,0|3,0,0]=4 1407 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [0,0,0,1,0,0|2,1,0]=4 1408 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,0,0,1,0,0|1,0,0]=2 1409 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [0,0,0,1,0,0|2,1,0]=4 1410 B7R1.2 O=C1COC(=S)N1 Amb17920585 [0,0,0,1,0,0|1,1,0]=3 1411 B7R1.2 O=C1COC(Cl)=N1 Amb24511416 [0,0,0,1,0,0|2,0,0]=3 1412 B7R1.2 O=C1CSC(=N)N1 Amb1397203 [0,0,0,1,0,0|2,1,0]=4 1413 B7R1.2 O=C1CSC(=N1)N Amb2455844 [0,0,0,1,0,0|2,1,0]=4 1414 B7R1.2 O=C1CSC(=N1)[S-] Amb2541926 [0,0,0,1,0,0|1,2,0]=4 1415 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,0,0,1,0,0|0,1,0]=2 1416 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [0,0,0,1,0,0|1,2,0]=4 1417 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,0,0,1,0,0|1,1,1]=4 1418 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,0,0,1,0,0|1,1,1]=4 1419 B7R1.2 O=C1NC(=O)C=S1 Amb25780722 [0,0,0,1,0,0|1,1,1]=4 1420 B7R1.2 O=C1NC(=O)NN1 Amb20660475 [0,0,0,1,0,0|3,0,0]=4 1421 B7R1.2 O=C1NCC(=O)S1 Amb22372196 [0,0,0,1,0,0|2,0,0]=3 1422 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [0,0,0,1,0,0|2,0,0]=3 1423 B7R1.2 O=C1OC=C(C1)O Amb17621628 [0,0,0,1,0,0|0,0,2]=3 1424 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [0,0,0,1,0,0|1,0,0]=2 1425 B7R1.2 O=C1OCC(I)O1 Amb25681787 [0,0,0,1,0,0|2,0,1]=4 1426 B7R1.2 O=C1SCC(=O)N1 Amb1853667 [0,0,0,1,0,0|1,1,0]=3 1427 B7R1.2 O=C1[13CH]=[13CH]C(=O)O1 Amb22353372 [0,0,0,1,0,0|2,0,1]=4 1428 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [0,0,0,1,0,0|2,0,0]=3 1429 B7R1.2 O=C1[15NH][13CH2]C(=O)N1 Amb17615001 [0,0,0,1,0,0|2,0,0]=3 1430 B7R1.2 O=C1[15NH][13CH2][13C](=O)N1 Amb17615000 [0,0,0,1,0,0|2,0,0]=3 1431 B7R1.2 O=[13C]1C=C[13C](=O)O1 Amb22367373 [0,0,0,1,0,0|2,0,1]=4 1432 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [0,0,0,1,0,0|2,0,0]=3 1433 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [0,0,0,1,0,0|2,0,0]=3 1434 B7R1.2 O=[13C]1[13CH]=[13CH][13C](=O)O1 Amb22055653 [0,0,0,1,0,0|2,0,1]=4 1435 B7R1.2 OC1CC(=O)CC1 Amb22057378 [0,0,0,1,0,0|1,0,1]=3 1436 B7R1.2 OC1CCC(=O)N1 Amb21963236 [0,0,0,1,0,0|2,0,1]=4 1437 B7R1.2 OC1CCC(=O)O1 Amb22740957 [0,0,0,1,0,0|2,0,1]=4 1438 B7R1.2 OC1CNC(=O)C1 Amb19958404 [0,0,0,1,0,0|1,0,2]=4 1439 B7R1.2 OC1COC(=O)N1 Amb24428770 [0,0,0,1,0,0|1,0,2]=4 1440 B7R1.2 OC=1C=CC(=O)N1 Amb22552540 [0,0,0,1,0,0|2,0,1]=4 1441 B7R1.2 OC=1CNC(=O)C1 Amb20623530 [0,0,0,1,0,0|1,0,2]=4 1442 B7R1.2 ON1CC(=O)C=C1 Amb25286099 [0,0,0,1,0,0|2,0,1]=4 1443 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [0,0,0,1,0,0|1,0,2]=4 1444 B7R1.2 Oc1cnc(s1)C Amb10599445 [0,0,0,1,0,0|3,0,0]=4 1445 B7R1.2 Oc1csc(n1)C Amb10600550 [0,0,0,1,0,0|2,1,0]=4 1446 B7R1.2 Oc1noc(c1)C Amb2370655 [0,0,0,1,0,0|1,0,2]=4 1447 B7R1.2 Oc1nsc(c1)C Amb2420511 [0,0,0,1,0,0|1,1,1]=4 1448 B7R1.2 S=C1CSC(=O)N1 Amb2469502 [0,0,0,1,0,0|1,2,0]=4 1449 B7R1.2 S=C1NC(=S)CO1 Amb24552528 [0,0,0,1,0,0|1,2,0]=4 1450 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,0,0,1,0,0|2,0,1]=4 1451 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,1,0,0|1,0,0]=2 1452 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,1,0,0|1,0,0]=2 1453 B7R1.12 CC(=O)C1CC1Br Amb24426068 [0,0,0,1,0,0|2,0,1]=4 1454 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [0,0,0,1,0,0|2,0,1]=4 1455 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [0,0,0,1,0,0|2,0,1]=4 1456 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [0,0,0,1,0,0|2,0,1]=4 1457 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [0,0,0,1,0,0|2,0,1]=4 1458 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [0,0,0,1,0,0|2,0,1]=4 1459 B7R1.12 CC1=CC1C(C)=O Amb24736062 [0,0,0,1,0,0|2,0,0]=3 1460 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,1,0,0|2,0,1]=4 1461 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|0,0,2]=3 1462 B7R1.12 CC1SC1C(C)=O Amb24333031 [0,0,0,1,0,0|1,1,1]=4 1463 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,1,0,0|2,0,1]=4 1464 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,1,0,0|2,0,1]=4 1465 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,1,0,0|1,0,1]=3 1466 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|2,0,1]=4 1467 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,1,0,0|1,0,1]=3 1468 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,1,0,0|1,0,1]=3 1469 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,1,0,0|0,0,2]=3 1470 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [0,0,0,1,0,0|1,1,1]=4 1471 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,1,0,0|1,0,1]=3 1472 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|1,0,1]=3 1473 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,1,0,0|2,0,1]=4 1474 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [0,0,0,1,0,0|2,0,1]=4 1475 B7R1.12 NC1CC1C(N)=O Amb18279694 [0,0,0,1,0,0|2,0,1]=4 1476 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,1,0,0|1,0,1]=3 1477 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,1,0,0|1,0,1]=3 1478 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,1,0,0|1,0,1]=3 1479 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [0,0,0,1,0,0|2,0,1]=4 1480 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [0,0,0,1,0,0|2,0,1]=4 1481 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|2,0,1]=4 1482 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,1]=3 1483 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,1,0,0|0,1,1]=3 1484 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,1,0,0|1,0,1]=3 1485 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,1]=3 1486 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,1]=3 1487 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,1]=3 1488 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,1]=3 1489 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,1]=3 1490 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,1]=3 1491 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,1]=3 1492 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,1,0,0|0,0,2]=3 1493 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,0,0|2,0,1]=4 1494 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,0,0|2,0,1]=4 1495 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,0,0|1,0,1]=3 1496 B7R1.16 O=C1CC(F)(F)C1 Amb22388689 [0,0,0,1,0,0|2,0,1]=4 1497 B7R1.16 O=C1CS(=O)(=O)C1 Amb22756924 [0,0,0,1,0,0|1,0,1]=3 1498 B7R1.16 OC1CP(O)(=O)C1 Amb25811046 [0,0,0,1,0,0|1,0,2]=4 1499 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,0,1,0,0|2,0,1]=4 1500 B7R1.20 CC(=O)CC1CO1 Amb25718439 [0,0,0,1,0,0|1,0,1]=3 1501 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,0,0,1,0,0|2,0,1]=4 1502 B7R1.20 CS(=O)CC1CO1 Amb25060906 [0,0,0,1,0,0|2,0,1]=4 1503 B7R1.20 CS(=O)C[C@H]1CO1 Amb24431713 [0,0,0,1,0,0|2,0,1]=4 1504 B7R1.20 NC(=O)CC1CO1 Amb24654802 [0,0,0,1,0,0|1,0,2]=4 1505 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,0,1,0,0|2,0,1]=4 1506 B7R1.20 OC(=O)CC1CO1 Amb25244347 [0,0,0,1,0,0|0,0,2]=3 1507 B5R0.5 BrC(=C)C(=O)C Amb17593709 [0,0,0,0,1,0|2,0,0]=3 1508 B5R0.5 BrC(=C)C(=O)N Amb16233793 [0,0,0,0,1,0|2,0,1]=4 1509 B5R0.5 BrC(C(=O)C)Br Amb16234148 [0,0,0,0,1,0|2,0,1]=4 1510 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [0,0,0,0,1,0|3,0,0]=4 1511 B5R0.5 C=C(Br)C(O)=O Amb20620403 [0,0,0,0,1,0|1,0,1]=3 1512 B5R0.5 C=C(Cl)C(=O)Cl Amb24478440 [0,0,0,0,1,0|2,0,1]=4 1513 B5R0.5 C=C(Cl)C(O)=O Amb17933971 [0,0,0,0,1,0|1,0,1]=3 1514 B5R0.5 C=C(F)C(=O)F Amb24382122 [0,0,0,0,1,0|2,0,1]=4 1515 B5R0.5 C=C(F)C(N)=O Amb25312034 [0,0,0,0,1,0|2,0,1]=4 1516 B5R0.5 C=C(F)C([O-])=O Amb22263484 [0,0,0,0,1,0|1,0,2]=4 1517 B5R0.5 C=C(I)C(N)=O Amb24650953 [0,0,0,0,1,0|2,0,1]=4 1518 B5R0.5 CC(=C)B(O)O Amb21857146 [0,0,0,0,1,0|2,0,1]=4 1519 B5R0.5 CC(=C)C(=O)F Amb22230833 [0,0,0,0,1,0|2,0,0]=3 1520 B5R0.5 CC(=C)C(N)=N Amb24683875 [0,0,0,0,1,0|3,0,0]=4 1521 B5R0.5 CC(=C)C(O)=O Amb22230681 [0,0,0,0,1,0|1,0,0]=2 1522 B5R0.5 CC(=C)C(O)=O Amb22337777 [0,0,0,0,1,0|1,0,0]=2 1523 B5R0.5 CC(=C)C(O)=O Amb22351305 [0,0,0,0,1,0|1,0,0]=2 1524 B5R0.5 CC(=C)C(O)=O Amb22351871 [0,0,0,0,1,0|1,0,0]=2 1525 B5R0.5 CC(=C)C(O)=O Amb22351927 [0,0,0,0,1,0|1,0,0]=2 1526 B5R0.5 CC(=C)C(O)O Amb22228890 [0,0,0,0,1,0|1,0,2]=4 1527 B5R0.5 CC(=C)C([O-])=O Amb17943044 [0,0,0,0,1,0|1,0,1]=3 1528 B5R0.5 CC(=C)C([O-])=O Amb20240542 [0,0,0,0,1,0|1,0,1]=3 1529 B5R0.5 CC(=C)C([O-])=O Amb20240585 [0,0,0,0,1,0|1,0,1]=3 1530 B5R0.5 CC(=C)C([O-])=O Amb22045782 [0,0,0,0,1,0|1,0,1]=3 1531 B5R0.5 CC(=C)C([O-])=O Amb22045789 [0,0,0,0,1,0|1,0,1]=3 1532 B5R0.5 CC(=C)C([O-])=O Amb22229881 [0,0,0,0,1,0|1,0,1]=3 1533 B5R0.5 CC(=C)C([O-])=O Amb22230829 [0,0,0,0,1,0|1,0,1]=3 1534 B5R0.5 CC(=C)C([O-])=O Amb22231309 [0,0,0,0,1,0|1,0,1]=3 1535 B5R0.5 CC(=C)C([O-])=O Amb22730162 [0,0,0,0,1,0|1,0,1]=3 1536 B5R0.5 CC(=C)C([O-])=O Amb22730173 [0,0,0,0,1,0|1,0,1]=3 1537 B5R0.5 CC(=C)C([O-])=O Amb22730220 [0,0,0,0,1,0|1,0,1]=3 1538 B5R0.5 CC(=C)C([O-])=O Amb22730616 [0,0,0,0,1,0|1,0,1]=3 1539 B5R0.5 CC(=C)C([O-])=O Amb22732008 [0,0,0,0,1,0|1,0,1]=3 1540 B5R0.5 CC(=C)C([O-])=O Amb22732130 [0,0,0,0,1,0|1,0,1]=3 1541 B5R0.5 CC(=C)C([O-])=O Amb22732965 [0,0,0,0,1,0|1,0,1]=3 1542 B5R0.5 CC(=C)C([O-])=O Amb22733010 [0,0,0,0,1,0|1,0,1]=3 1543 B5R0.5 CC(=C)C([O-])=O Amb22733228 [0,0,0,0,1,0|1,0,1]=3 1544 B5R0.5 CC(=C)C([O-])=O Amb22733283 [0,0,0,0,1,0|1,0,1]=3 1545 B5R0.5 CC(=C)C([O-])=O Amb22733711 [0,0,0,0,1,0|1,0,1]=3 1546 B5R0.5 CC(=C)C([O-])=O Amb22734514 [0,0,0,0,1,0|1,0,1]=3 1547 B5R0.5 CC(=C)[N+]([O-])=O Amb22228902 [0,0,0,0,1,0|2,0,1]=4 1548 B5R0.5 CC(=O)C(=C)C Amb17593021 [0,0,0,0,1,0|2,0,0]=3 1549 B5R0.5 CC(=O)C(=C)S Amb24721662 [0,0,0,0,1,0|1,1,0]=3 1550 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [0,0,0,0,1,0|1,0,0]=2 1551 B5R0.5 CC(=O)C(Cl)Br Amb25784019 [0,0,0,0,1,0|2,0,1]=4 1552 B5R0.5 CC(=O)C(F)C Amb10841897 [0,0,0,0,1,0|2,0,1]=4 1553 B5R0.5 CC(=O)C(N)=N Amb24409561 [0,0,0,0,1,0|2,0,0]=3 1554 B5R0.5 CC(=O)C(N)=S Amb24581132 [0,0,0,0,1,0|1,1,0]=3 1555 B5R0.5 CC(=O)C(N)C Amb17593029 [0,0,0,0,1,0|2,0,1]=4 1556 B5R0.5 CC(=O)C(N)N Amb25810479 [0,0,0,0,1,0|2,0,1]=4 1557 B5R0.5 CC(=O)C(O)O Amb22436762 [0,0,0,0,1,0|0,0,2]=3 1558 B5R0.5 CC(=O)C([O-])=O Amb22043412 [0,0,0,0,1,0|0,0,1]=2 1559 B5R0.5 CC(=O)C([O-])=O Amb22053857 [0,0,0,0,1,0|0,0,1]=2 1560 B5R0.5 CC(=O)C([O-])=O Amb22167358 [0,0,0,0,1,0|0,0,1]=2 1561 B5R0.5 CC(=O)C([O-])=O Amb22733838 [0,0,0,0,1,0|0,0,1]=2 1562 B5R0.5 CC(=O)N(C)O Amb24066817 [0,0,0,0,1,0|2,0,0]=3 1563 B5R0.5 CC(=O)N(N)C Amb17593037 [0,0,0,0,1,0|3,0,0]=4 1564 B5R0.5 CC(=O)P(O)=O Amb25368211 [0,0,0,0,1,0|1,0,0]=2 1565 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [0,0,0,0,1,0|0,0,1]=2 1566 B5R0.5 CC(Br)=C(C)Br Amb24741236 [0,0,0,0,1,0|3,0,0]=4 1567 B5R0.5 CC(Br)C(N)=O Amb22491874 [0,0,0,0,1,0|2,0,1]=4 1568 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [0,0,0,0,1,0|1,0,1]=3 1569 B5R0.5 CC(C(=O)N)C Amb1153145 [0,0,0,0,1,0|2,0,1]=4 1570 B5R0.5 CC(C(=O)N)Cl Amb1151918 [0,0,0,0,1,0|2,0,1]=4 1571 B5R0.5 CC(C(=O)O)F Amb10605770 [0,0,0,0,1,0|1,0,1]=3 1572 B5R0.5 CC(C)=C(C)Br Amb22228669 [0,0,0,0,1,0|3,0,0]=4 1573 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,1,0|2,0,1]=4 1574 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,1,0|2,0,1]=4 1575 B5R0.5 CC(C)C([O-])=O Amb22045473 [0,0,0,0,1,0|1,0,2]=4 1576 B5R0.5 CC(C)C([O-])=O Amb22730398 [0,0,0,0,1,0|1,0,2]=4 1577 B5R0.5 CC(C)C([O-])=O Amb22734686 [0,0,0,0,1,0|1,0,2]=4 1578 B5R0.5 CC(Cl)=C(Cl)Cl Amb22227671 [0,0,0,0,1,0|3,0,0]=4 1579 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [0,0,0,0,1,0|2,0,1]=4 1580 B5R0.5 CC(F)C(=O)Cl Amb24472500 [0,0,0,0,1,0|2,0,1]=4 1581 B5R0.5 CC(I)C(=O)Cl Amb24559615 [0,0,0,0,1,0|2,0,1]=4 1582 B5R0.5 CC(I)C(N)=O Amb25684673 [0,0,0,0,1,0|2,0,1]=4 1583 B5R0.5 CC(N)=S(=O)=O Amb25142009 [0,0,0,0,1,0|2,0,1]=4 1584 B5R0.5 CC(N)C(=O)Br Amb25184851 [0,0,0,0,1,0|2,0,1]=4 1585 B5R0.5 CC(N)C(C)=O Amb19148817 [0,0,0,0,1,0|2,0,1]=4 1586 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,1,0|2,0,1]=4 1587 B5R0.5 CC(N)P(O)=O Amb25147710 [0,0,0,0,1,0|2,0,1]=4 1588 B5R0.5 CC(N)[13C](O)=O Amb22336671 [0,0,0,0,1,0|1,0,1]=3 1589 B5R0.5 CC(O)C(=O)Cl Amb25045690 [0,0,0,0,1,0|1,0,2]=4 1590 B5R0.5 CC(O)C(O)=O Amb22350027 [0,0,0,0,1,0|0,0,2]=3 1591 B5R0.5 CC(O)C([O-])=O Amb17942960 [0,0,0,0,1,0|0,0,3]=4 1592 B5R0.5 CC(O)C([O-])=O Amb17943079 [0,0,0,0,1,0|0,0,3]=4 1593 B5R0.5 CC(O)C([O-])=O Amb20246816 [0,0,0,0,1,0|0,0,3]=4 1594 B5R0.5 CC(O)C([O-])=O Amb21936112 [0,0,0,0,1,0|0,0,3]=4 1595 B5R0.5 CC(O)C([O-])=O Amb22002445 [0,0,0,0,1,0|0,0,3]=4 1596 B5R0.5 CC(O)C([O-])=O Amb22054134 [0,0,0,0,1,0|0,0,3]=4 1597 B5R0.5 CC(O)C([O-])=O Amb22055552 [0,0,0,0,1,0|0,0,3]=4 1598 B5R0.5 CC(O)C([O-])=O Amb22167842 [0,0,0,0,1,0|0,0,3]=4 1599 B5R0.5 CC(O)C([O-])=O Amb22350448 [0,0,0,0,1,0|0,0,3]=4 1600 B5R0.5 CC(O)C([O-])=O Amb22730128 [0,0,0,0,1,0|0,0,3]=4 1601 B5R0.5 CC(O)C([O-])=O Amb22730326 [0,0,0,0,1,0|0,0,3]=4 1602 B5R0.5 CC(O)C([O-])=O Amb22731947 [0,0,0,0,1,0|0,0,3]=4 1603 B5R0.5 CC(O)C([O-])=O Amb22732237 [0,0,0,0,1,0|0,0,3]=4 1604 B5R0.5 CC(O)C([O-])=O Amb22732420 [0,0,0,0,1,0|0,0,3]=4 1605 B5R0.5 CC(O)C([O-])=O Amb22732487 [0,0,0,0,1,0|0,0,3]=4 1606 B5R0.5 CC(O)C([O-])=O Amb22732889 [0,0,0,0,1,0|0,0,3]=4 1607 B5R0.5 CC(O)C([O-])=O Amb22733874 [0,0,0,0,1,0|0,0,3]=4 1608 B5R0.5 CC(O)C([O-])=O Amb22733995 [0,0,0,0,1,0|0,0,3]=4 1609 B5R0.5 CC(O)P(O)=O Amb24333635 [0,0,0,0,1,0|1,0,2]=4 1610 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [0,0,0,0,1,0|0,0,3]=4 1611 B5R0.5 CC(P)C(N)=O Amb24715877 [0,0,0,0,1,0|2,0,1]=4 1612 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [0,0,0,0,1,0|1,0,1]=3 1613 B5R0.5 CC([O-])C([O-])=O Amb22045882 [0,0,0,0,1,0|0,0,3]=4 1614 B5R0.5 CN(C)C(=O)F Amb24660451 [0,0,0,0,1,0|3,0,0]=4 1615 B5R0.5 CN(C)C(C)=O Amb24323347 [0,0,0,0,1,0|3,0,0]=4 1616 B5R0.5 CN(C)C(N)=O Amb22739731 [0,0,0,0,1,0|3,0,0]=4 1617 B5R0.5 CN(C)C(O)=O Amb22348477 [0,0,0,0,1,0|2,0,0]=3 1618 B5R0.5 CN(C)C(O)=S Amb24477978 [0,0,0,0,1,0|2,1,0]=4 1619 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [0,0,0,0,1,0|3,0,0]=4 1620 B5R0.5 CN(O)C(N)=O Amb22055740 [0,0,0,0,1,0|2,0,1]=4 1621 B5R0.5 CN([No])C(N)=O Amb20621701 [0,0,0,0,1,0|3,0,0]=4 1622 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [0,0,0,0,1,0|1,0,1]=3 1623 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [0,0,0,0,1,0|1,0,1]=3 1624 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [0,0,0,0,1,0|0,0,1]=2 1625 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [0,0,0,0,1,0|1,0,0]=2 1626 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [0,0,0,0,1,0|2,0,1]=4 1627 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [0,0,0,0,1,0|1,0,1]=3 1628 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [0,0,0,0,1,0|2,0,1]=4 1629 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [0,0,0,0,1,0|2,0,1]=4 1630 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [0,0,0,0,1,0|2,0,1]=4 1631 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [0,0,0,0,1,0|2,0,1]=4 1632 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [0,0,0,0,1,0|2,0,1]=4 1633 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [0,0,0,0,1,0|1,0,1]=3 1634 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [0,0,0,0,1,0|0,0,2]=3 1635 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [0,0,0,0,1,0|0,0,3]=4 1636 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [0,0,0,0,1,0|0,0,3]=4 1637 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [0,0,0,0,1,0|1,0,2]=4 1638 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [0,0,0,0,1,0|1,1,1]=4 1639 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [0,0,0,0,1,0|1,0,1]=3 1640 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [0,0,0,0,1,0|2,0,1]=4 1641 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [0,0,0,0,1,0|2,0,1]=4 1642 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [0,0,0,0,1,0|2,0,1]=4 1643 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [0,0,0,0,1,0|1,0,1]=3 1644 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [0,0,0,0,1,0|1,0,1]=3 1645 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [0,0,0,0,1,0|2,0,1]=4 1646 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,1,0|2,0,1]=4 1647 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [0,0,0,0,1,0|2,0,1]=4 1648 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [0,0,0,0,1,0|2,0,1]=4 1649 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [0,0,0,0,1,0|1,0,1]=3 1650 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [0,0,0,0,1,0|0,0,3]=4 1651 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [0,0,0,0,1,0|0,0,3]=4 1652 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [0,0,0,0,1,0|0,0,3]=4 1653 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [0,0,0,0,1,0|0,0,3]=4 1654 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [0,0,0,0,1,0|0,1,1]=3 1655 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [0,0,0,0,1,0|1,0,1]=3 1656 B5R0.5 ClC(=O)C(=O)C Amb17593107 [0,0,0,0,1,0|1,0,0]=2 1657 B5R0.5 FC(=C)C(=O)C Amb17593032 [0,0,0,0,1,0|2,0,0]=3 1658 B5R0.5 FC(=C)C(=O)Cl Amb10838637 [0,0,0,0,1,0|2,0,1]=4 1659 B5R0.5 FC(=O)C(=O)F Amb10840380 [0,0,0,0,1,0|2,0,0]=3 1660 B5R0.5 FC(C(=O)O)F Amb1953492 [0,0,0,0,1,0|2,0,1]=4 1661 B5R0.5 IC(C(=O)O)I Amb17612865 [0,0,0,0,1,0|2,0,1]=4 1662 B5R0.5 N=C(S)C(O)=O Amb18640468 [0,0,0,0,1,0|1,1,0]=3 1663 B5R0.5 NC(=N)C(=O)O Amb10549353 [0,0,0,0,1,0|2,0,0]=3 1664 B5R0.5 NC(=O)C(=O)C Amb17593028 [0,0,0,0,1,0|1,0,0]=2 1665 B5R0.5 NC(=O)C(=O)Cl Amb24377962 [0,0,0,0,1,0|2,0,0]=3 1666 B5R0.5 NC(=O)C(N)C Amb1156937 [0,0,0,0,1,0|2,0,1]=4 1667 B5R0.5 NC(=O)C(O)O Amb24680574 [0,0,0,0,1,0|1,0,2]=4 1668 B5R0.5 NC(=O)C([O-])=O Amb22053860 [0,0,0,0,1,0|1,0,1]=3 1669 B5R0.5 NC(=O)C([O-])=O Amb22351608 [0,0,0,0,1,0|1,0,1]=3 1670 B5R0.5 NC(=O)C([O-])=O Amb22730546 [0,0,0,0,1,0|1,0,1]=3 1671 B5R0.5 NC(=O)C([O-])=S Amb24402142 [0,0,0,0,1,0|1,1,1]=4 1672 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [0,0,0,0,1,0|2,0,1]=4 1673 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [0,0,0,0,1,0|2,0,1]=4 1674 B5R0.5 NC(Br)C(O)=O Amb25724348 [0,0,0,0,1,0|2,0,1]=4 1675 B5R0.5 NC(O)C(N)=O Amb24478450 [0,0,0,0,1,0|2,0,1]=4 1676 B5R0.5 NC(O)C(O)=O Amb24663706 [0,0,0,0,1,0|1,0,2]=4 1677 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [0,0,0,0,1,0|2,0,1]=4 1678 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [0,0,0,0,1,0|1,1,1]=4 1679 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [0,0,0,0,1,0|1,1,0]=3 1680 B5R0.5 O=[13C](Cl)[13C](=O)Cl Amb22353781 [0,0,0,0,1,0|2,0,0]=3 1681 B5R0.5 OC(=O)C(=O)O Amb10608980 [0,0,0,0,1,0|1,0,0]=2 1682 B5R0.5 OC(=O)C(=O)O Amb19134307 [0,0,0,0,1,0|1,0,0]=2 1683 B5R0.5 OC(=O)C(=O)S Amb25375340 [0,0,0,0,1,0|1,0,0]=2 1684 B5R0.5 OC(=O)C(Br)F Amb10841090 [0,0,0,0,1,0|2,0,1]=4 1685 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [0,0,0,0,1,0|2,0,1]=4 1686 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [0,0,0,0,1,0|2,0,1]=4 1687 B5R0.5 OC(=O)C(Cl)F Amb10838714 [0,0,0,0,1,0|2,0,1]=4 1688 B5R0.5 OC(=O)C(F)S Amb25272480 [0,0,0,0,1,0|1,1,1]=4 1689 B5R0.5 OC(=O)C(I)Br Amb17610018 [0,0,0,0,1,0|2,0,1]=4 1690 B5R0.5 OC(=O)C(I)Cl Amb17610937 [0,0,0,0,1,0|2,0,1]=4 1691 B5R0.5 OC(=O)C(I)F Amb10838458 [0,0,0,0,1,0|2,0,1]=4 1692 B5R0.5 OC(=O)C(O)=O Amb19374136 [0,0,0,0,1,0|1,0,0]=2 1693 B5R0.5 OC(=O)C(O)=O Amb22002537 [0,0,0,0,1,0|1,0,0]=2 1694 B5R0.5 OC(=O)C(O)=O Amb22231343 [0,0,0,0,1,0|1,0,0]=2 1695 B5R0.5 OC(=O)C(O)=O Amb22352057 [0,0,0,0,1,0|1,0,0]=2 1696 B5R0.5 OC(=O)C(O)=O Amb22353291 [0,0,0,0,1,0|1,0,0]=2 1697 B5R0.5 OC(=O)C(O)=O Amb22360650 [0,0,0,0,1,0|1,0,0]=2 1698 B5R0.5 OC(=O)C(O)=O Amb22360667 [0,0,0,0,1,0|1,0,0]=2 1699 B5R0.5 OC(=O)C(O)=O Amb22363275 [0,0,0,0,1,0|1,0,0]=2 1700 B5R0.5 OC(=O)C(O)=O Amb22363302 [0,0,0,0,1,0|1,0,0]=2 1701 B5R0.5 OC(=O)C(O)=O Amb22394874 [0,0,0,0,1,0|1,0,0]=2 1702 B5R0.5 OC(=O)C(O)=O Amb22436461 [0,0,0,0,1,0|1,0,0]=2 1703 B5R0.5 OC(=O)C(O)=O Amb22731645 [0,0,0,0,1,0|1,0,0]=2 1704 B5R0.5 OC(=O)C(O)=O Amb22731888 [0,0,0,0,1,0|1,0,0]=2 1705 B5R0.5 OC(=O)C(O)=O Amb22897045 [0,0,0,0,1,0|1,0,0]=2 1706 B5R0.5 OC(=O)C(O)=O Amb23412252 [0,0,0,0,1,0|1,0,0]=2 1707 B5R0.5 OC(=O)C(S)=S Amb25695615 [0,0,0,0,1,0|1,1,0]=3 1708 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [0,0,0,0,1,0|2,0,1]=4 1709 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [0,0,0,0,1,0|2,0,1]=4 1710 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [0,0,0,0,1,0|2,0,1]=4 1711 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [0,0,0,0,1,0|2,0,1]=4 1712 B5R0.5 OC(Cl)C(=O)Cl Amb24470096 [0,0,0,0,1,0|2,0,1]=4 1713 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [0,0,0,0,1,0|2,0,1]=4 1714 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [0,0,0,0,1,0|2,0,1]=4 1715 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [0,0,0,0,1,0|1,0,0]=2 1716 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [0,0,0,0,1,0|1,0,0]=2 1717 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [0,0,0,0,1,0|1,0,1]=3 1718 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [0,0,0,0,1,0|0,0,1]=2 1719 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [0,0,0,0,1,0|1,0,1]=3 1720 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [0,0,0,0,1,0|1,0,1]=3 1721 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [0,0,0,0,1,0|1,0,1]=3 1722 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [0,0,0,0,1,0|0,0,3]=4 1723 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [0,0,0,0,1,0|1,0,0]=2 1724 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [0,0,0,0,1,0|1,0,0]=2 1725 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [0,0,0,0,1,0|1,0,0]=2 1726 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [0,0,0,0,1,0|1,0,0]=2 1727 B5R0.5 [O-]C(=O)C([O-])=O Amb17678768 [0,0,0,0,1,0|1,0,1]=3 1728 B5R0.5 [O-]C(=O)C([O-])=O Amb17943075 [0,0,0,0,1,0|1,0,1]=3 1729 B5R0.5 [O-]C(=O)C([O-])=O Amb17943080 [0,0,0,0,1,0|1,0,1]=3 1730 B5R0.5 [O-]C(=O)C([O-])=O Amb19516140 [0,0,0,0,1,0|1,0,1]=3 1731 B5R0.5 [O-]C(=O)C([O-])=O Amb20246439 [0,0,0,0,1,0|1,0,1]=3 1732 B5R0.5 [O-]C(=O)C([O-])=O Amb20246440 [0,0,0,0,1,0|1,0,1]=3 1733 B5R0.5 [O-]C(=O)C([O-])=O Amb20246449 [0,0,0,0,1,0|1,0,1]=3 1734 B5R0.5 [O-]C(=O)C([O-])=O Amb20246450 [0,0,0,0,1,0|1,0,1]=3 1735 B5R0.5 [O-]C(=O)C([O-])=O Amb20246484 [0,0,0,0,1,0|1,0,1]=3 1736 B5R0.5 [O-]C(=O)C([O-])=O Amb20246489 [0,0,0,0,1,0|1,0,1]=3 1737 B5R0.5 [O-]C(=O)C([O-])=O Amb21963194 [0,0,0,0,1,0|1,0,1]=3 1738 B5R0.5 [O-]C(=O)C([O-])=O Amb22002099 [0,0,0,0,1,0|1,0,1]=3 1739 B5R0.5 [O-]C(=O)C([O-])=O Amb22008847 [0,0,0,0,1,0|1,0,1]=3 1740 B5R0.5 [O-]C(=O)C([O-])=O Amb22008848 [0,0,0,0,1,0|1,0,1]=3 1741 B5R0.5 [O-]C(=O)C([O-])=O Amb22045372 [0,0,0,0,1,0|1,0,1]=3 1742 B5R0.5 [O-]C(=O)C([O-])=O Amb22045383 [0,0,0,0,1,0|1,0,1]=3 1743 B5R0.5 [O-]C(=O)C([O-])=O Amb22045394 [0,0,0,0,1,0|1,0,1]=3 1744 B5R0.5 [O-]C(=O)C([O-])=O Amb22045421 [0,0,0,0,1,0|1,0,1]=3 1745 B5R0.5 [O-]C(=O)C([O-])=O Amb22045450 [0,0,0,0,1,0|1,0,1]=3 1746 B5R0.5 [O-]C(=O)C([O-])=O Amb22045454 [0,0,0,0,1,0|1,0,1]=3 1747 B5R0.5 [O-]C(=O)C([O-])=O Amb22045456 [0,0,0,0,1,0|1,0,1]=3 1748 B5R0.5 [O-]C(=O)C([O-])=O Amb22045460 [0,0,0,0,1,0|1,0,1]=3 1749 B5R0.5 [O-]C(=O)C([O-])=O Amb22045466 [0,0,0,0,1,0|1,0,1]=3 1750 B5R0.5 [O-]C(=O)C([O-])=O Amb22045574 [0,0,0,0,1,0|1,0,1]=3 1751 B5R0.5 [O-]C(=O)C([O-])=O Amb22045860 [0,0,0,0,1,0|1,0,1]=3 1752 B5R0.5 [O-]C(=O)C([O-])=O Amb22045877 [0,0,0,0,1,0|1,0,1]=3 1753 B5R0.5 [O-]C(=O)C([O-])=O Amb22052446 [0,0,0,0,1,0|1,0,1]=3 1754 B5R0.5 [O-]C(=O)C([O-])=O Amb22052448 [0,0,0,0,1,0|1,0,1]=3 1755 B5R0.5 [O-]C(=O)C([O-])=O Amb22052474 [0,0,0,0,1,0|1,0,1]=3 1756 B5R0.5 [O-]C(=O)C([O-])=O Amb22053405 [0,0,0,0,1,0|1,0,1]=3 1757 B5R0.5 [O-]C(=O)C([O-])=O Amb22053543 [0,0,0,0,1,0|1,0,1]=3 1758 B5R0.5 [O-]C(=O)C([O-])=O Amb22053546 [0,0,0,0,1,0|1,0,1]=3 1759 B5R0.5 [O-]C(=O)C([O-])=O Amb22053547 [0,0,0,0,1,0|1,0,1]=3 1760 B5R0.5 [O-]C(=O)C([O-])=O Amb22053562 [0,0,0,0,1,0|1,0,1]=3 1761 B5R0.5 [O-]C(=O)C([O-])=O Amb22053601 [0,0,0,0,1,0|1,0,1]=3 1762 B5R0.5 [O-]C(=O)C([O-])=O Amb22231460 [0,0,0,0,1,0|1,0,1]=3 1763 B5R0.5 [O-]C(=O)C([O-])=O Amb22264699 [0,0,0,0,1,0|1,0,1]=3 1764 B5R0.5 [O-]C(=O)C([O-])=O Amb22338348 [0,0,0,0,1,0|1,0,1]=3 1765 B5R0.5 [O-]C(=O)C([O-])=O Amb22338401 [0,0,0,0,1,0|1,0,1]=3 1766 B5R0.5 [O-]C(=O)C([O-])=O Amb22338445 [0,0,0,0,1,0|1,0,1]=3 1767 B5R0.5 [O-]C(=O)C([O-])=O Amb22363119 [0,0,0,0,1,0|1,0,1]=3 1768 B5R0.5 [O-]C(=O)C([O-])=O Amb22432231 [0,0,0,0,1,0|1,0,1]=3 1769 B5R0.5 [O-]C(=O)C([O-])=O Amb22730020 [0,0,0,0,1,0|1,0,1]=3 1770 B5R0.5 [O-]C(=O)C([O-])=O Amb22730044 [0,0,0,0,1,0|1,0,1]=3 1771 B5R0.5 [O-]C(=O)C([O-])=O Amb22732203 [0,0,0,0,1,0|1,0,1]=3 1772 B5R0.5 [O-]C(=O)C([O-])=O Amb22732260 [0,0,0,0,1,0|1,0,1]=3 1773 B5R0.5 [O-]C(=O)C([O-])=O Amb22732351 [0,0,0,0,1,0|1,0,1]=3 1774 B5R0.5 [O-]C(=O)C([O-])=O Amb22732671 [0,0,0,0,1,0|1,0,1]=3 1775 B5R0.5 [O-]C(=O)C([O-])=O Amb22732891 [0,0,0,0,1,0|1,0,1]=3 1776 B5R0.5 [O-]C(=O)C([O-])=O Amb22733764 [0,0,0,0,1,0|1,0,1]=3 1777 B5R0.5 [O-]C(=O)C([O-])=O Amb22734003 [0,0,0,0,1,0|1,0,1]=3 1778 B5R0.5 [O-][13C](=O)[13C]([O-])=O Amb22337921 [0,0,0,0,1,0|1,0,1]=3 1779 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [0,0,0,0,0,1|1,0,1]=3 1780 B7R0.6 C=C(Cl)CCC(N)=O Amb25843741 [0,0,0,0,0,1|2,0,1]=4 1781 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [0,0,0,0,0,1|1,0,1]=3 1782 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [0,0,0,0,0,1|1,0,1]=3 1783 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [0,0,0,0,0,1|2,0,0]=3 1784 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [0,0,0,0,0,1|1,0,0]=2 1785 B7R0.6 CC(=C)CNC(N)=S Amb19372825 [0,0,0,0,0,1|2,1,0]=4 1786 B7R0.6 CC(=C)CSC(N)=N Amb25025376 [0,0,0,0,0,1|3,0,0]=4 1787 B7R0.6 CC(=C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,1|1,0,1]=3 1788 B7R0.6 CC(=C)\C=C\C(N)=O Amb25259797 [0,0,0,0,0,1|2,0,1]=4 1789 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [0,0,0,0,0,1|2,0,0]=3 1790 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [0,0,0,0,0,1|1,0,0]=2 1791 B7R0.6 CC(=NNC(=O)C)C Amb1047247 [0,0,0,0,0,1|3,0,0]=4 1792 B7R0.6 CC(=O)C=CC(C)=O Amb22346013 [0,0,0,0,0,1|1,0,1]=3 1793 B7R0.6 CC(=O)CC=C(Cl)Cl Amb25745505 [0,0,0,0,0,1|2,0,0]=3 1794 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,0,0,0,0,1|1,0,1]=3 1795 B7R0.6 CC(=O)CCC(=C)Br Amb24690678 [0,0,0,0,0,1|2,0,0]=3 1796 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [0,0,0,0,0,1|1,0,0]=2 1797 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [0,0,0,0,0,1|1,0,0]=2 1798 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [0,0,0,0,0,1|2,0,1]=4 1799 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [0,0,0,0,0,1|0,0,1]=2 1800 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [0,0,0,0,0,1|1,0,0]=2 1801 B7R0.6 CC(=O)CCS(=O)=O Amb25730256 [0,0,0,0,0,1|1,0,1]=3 1802 B7R0.6 CC(=O)CC[N+]([O-])=O Amb18198961 [0,0,0,0,0,1|1,0,1]=3 1803 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [0,0,0,0,0,1|1,0,0]=2 1804 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [0,0,0,0,0,1|2,0,0]=3 1805 B7R0.6 CC(=O)CSC(C)=N Amb24634756 [0,0,0,0,0,1|2,0,0]=3 1806 B7R0.6 CC(=O)CSC(N)=N Amb24084924 [0,0,0,0,0,1|2,0,0]=3 1807 B7R0.6 CC(=O)CSC(N)=S Amb25044427 [0,0,0,0,0,1|1,1,0]=3 1808 B7R0.6 CC(=O)NCC(=C)Br Amb25804966 [0,0,0,0,0,1|2,0,0]=3 1809 B7R0.6 CC(=O)NCC(=C)Cl Amb25032220 [0,0,0,0,0,1|2,0,0]=3 1810 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [0,0,0,0,0,1|1,0,0]=2 1811 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,1|0,0,0]=1 1812 B7R0.6 CC(=O)NCC(=S)N Amb17231879 [0,0,0,0,0,1|1,1,0]=3 1813 B7R0.6 CC(=O)NCC(C)=C Amb25126091 [0,0,0,0,0,1|2,0,0]=3 1814 B7R0.6 CC(=O)NCC(O)O Amb25378443 [0,0,0,0,0,1|0,0,2]=3 1815 B7R0.6 CC(=O)NNC(=S)N Amb2543737 [0,0,0,0,0,1|2,1,0]=4 1816 B7R0.6 CC(=O)OC=C(C)N Amb24573507 [0,0,0,0,0,1|2,0,1]=4 1817 B7R0.6 CC(=O)OCC(=C)Br Amb25333124 [0,0,0,0,0,1|2,0,0]=3 1818 B7R0.6 CC(=O)OCC(=C)C Amb16187121 [0,0,0,0,0,1|2,0,0]=3 1819 B7R0.6 CC(=O)OCC(=C)Cl Amb24744447 [0,0,0,0,0,1|2,0,0]=3 1820 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [0,0,0,0,0,1|1,0,0]=2 1821 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,1|0,0,0]=1 1822 B7R0.6 CC(=O)OCC(F)Cl Amb25116212 [0,0,0,0,0,1|2,0,1]=4 1823 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,1|1,0,0]=2 1824 B7R0.6 CC(=O)OCS(C)=O Amb24667100 [0,0,0,0,0,1|2,0,0]=3 1825 B7R0.6 CC(=O)OOC(C)=O Amb22230214 [0,0,0,0,0,1|2,0,0]=3 1826 B7R0.6 CC(=O)OSC(N)=S Amb24381984 [0,0,0,0,0,1|2,1,0]=4 1827 B7R0.6 CC(=O)SCC(=C)Cl Amb21960981 [0,0,0,0,0,1|2,0,0]=3 1828 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,1|1,0,0]=2 1829 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [0,0,0,0,0,1|0,0,0]=1 1830 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [0,0,0,0,0,1|1,0,0]=2 1831 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,1|1,0,0]=2 1832 B7R0.6 CC(=O)SNC(N)=O Amb25843227 [0,0,0,0,0,1|2,0,0]=3 1833 B7R0.6 CC(=O)SSC(C)=O Amb24099405 [0,0,0,0,0,1|2,0,0]=3 1834 B7R0.6 CC(=O)\C=C/C(C)=O Amb24551133 [0,0,0,0,0,1|1,0,1]=3 1835 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [0,0,0,0,0,1|0,0,1]=2 1836 B7R0.6 CC(=O)\C=C\C(=O)Cl Amb24643241 [0,0,0,0,0,1|1,0,1]=3 1837 B7R0.6 CC(=O)\C=C\C(C)=C Amb25232835 [0,0,0,0,0,1|2,0,1]=4 1838 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,0,0,0,0,1|1,0,1]=3 1839 B7R0.6 CC(=O)\C=C\C(O)O Amb25663062 [0,0,0,0,0,1|0,0,3]=4 1840 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [0,0,0,0,0,1|0,1,0]=2 1841 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [0,0,0,0,0,1|2,0,1]=4 1842 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [0,0,0,0,0,1|2,0,1]=4 1843 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [0,0,0,0,0,1|1,0,1]=3 1844 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [0,0,0,0,0,1|2,0,1]=4 1845 B7R0.6 CC(Br)COC(C)=O Amb25360690 [0,0,0,0,0,1|2,0,1]=4 1846 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [0,0,0,0,0,1|1,0,2]=4 1847 B7R0.6 CC(C)=C=CC(C)=O Amb25189061 [0,0,0,0,0,1|2,0,1]=4 1848 B7R0.6 CC(C)=CCC([O-])=O Amb22491058 [0,0,0,0,0,1|1,0,1]=3 1849 B7R0.6 CC(C)=COC(=O)Cl Amb25174283 [0,0,0,0,0,1|2,0,1]=4 1850 B7R0.6 CC(C)=COC(C)=O Amb25349708 [0,0,0,0,0,1|2,0,1]=4 1851 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [0,0,0,0,0,1|1,0,0]=2 1852 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [0,0,0,0,0,1|1,0,1]=3 1853 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [0,0,0,0,0,1|1,0,2]=4 1854 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,1|2,0,1]=4 1855 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [0,0,0,0,0,1|1,0,2]=4 1856 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [0,0,0,0,0,1|1,0,2]=4 1857 B7R0.6 CC(C)SCC(C)=O Amb22549127 [0,0,0,0,0,1|2,0,1]=4 1858 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [0,0,0,0,0,1|1,0,2]=4 1859 B7R0.6 CC(CCC(=O)O)C Amb1153016 [0,0,0,0,0,1|1,0,1]=3 1860 B7R0.6 CC(CCC(=O)O)N Amb17593212 [0,0,0,0,0,1|1,0,1]=3 1861 B7R0.6 CC(CNC(=O)N)C Amb1151241 [0,0,0,0,0,1|2,0,1]=4 1862 B7R0.6 CC(Cl)=C=CC(O)=O Amb25321565 [0,0,0,0,0,1|1,0,1]=3 1863 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [0,0,0,0,0,1|2,0,0]=3 1864 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,1|2,0,1]=4 1865 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [0,0,0,0,0,1|2,0,1]=4 1866 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [0,0,0,0,0,1|1,0,1]=3 1867 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [0,0,0,0,0,1|2,0,1]=4 1868 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [0,0,0,0,0,1|2,0,1]=4 1869 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [0,0,0,0,0,1|2,0,1]=4 1870 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [0,0,0,0,0,1|2,0,1]=4 1871 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [0,0,0,0,0,1|2,0,1]=4 1872 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [0,0,0,0,0,1|2,0,1]=4 1873 B7R0.6 CC(F)CCC(O)=O Amb24682772 [0,0,0,0,0,1|1,0,1]=3 1874 B7R0.6 CC(N)=NCC(=C)Br Amb25355414 [0,0,0,0,0,1|3,0,0]=4 1875 B7R0.6 CC(N)=NCC(=C)Cl Amb25200362 [0,0,0,0,0,1|3,0,0]=4 1876 B7R0.6 CC(N)CCC(C)=O Amb24698356 [0,0,0,0,0,1|2,0,1]=4 1877 B7R0.6 CC(N)CCC(N)=O Amb18641901 [0,0,0,0,0,1|2,0,1]=4 1878 B7R0.6 CC(N)CCC(O)=O Amb19515603 [0,0,0,0,0,1|1,0,1]=3 1879 B7R0.6 CC(N)CNC(C)=O Amb18631377 [0,0,0,0,0,1|2,0,1]=4 1880 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,1|2,0,1]=4 1881 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [0,0,0,0,0,1|1,0,2]=4 1882 B7R0.6 CC(NCC(=O)N)C Amb2370772 [0,0,0,0,0,1|2,0,1]=4 1883 B7R0.6 CC(NCC(=O)O)C Amb2372347 [0,0,0,0,0,1|1,0,1]=3 1884 B7R0.6 CC(O)=NNC(N)=O Amb17777869 [0,0,0,0,0,1|2,0,1]=4 1885 B7R0.6 CC(O)CC=C(C)C Amb24645341 [0,0,0,0,0,1|2,0,1]=4 1886 B7R0.6 CC(O)CCC(C)=C Amb24062974 [0,0,0,0,0,1|2,0,1]=4 1887 B7R0.6 CC(O)CCC(C)=O Amb25829594 [0,0,0,0,0,1|1,0,1]=3 1888 B7R0.6 CC(O)CCC(O)=O Amb18294804 [0,0,0,0,0,1|0,0,2]=3 1889 B7R0.6 CC(O)CN=C(C)N Amb24370924 [0,0,0,0,0,1|2,0,1]=4 1890 B7R0.6 CC(O)CNS(C)=O Amb24536649 [0,0,0,0,0,1|2,0,1]=4 1891 B7R0.6 CC(O)COC(C)=O Amb24056158 [0,0,0,0,0,1|1,0,1]=3 1892 B7R0.6 CC(O)COP(O)=O Amb24591406 [0,0,0,0,0,1|1,0,2]=4 1893 B7R0.6 CC(O)NCC(O)=O Amb25141558 [0,0,0,0,0,1|0,0,2]=3 1894 B7R0.6 CC(O)OCC(C)=C Amb24333382 [0,0,0,0,0,1|2,0,1]=4 1895 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [0,0,0,0,0,1|1,0,2]=4 1896 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [0,0,0,0,0,1|0,0,3]=4 1897 B7R0.6 CC(S)CNC(C)=O Amb24695989 [0,0,0,0,0,1|1,1,1]=4 1898 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [0,0,0,0,0,1|0,1,2]=4 1899 B7R0.6 CC(SCC(=O)O)C Amb1128460 [0,0,0,0,0,1|1,0,1]=3 1900 B7R0.6 CN(C)CCC(O)=O Amb19888182 [0,0,0,0,0,1|2,0,0]=3 1901 B7R0.6 CN(C)NCC(N)=O Amb24634715 [0,0,0,0,0,1|3,0,0]=4 1902 B7R0.6 CN(C)NCC(O)=O Amb24481366 [0,0,0,0,0,1|2,0,0]=3 1903 B7R0.6 CN(C)SCC(N)=O Amb22492532 [0,0,0,0,0,1|3,0,0]=4 1904 B7R0.6 CN(C)\C=C\C(O)=O Amb25273624 [0,0,0,0,0,1|2,0,1]=4 1905 B7R0.6 CN(CCC(=O)C)C Amb1129203 [0,0,0,0,0,1|3,0,0]=4 1906 B7R0.6 CN(CCC(=O)N)C Amb17231825 [0,0,0,0,0,1|3,0,0]=4 1907 B7R0.6 CS(=O)CCC(N)=N Amb25248432 [0,0,0,0,0,1|3,0,0]=4 1908 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [0,0,0,0,0,1|2,0,0]=3 1909 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [0,0,0,0,0,1|1,0,0]=2 1910 B7R0.6 CS(=O)NCC(=C)Br Amb24688786 [0,0,0,0,0,1|3,0,0]=4 1911 B7R0.6 CS(=O)NCC(=C)Cl Amb25177399 [0,0,0,0,0,1|3,0,0]=4 1912 B7R0.6 CS(=O)NCC(N)=O Amb24589713 [0,0,0,0,0,1|2,0,0]=3 1913 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [0,0,0,0,0,1|1,0,0]=2 1914 B7R0.6 CS(=O)\C=C\C(O)=O Amb18642965 [0,0,0,0,0,1|1,0,1]=3 1915 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [0,0,0,0,0,1|0,0,2]=3 1916 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [0,0,0,0,0,1|0,0,3]=4 1917 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [0,0,0,0,0,1|2,0,1]=4 1918 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [0,0,0,0,0,1|1,0,1]=3 1919 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [0,0,0,0,0,1|2,0,1]=4 1920 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [0,0,0,0,0,1|1,0,1]=3 1921 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [0,0,0,0,0,1|1,0,1]=3 1922 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [0,0,0,0,0,1|0,1,1]=3 1923 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [0,0,0,0,0,1|1,0,1]=3 1924 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [0,0,0,0,0,1|1,0,2]=4 1925 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [0,0,0,0,0,1|1,0,1]=3 1926 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [0,0,0,0,0,1|2,0,0]=3 1927 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [0,0,0,0,0,1|2,0,1]=4 1928 B7R0.6 FC(COC(=O)C)F Amb10839327 [0,0,0,0,0,1|2,0,1]=4 1929 B7R0.6 NC(=N)CCC(=O)Cl Amb24565938 [0,0,0,0,0,1|3,0,0]=4 1930 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [0,0,0,0,0,1|2,0,0]=3 1931 B7R0.6 NC(=N)NCC(=O)Cl Amb25258517 [0,0,0,0,0,1|3,0,0]=4 1932 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [0,0,0,0,0,1|2,0,0]=3 1933 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [0,0,0,0,0,1|2,0,0]=3 1934 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [0,0,0,0,0,1|2,0,0]=3 1935 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [0,0,0,0,0,1|2,0,0]=3 1936 B7R0.6 NC(=O)CCB(O)O Amb24483052 [0,0,0,0,0,1|2,0,1]=4 1937 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [0,0,0,0,0,1|2,0,0]=3 1938 B7R0.6 NC(=O)CCC(N)=N Amb25680023 [0,0,0,0,0,1|3,0,0]=4 1939 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [0,0,0,0,0,1|2,0,0]=3 1940 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [0,0,0,0,0,1|1,0,0]=2 1941 B7R0.6 NC(=O)CNC(S)=S Amb24697901 [0,0,0,0,0,1|1,2,0]=4 1942 B7R0.6 NC(=O)CNC([O-])=S Amb25146514 [0,0,0,0,0,1|1,1,1]=4 1943 B7R0.6 NC(=O)CSC(N)=N Amb22261500 [0,0,0,0,0,1|3,0,0]=4 1944 B7R0.6 NC(=O)NCC(=O)N Amb1136421 [0,0,0,0,0,1|2,0,0]=3 1945 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [0,0,0,0,0,1|1,0,0]=2 1946 B7R0.6 NC(=O)OCC(=O)Cl Amb25259155 [0,0,0,0,0,1|2,0,0]=3 1947 B7R0.6 NC(=O)OCC(N)=O Amb25724808 [0,0,0,0,0,1|2,0,0]=3 1948 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [0,0,0,0,0,1|1,0,0]=2 1949 B7R0.6 NC(=O)SCC(N)=O Amb24359876 [0,0,0,0,0,1|2,0,0]=3 1950 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [0,0,0,0,0,1|1,0,0]=2 1951 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [0,0,0,0,0,1|1,1,0]=3 1952 B7R0.6 NC(=S)CNC(N)=O Amb24667922 [0,0,0,0,0,1|2,1,0]=4 1953 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [0,0,0,0,0,1|1,1,0]=3 1954 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [0,0,0,0,0,1|1,1,0]=3 1955 B7R0.6 NC(=S)\C=C\C(O)=O Amb25707640 [0,0,0,0,0,1|1,1,1]=4 1956 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [0,0,0,0,0,1|2,0,0]=3 1957 B7R0.6 O=C([OH2+])[13C]#CC(=O)[OH2+] Amb22336968 [0,0,0,0,0,1|1,0,2]=4 1958 B7R0.6 OB(O)CCC(O)=O Amb24640288 [0,0,0,0,0,1|2,0,1]=4 1959 B7R0.6 OC(=O)C=CC(O)=O Amb22487311 [0,0,0,0,0,1|1,0,1]=3 1960 B7R0.6 OC(=O)C=CC(O)=O Amb22487315 [0,0,0,0,0,1|1,0,1]=3 1961 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,1|2,0,0]=3 1962 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [0,0,0,0,0,1|2,0,0]=3 1963 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [0,0,0,0,0,1|1,0,0]=2 1964 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,1|2,0,1]=4 1965 B7R0.6 OC(=O)CCC(F)F Amb20623135 [0,0,0,0,0,1|2,0,1]=4 1966 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [0,0,0,0,0,1|1,0,0]=2 1967 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [0,0,0,0,0,1|1,0,0]=2 1968 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [0,0,0,0,0,1|1,0,0]=2 1969 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [0,0,0,0,0,1|1,0,0]=2 1970 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [0,0,0,0,0,1|1,0,0]=2 1971 B7R0.6 OC(=O)CNC(S)=S Amb24739663 [0,0,0,0,0,1|1,1,0]=3 1972 B7R0.6 OC(=O)COC(S)=S Amb24739791 [0,0,0,0,0,1|1,1,0]=3 1973 B7R0.6 OC(=O)COS(=O)=O Amb25064798 [0,0,0,0,0,1|2,0,0]=3 1974 B7R0.6 OC(=O)CSC(S)=S Amb24608205 [0,0,0,0,0,1|1,1,0]=3 1975 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [0,0,0,0,0,1|1,0,0]=2 1976 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [0,0,0,0,0,1|2,0,0]=3 1977 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [0,0,0,0,0,1|1,0,0]=2 1978 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [0,0,0,0,0,1|1,0,0]=2 1979 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [0,0,0,0,0,1|1,0,0]=2 1980 B7R0.6 OC(=O)\C=C/C(O)=O Amb22274309 [0,0,0,0,0,1|1,0,1]=3 1981 B7R0.6 OC(=O)\C=C/C(O)=O Amb22350132 [0,0,0,0,0,1|1,0,1]=3 1982 B7R0.6 OC(=O)\C=C\C(=O)O Amb10072561 [0,0,0,0,0,1|1,0,1]=3 1983 B7R0.6 OC(=O)\C=C\C(O)=O Amb22336584 [0,0,0,0,0,1|1,0,1]=3 1984 B7R0.6 OC(=O)\C=C\C(O)=O Amb22352586 [0,0,0,0,0,1|1,0,1]=3 1985 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353441 [0,0,0,0,0,1|1,0,1]=3 1986 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353537 [0,0,0,0,0,1|1,0,1]=3 1987 B7R0.6 OC(=O)\C=C\C(O)=O Amb22360655 [0,0,0,0,0,1|1,0,1]=3 1988 B7R0.6 OC(=O)\C=C\P(O)=O Amb24622481 [0,0,0,0,0,1|2,0,1]=4 1989 B7R0.6 OC(=O)\[13CH]=[13CH]\C(O)=O Amb22363150 [0,0,0,0,0,1|1,0,1]=3 1990 B7R0.6 OC(=O)\[14CH]=[14CH]/C(O)=O Amb22352435 [0,0,0,0,0,1|1,0,1]=3 1991 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [0,0,0,0,0,1|1,0,1]=3 1992 B7R0.6 OC(O)CCC(O)=O Amb25762802 [0,0,0,0,0,1|1,0,2]=4 1993 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [0,0,0,0,0,1|1,0,0]=2 1994 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [0,0,0,0,0,1|1,0,0]=2 1995 B7R0.6 O[13C](=O)\[13CH]=[13CH]\[13C](O)=O Amb22055283 [0,0,0,0,0,1|1,0,1]=3 1996 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [0,0,0,0,0,1|1,0,0]=2 1997 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [0,0,0,0,0,1|0,0,0]=1 1998 B7R0.6 [15NH2][13C](=O)NN[13C](=O)[15NH2] Amb17615003 [0,0,0,0,0,1|3,0,0]=4 1999 B7R0.6 [O-]C(=O)/C=C/C([O-])=O Amb17942943 [0,0,0,0,0,1|1,0,2]=4 2000 B7R0.6 [O-]C(=O)C#CC(O)=O Amb19748298 [0,0,0,0,0,1|1,0,1]=3 2001 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [0,0,0,0,0,1|1,0,0]=2 2002 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [0,0,0,0,0,1|1,0,0]=2 2003 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [0,0,0,0,0,1|1,0,1]=3 2004 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [0,0,0,0,0,1|1,0,1]=3 2005 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [0,0,0,0,0,1|1,0,1]=3 2006 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [0,0,0,0,0,1|1,0,1]=3 2007 B7R0.6 [O-]C(=O)NCC([O-])=O Amb22731445 [0,0,0,0,0,1|1,0,1]=3 2008 B7R0.6 [O-]C(=O)\C=C/C(O)=O Amb22168115 [0,0,0,0,0,1|1,0,1]=3 2009 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb22731335 [0,0,0,0,0,1|1,0,2]=4 2010 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb22733809 [0,0,0,0,0,1|1,0,2]=4 2011 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb24325338 [0,0,0,0,0,1|1,0,2]=4 2012 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22043387 [0,0,0,0,0,1|1,0,1]=3 2013 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22734231 [0,0,0,0,0,1|1,0,1]=3 2014 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb20246799 [0,0,0,0,0,1|1,0,2]=4 2015 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22002520 [0,0,0,0,0,1|1,0,2]=4 2016 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22043369 [0,0,0,0,0,1|1,0,2]=4 2017 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22730640 [0,0,0,0,0,1|1,0,2]=4 2018 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22732045 [0,0,0,0,0,1|1,0,2]=4 2019 B7R0.6 [O-][N+](=O)CCC(=O)Cl Amb24532013 [0,0,0,0,0,1|2,0,1]=4 2020 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [0,0,0,0,0,1|2,0,0]=3 2021 B7R0.6 [O-][N+](=O)\C=C\C(O)=O Amb25736416 [0,0,0,0,0,1|2,0,1]=4 2022 B4R0.1 BC(=O)OC Amb22337865 [2,0,0,0,0,0|2,0,0]=4 2023 B4R0.1 BC(=O)OC Amb25199772 [2,0,0,0,0,0|2,0,0]=4 2024 B4R0.1 BCC(C)=O Amb25024392 [2,0,0,0,0,0|1,0,0]=3 2025 B4R0.1 BrC=C(C)C Amb10067297 [2,0,0,0,0,0|2,0,0]=4 2026 B4R0.1 C=C(Br)CO Amb20620404 [2,0,0,0,0,0|1,0,1]=4 2027 B4R0.1 C=C(F)CO Amb22008254 [2,0,0,0,0,0|1,0,1]=4 2028 B4R0.1 C=C(I)C=O Amb25747223 [2,0,0,0,0,0|1,0,1]=4 2029 B4R0.1 C=CC(N)=O Amb22167336 [2,0,0,0,0,0|1,0,1]=4 2030 B4R0.1 C=CC(N)=O Amb22351294 [2,0,0,0,0,0|1,0,1]=4 2031 B4R0.1 C=CC(O)=O Amb22227738 [2,0,0,0,0,0|0,0,1]=3 2032 B4R0.1 C=CC(O)=O Amb22336305 [2,0,0,0,0,0|0,0,1]=3 2033 B4R0.1 C=CC(O)=O Amb22338581 [2,0,0,0,0,0|0,0,1]=3 2034 B4R0.1 C=CC(O)=O Amb22351186 [2,0,0,0,0,0|0,0,1]=3 2035 B4R0.1 C=CC(O)=O Amb22351399 [2,0,0,0,0,0|0,0,1]=3 2036 B4R0.1 C=CC(O)=O Amb22363130 [2,0,0,0,0,0|0,0,1]=3 2037 B4R0.1 C=CC([O-])=O Amb22045810 [2,0,0,0,0,0|0,0,2]=4 2038 B4R0.1 C=CC([O-])=O Amb22045811 [2,0,0,0,0,0|0,0,2]=4 2039 B4R0.1 C=CC([O-])=O Amb22045848 [2,0,0,0,0,0|0,0,2]=4 2040 B4R0.1 C=CC([O-])=O Amb22045849 [2,0,0,0,0,0|0,0,2]=4 2041 B4R0.1 C=CC([O-])=O Amb22045850 [2,0,0,0,0,0|0,0,2]=4 2042 B4R0.1 C=CC([O-])=O Amb22054122 [2,0,0,0,0,0|0,0,2]=4 2043 B4R0.1 C=CC([O-])=O Amb22167662 [2,0,0,0,0,0|0,0,2]=4 2044 B4R0.1 C=CC([O-])=O Amb22229631 [2,0,0,0,0,0|0,0,2]=4 2045 B4R0.1 C=CC([O-])=O Amb22336408 [2,0,0,0,0,0|0,0,2]=4 2046 B4R0.1 C=CC([O-])=O Amb22366873 [2,0,0,0,0,0|0,0,2]=4 2047 B4R0.1 C=CC([O-])=O Amb22731093 [2,0,0,0,0,0|0,0,2]=4 2048 B4R0.1 C=CC([O-])=O Amb22732585 [2,0,0,0,0,0|0,0,2]=4 2049 B4R0.1 C=CC([O-])=O Amb22733713 [2,0,0,0,0,0|0,0,2]=4 2050 B4R0.1 C=C[13C](N)=O Amb22350706 [2,0,0,0,0,0|1,0,1]=4 2051 B4R0.1 C=C[13C](O)=O Amb22351199 [2,0,0,0,0,0|0,0,1]=3 2052 B4R0.1 C=NC(N)=O Amb25267386 [2,0,0,0,0,0|2,0,0]=4 2053 B4R0.1 CB(C)CO Amb24477462 [2,0,0,0,0,0|2,0,0]=4 2054 B4R0.1 CC(=C)C=C Amb22337780 [2,0,0,0,0,0|1,0,1]=4 2055 B4R0.1 CC(=C)CN Amb10071222 [2,0,0,0,0,0|2,0,0]=4 2056 B4R0.1 CC(=C)CN Amb17749039 [2,0,0,0,0,0|2,0,0]=4 2057 B4R0.1 CC(=C)CS Amb19888160 [2,0,0,0,0,0|1,1,0]=4 2058 B4R0.1 CC(=C)C[Pd+] Amb22729504 [2,0,0,0,0,0|2,0,0]=4 2059 B4R0.1 CC(=C)[13CH]=O Amb22055667 [2,0,0,0,0,0|1,0,0]=3 2060 B4R0.1 CC(=N)CO Amb24478077 [2,0,0,0,0,0|1,0,0]=3 2061 B4R0.1 CC(=N)NO Amb22232230 [2,0,0,0,0,0|2,0,0]=4 2062 B4R0.1 CC(=O)C#N Amb17231798 [2,0,0,0,0,0|1,0,1]=4 2063 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|1,0,0]=3 2064 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,0]=3 2065 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,0]=3 2066 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|0,0,0]=2 2067 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|0,1,0]=3 2068 B4R0.1 CC(=O)N=O Amb25745528 [2,0,0,0,0,0|1,0,0]=3 2069 B4R0.1 CC(=O)NBr Amb17672559 [2,0,0,0,0,0|2,0,0]=4 2070 B4R0.1 CC(=O)NCl Amb17939326 [2,0,0,0,0,0|2,0,0]=4 2071 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 2072 B4R0.1 CC(=O)N[SiH3] Amb25746995 [2,0,0,0,0,0|1,1,0]=4 2073 B4R0.1 CC(=O)OS Amb22168358 [2,0,0,0,0,0|1,1,0]=4 2074 B4R0.1 CC(=O)O[Hg] Amb22732602 [2,0,0,0,0,0|2,0,0]=4 2075 B4R0.1 CC(=S)C=O Amb24477343 [2,0,0,0,0,0|0,1,0]=3 2076 B4R0.1 CC(=S)CBr Amb24358071 [2,0,0,0,0,0|1,1,0]=4 2077 B4R0.1 CC(=S)CCl Amb24476902 [2,0,0,0,0,0|1,1,0]=4 2078 B4R0.1 CC(C)=C=C Amb19930195 [2,0,0,0,0,0|1,0,1]=4 2079 B4R0.1 CC(C)=C=O Amb17672588 [2,0,0,0,0,0|1,0,1]=4 2080 B4R0.1 CC(C)=CCl Amb22338168 [2,0,0,0,0,0|2,0,0]=4 2081 B4R0.1 CC(C=O)Cl Amb10603585 [2,0,0,0,0,0|1,0,1]=4 2082 B4R0.1 CC(Cl)CO Amb20623180 [2,0,0,0,0,0|1,0,1]=4 2083 B4R0.1 CC(F)=CCl Amb25663106 [2,0,0,0,0,0|2,0,0]=4 2084 B4R0.1 CC(I)C=O Amb24477178 [2,0,0,0,0,0|1,0,1]=4 2085 B4R0.1 CC(I)CO Amb24477272 [2,0,0,0,0,0|1,0,1]=4 2086 B4R0.1 CC(N)=CO Amb24478074 [2,0,0,0,0,0|1,0,0]=3 2087 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|1,0,1]=4 2088 B4R0.1 CC(N)CO Amb22230596 [2,0,0,0,0,0|1,0,1]=4 2089 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|0,0,2]=4 2090 B4R0.1 CC(O)CO Amb22231414 [2,0,0,0,0,0|0,0,2]=4 2091 B4R0.1 CC(O)CO Amb22336184 [2,0,0,0,0,0|0,0,2]=4 2092 B4R0.1 CC(O)CO Amb22336311 [2,0,0,0,0,0|0,0,2]=4 2093 B4R0.1 CC(O)CO Amb22337860 [2,0,0,0,0,0|0,0,2]=4 2094 B4R0.1 CC(O)CO Amb22337955 [2,0,0,0,0,0|0,0,2]=4 2095 B4R0.1 CC(O)CO Amb22338488 [2,0,0,0,0,0|0,0,2]=4 2096 B4R0.1 CC(O)CO Amb22730967 [2,0,0,0,0,0|0,0,2]=4 2097 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|0,1,1]=4 2098 B4R0.1 CC(S)CO Amb19375527 [2,0,0,0,0,0|0,1,1]=4 2099 B4R0.1 CC=C(Br)Br Amb22733606 [2,0,0,0,0,0|2,0,0]=4 2100 B4R0.1 CC=C(F)F Amb10840482 [2,0,0,0,0,0|2,0,0]=4 2101 B4R0.1 CCC(=C)Br Amb22052658 [2,0,0,0,0,0|2,0,0]=4 2102 B4R0.1 CCC(=C)C Amb10069004 [2,0,0,0,0,0|1,0,1]=4 2103 B4R0.1 CCC(=C)Cl Amb22228725 [2,0,0,0,0,0|2,0,0]=4 2104 B4R0.1 CCC(=C)O Amb22338693 [2,0,0,0,0,0|1,0,0]=3 2105 B4R0.1 CCC(=O)Cl Amb22338551 [2,0,0,0,0,0|1,0,0]=3 2106 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 2107 B4R0.1 CCC(=S)N Amb1114671 [2,0,0,0,0,0|1,1,0]=4 2108 B4R0.1 CCC(N)O Amb25076743 [2,0,0,0,0,0|1,0,1]=4 2109 B4R0.1 CCC(O)=O Amb22363268 [2,0,0,0,0,0|0,0,0]=2 2110 B4R0.1 CCC(O)Br Amb25045070 [2,0,0,0,0,0|1,0,1]=4 2111 B4R0.1 CCC(O)Cl Amb24390895 [2,0,0,0,0,0|1,0,1]=4 2112 B4R0.1 CCC(O)S Amb25057963 [2,0,0,0,0,0|0,1,1]=4 2113 B4R0.1 CCC(S)=S Amb25219037 [2,0,0,0,0,0|0,2,0]=4 2114 B4R0.1 CCC([O-])=O Amb17942918 [2,0,0,0,0,0|0,0,1]=3 2115 B4R0.1 CCC([O-])=O Amb22043363 [2,0,0,0,0,0|0,0,1]=3 2116 B4R0.1 CCC([O-])=O Amb22053980 [2,0,0,0,0,0|0,0,1]=3 2117 B4R0.1 CCC([O-])=O Amb22353324 [2,0,0,0,0,0|0,0,1]=3 2118 B4R0.1 CCC([O-])=O Amb22730265 [2,0,0,0,0,0|0,0,1]=3 2119 B4R0.1 CCC([O-])=O Amb22731204 [2,0,0,0,0,0|0,0,1]=3 2120 B4R0.1 CCC([O-])=O Amb22732964 [2,0,0,0,0,0|0,0,1]=3 2121 B4R0.1 CCC([O-])=O Amb22733966 [2,0,0,0,0,0|0,0,1]=3 2122 B4R0.1 CCI(=O)=O Amb25809920 [2,0,0,0,0,0|1,0,1]=4 2123 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 2124 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 2125 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|1,0,1]=4 2126 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 2127 B4R0.1 CCS(O)=O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 2128 B4R0.1 CCS([O-])=O Amb17943109 [2,0,0,0,0,0|1,0,1]=4 2129 B4R0.1 CCS([O-])=O Amb22411287 [2,0,0,0,0,0|1,0,1]=4 2130 B4R0.1 CC[13C](O)=O Amb22336570 [2,0,0,0,0,0|0,0,0]=2 2131 B4R0.1 CC[13C](O)=O Amb22732548 [2,0,0,0,0,0|0,0,0]=2 2132 B4R0.1 CC[13C]([O-])=O Amb22363364 [2,0,0,0,0,0|0,0,1]=3 2133 B4R0.1 CC[C@@H](N)O Amb25824305 [2,0,0,0,0,0|1,0,1]=4 2134 B4R0.1 CN(C)C=O Amb22168323 [2,0,0,0,0,0|2,0,0]=4 2135 B4R0.1 CN(C)CO Amb17673884 [2,0,0,0,0,0|2,0,0]=4 2136 B4R0.1 CN(C)[13CH]=O Amb22363163 [2,0,0,0,0,0|2,0,0]=4 2137 B4R0.1 CN(C=O)N Amb10843911 [2,0,0,0,0,0|2,0,0]=4 2138 B4R0.1 CNC(=O)Br Amb25764660 [2,0,0,0,0,0|2,0,0]=4 2139 B4R0.1 CNC(=O)N Amb1152075 [2,0,0,0,0,0|2,0,0]=4 2140 B4R0.1 CNC(Cl)=O Amb17942998 [2,0,0,0,0,0|2,0,0]=4 2141 B4R0.1 CNC(N)=O Amb22899158 [2,0,0,0,0,0|2,0,0]=4 2142 B4R0.1 CNC(O)=S Amb25747283 [2,0,0,0,0,0|1,1,0]=4 2143 B4R0.1 COC([O-])=O Amb22731820 [2,0,0,0,0,0|1,0,1]=4 2144 B4R0.1 COC([O-])=O Amb25688001 [2,0,0,0,0,0|1,0,1]=4 2145 B4R0.1 CP(C)CO Amb24430966 [2,0,0,0,0,0|2,0,0]=4 2146 B4R0.1 CS(=O)CBr Amb24476829 [2,0,0,0,0,0|2,0,0]=4 2147 B4R0.1 CS(=O)C[Na] Amb25809809 [2,0,0,0,0,0|2,0,0]=4 2148 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 2149 B4R0.1 CSC(C)=O Amb22043188 [2,0,0,0,0,0|1,0,1]=4 2150 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 2151 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [2,0,0,0,0,0|0,0,1]=3 2152 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [2,0,0,0,0,0|0,0,1]=3 2153 B4R0.1 C[14C](=O)O[Na] Amb22350228 [2,0,0,0,0,0|2,0,0]=4 2154 B4R0.1 C[15N](C)C=O Amb22338371 [2,0,0,0,0,0|2,0,0]=4 2155 B4R0.1 C[C@@H](Br)CO Amb24477146 [2,0,0,0,0,0|1,0,1]=4 2156 B4R0.1 C[C@@H](CO)F Amb10840975 [2,0,0,0,0,0|1,0,1]=4 2157 B4R0.1 C[C@@H](N)C=O Amb25090862 [2,0,0,0,0,0|1,0,1]=4 2158 B4R0.1 C[C@@H](N)CO Amb22748206 [2,0,0,0,0,0|1,0,1]=4 2159 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|0,0,2]=4 2160 B4R0.1 C[C@@H](S)CO Amb25220615 [2,0,0,0,0,0|0,1,1]=4 2161 B4R0.1 C[C@H](Br)CO Amb24661942 [2,0,0,0,0,0|1,0,1]=4 2162 B4R0.1 C[C@H](CO)F Amb10840974 [2,0,0,0,0,0|1,0,1]=4 2163 B4R0.1 C[C@H](O)C=O Amb24452140 [2,0,0,0,0,0|0,0,2]=4 2164 B4R0.1 C[C@H](S)CO Amb25662302 [2,0,0,0,0,0|0,1,1]=4 2165 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|2,0,0]=4 2166 B4R0.1 C[SiH](C)CO Amb25058422 [2,0,0,0,0,0|1,1,0]=4 2167 B4R0.1 C\C(=C\Cl)\F Amb10838560 [2,0,0,0,0,0|2,0,0]=4 2168 B4R0.1 C\C(=N\O)\N Amb10610482 [2,0,0,0,0,0|2,0,0]=4 2169 B4R0.1 C\C(\Br)=C/Br Amb22730991 [2,0,0,0,0,0|2,0,0]=4 2170 B4R0.1 C\C(\Br)=C/F Amb24088815 [2,0,0,0,0,0|2,0,0]=4 2171 B4R0.1 C\C(\Cl)=C/Cl Amb24077348 [2,0,0,0,0,0|2,0,0]=4 2172 B4R0.1 C\C(\O)=N\O Amb22492489 [2,0,0,0,0,0|1,0,1]=4 2173 B4R0.1 C\C=C(/C)\Br Amb21953703 [2,0,0,0,0,0|2,0,0]=4 2174 B4R0.1 C\C=C(/C)\Cl Amb25025045 [2,0,0,0,0,0|2,0,0]=4 2175 B4R0.1 C\C=C(\C)/Br Amb20001493 [2,0,0,0,0,0|2,0,0]=4 2176 B4R0.1 C\C=C(\C)/Cl Amb22731715 [2,0,0,0,0,0|2,0,0]=4 2177 B4R0.1 C\C=C(\Cl)/Br Amb24640149 [2,0,0,0,0,0|2,0,0]=4 2178 B4R0.1 ClC(=O)C=C Amb17942845 [2,0,0,0,0,0|1,0,1]=4 2179 B4R0.1 FC(=O)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 2180 B4R0.1 FCC(=O)Cl Amb16185604 [2,0,0,0,0,0|2,0,0]=4 2181 B4R0.1 NC(=O)C=N Amb24460788 [2,0,0,0,0,0|2,0,0]=4 2182 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|2,0,0]=4 2183 B4R0.1 NC(=O)CCl Amb20620153 [2,0,0,0,0,0|2,0,0]=4 2184 B4R0.1 NC(=O)CN Amb22234569 [2,0,0,0,0,0|2,0,0]=4 2185 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|1,0,0]=3 2186 B4R0.1 NC(=O)[15NH]O Amb17615941 [2,0,0,0,0,0|2,0,0]=4 2187 B4R0.1 NC(S)=CO Amb25173804 [2,0,0,0,0,0|1,1,0]=4 2188 B4R0.1 NCC(=O)N Amb10604177 [2,0,0,0,0,0|2,0,0]=4 2189 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|1,1,0]=4 2190 B4R0.1 NCC(O)=O Amb22274145 [2,0,0,0,0,0|1,0,0]=3 2191 B4R0.1 NCC(O)=O Amb22731925 [2,0,0,0,0,0|1,0,0]=3 2192 B4R0.1 NCC([O-])=O Amb20240906 [2,0,0,0,0,0|1,0,1]=4 2193 B4R0.1 NCC([O-])=O Amb21962917 [2,0,0,0,0,0|1,0,1]=4 2194 B4R0.1 NCC([O-])=O Amb22167467 [2,0,0,0,0,0|1,0,1]=4 2195 B4R0.1 NCC([O-])=O Amb22167948 [2,0,0,0,0,0|1,0,1]=4 2196 B4R0.1 NCC([O-])=O Amb22336294 [2,0,0,0,0,0|1,0,1]=4 2197 B4R0.1 NCC([O-])=O Amb22493796 [2,0,0,0,0,0|1,0,1]=4 2198 B4R0.1 NCC([O-])=O Amb22729954 [2,0,0,0,0,0|1,0,1]=4 2199 B4R0.1 NCC([O-])=O Amb22729967 [2,0,0,0,0,0|1,0,1]=4 2200 B4R0.1 NCC([O-])=O Amb22733691 [2,0,0,0,0,0|1,0,1]=4 2201 B4R0.1 NC[13C](O)=O Amb22354047 [2,0,0,0,0,0|1,0,0]=3 2202 B4R0.1 N[13CH2]C(O)=O Amb22363299 [2,0,0,0,0,0|1,0,0]=3 2203 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [2,0,0,0,0,0|1,0,0]=3 2204 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 2205 B4R0.1 O=C(F)CF Amb24476837 [2,0,0,0,0,0|2,0,0]=4 2206 B4R0.1 O=C(P)CCl Amb24377624 [2,0,0,0,0,0|2,0,0]=4 2207 B4R0.1 O=CC(=O)S Amb24505852 [2,0,0,0,0,0|0,1,0]=3 2208 B4R0.1 OC(=O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 2209 B4R0.1 OC(=O)CI Amb22274295 [2,0,0,0,0,0|1,0,0]=3 2210 B4R0.1 OC(=O)CI Amb22353096 [2,0,0,0,0,0|1,0,0]=3 2211 B4R0.1 OC(=O)CO Amb22338156 [2,0,0,0,0,0|0,0,1]=3 2212 B4R0.1 OC(=O)CP Amb24476887 [2,0,0,0,0,0|1,0,0]=3 2213 B4R0.1 OC(=O)CS Amb22360787 [2,0,0,0,0,0|0,1,0]=3 2214 B4R0.1 OC(=O)CS Amb24323537 [2,0,0,0,0,0|0,1,0]=3 2215 B4R0.1 OC(=O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 2216 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [2,0,0,0,0,0|1,0,0]=3 2217 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [2,0,0,0,0,0|1,0,0]=3 2218 B4R0.1 OC(=O)[13CH2]I Amb22367368 [2,0,0,0,0,0|1,0,0]=3 2219 B4R0.1 OC(=S)CCl Amb25064312 [2,0,0,0,0,0|1,1,0]=4 2220 B4R0.1 OC(=[18O])CBr Amb22367291 [2,0,0,0,0,0|1,0,0]=3 2221 B4R0.1 OC(Cl)C=O Amb25700927 [2,0,0,0,0,0|1,0,1]=4 2222 B4R0.1 OC=C(Br)Br Amb25747016 [2,0,0,0,0,0|2,0,0]=4 2223 B4R0.1 OCC(=O)Cl Amb25121296 [2,0,0,0,0,0|1,0,0]=3 2224 B4R0.1 OCC(O)=S Amb25245907 [2,0,0,0,0,0|0,1,1]=4 2225 B4R0.1 OCC(S)=S Amb25746765 [2,0,0,0,0,0|1,1,0]=4 2226 B4R0.1 OCP(=O)O Amb1981423 [2,0,0,0,0,0|1,0,1]=4 2227 B4R0.1 OCS(=O)=O Amb25184792 [2,0,0,0,0,0|2,0,0]=4 2228 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [2,0,0,0,0,0|0,0,1]=3 2229 B4R0.1 O[13C](=O)CBr Amb22351346 [2,0,0,0,0,0|1,0,0]=3 2230 B4R0.1 O[13C](=O)CCl Amb22351545 [2,0,0,0,0,0|1,0,0]=3 2231 B4R0.1 O[13C](=O)CI Amb22367367 [2,0,0,0,0,0|1,0,0]=3 2232 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [2,0,0,0,0,0|1,0,0]=3 2233 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [2,0,0,0,0,0|1,0,0]=3 2234 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [2,0,0,0,0,0|1,0,0]=3 2235 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [2,0,0,0,0,0|0,0,0]=2 2236 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [2,0,0,0,0,0|0,0,1]=3 2237 B4R0.1 O[13C](=[18O])CBr Amb22337237 [2,0,0,0,0,0|1,0,0]=3 2238 B4R0.1 O[14C](=O)CBr Amb22731740 [2,0,0,0,0,0|1,0,0]=3 2239 B4R0.1 O[14C](=O)O[Na] Amb22350243 [2,0,0,0,0,0|2,0,0]=4 2240 B4R0.1 [13CH2]=[13CH][13C](N)=O Amb22367442 [2,0,0,0,0,0|1,0,1]=4 2241 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [2,0,0,0,0,0|0,0,1]=3 2242 B4R0.1 [13CH3]N([13CH3])C=O Amb22353459 [2,0,0,0,0,0|2,0,0]=4 2243 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [2,0,0,0,0,0|0,0,0]=2 2244 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [2,0,0,0,0,0|0,0,0]=2 2245 B4R0.1 [13CH3][13CH]([13CH3])[13CH2]O Amb22338875 [2,0,0,0,0,0|1,0,1]=4 2246 B4R0.1 [14CH3]C(=O)O[Na] Amb22349811 [2,0,0,0,0,0|2,0,0]=4 2247 B4R0.1 [15NH2]C(=O)CI Amb22367467 [2,0,0,0,0,0|2,0,0]=4 2248 B4R0.1 [15NH2]CC(O)=O Amb22337980 [2,0,0,0,0,0|1,0,0]=3 2249 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [2,0,0,0,0,0|1,0,0]=3 2250 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [2,0,0,0,0,0|1,0,0]=3 2251 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [2,0,0,0,0,0|1,0,0]=3 2252 B4R0.1 [15NH2][13C](=O)[15NH]O Amb17615940 [2,0,0,0,0,0|2,0,0]=4 2253 B4R0.1 [BH3-]OC(C)=O Amb24625387 [2,0,0,0,0,0|2,0,0]=4 2254 B4R0.1 [Na]OC(=O)C Amb10552368 [2,0,0,0,0,0|2,0,0]=4 2255 B4R0.1 [O-]C(=O)C=C Amb17942810 [2,0,0,0,0,0|0,0,2]=4 2256 B4R0.1 [O-]C(=O)C=O Amb22349677 [2,0,0,0,0,0|0,0,1]=3 2257 B4R0.1 [O-]C(=O)C=O Amb22359884 [2,0,0,0,0,0|0,0,1]=3 2258 B4R0.1 [O-]C(=O)CBr Amb22049507 [2,0,0,0,0,0|1,0,1]=4 2259 B4R0.1 [O-]C(=O)CC Amb10844614 [2,0,0,0,0,0|0,0,1]=3 2260 B4R0.1 [O-]C(=O)CCl Amb22330602 [2,0,0,0,0,0|1,0,1]=4 2261 B4R0.1 [O-]C(=O)CF Amb10840933 [2,0,0,0,0,0|1,0,1]=4 2262 B4R0.1 [O-]C(=O)CF Amb22230760 [2,0,0,0,0,0|1,0,1]=4 2263 B4R0.1 [O-]C(=O)CF Amb22730747 [2,0,0,0,0,0|1,0,1]=4 2264 B4R0.1 [O-]C(=O)CI Amb22229643 [2,0,0,0,0,0|1,0,1]=4 2265 B4R0.1 [O-]C(=O)CO Amb22045509 [2,0,0,0,0,0|1,0,0]=3 2266 B4R0.1 [O-]C(=O)CO Amb22730982 [2,0,0,0,0,0|1,0,0]=3 2267 B4R0.1 [O-]CC([O-])=O Amb22739620 [2,0,0,0,0,0|0,0,2]=4 2268 B4R0.1 [O-]S(=O)C=O Amb22043269 [2,0,0,0,0,0|1,0,1]=4 2269 B4R0.1 [O-]S(=O)CO Amb19930207 [2,0,0,0,0,0|2,0,0]=4 2270 B4R0.2 C#CCC=O Amb25681696 [2,0,0,0,0,0|0,0,2]=4 2271 B4R0.2 C/C=C/C=C Amb17772326 [2,0,0,0,0,0|1,0,1]=4 2272 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,1]=3 2273 B4R0.2 C=CNC=O Amb10844823 [2,0,0,0,0,0|1,0,1]=4 2274 B4R0.2 C=COC=O Amb22734253 [2,0,0,0,0,0|1,0,1]=4 2275 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 2276 B4R0.2 CC=C=CBr Amb17670638 [2,0,0,0,0,0|1,0,1]=4 2277 B4R0.2 CC=C=CC Amb17670597 [2,0,0,0,0,0|1,0,1]=4 2278 B4R0.2 CC=C=CCl Amb17670634 [2,0,0,0,0,0|1,0,1]=4 2279 B4R0.2 CC=C=CI Amb17673291 [2,0,0,0,0,0|1,0,1]=4 2280 B4R0.2 CCCCO Amb22336484 [2,0,0,0,0,0|0,0,2]=4 2281 B4R0.2 CCCCO Amb22338139 [2,0,0,0,0,0|0,0,2]=4 2282 B4R0.2 CCCCO Amb22338167 [2,0,0,0,0,0|0,0,2]=4 2283 B4R0.2 CCCCO Amb22351678 [2,0,0,0,0,0|0,0,2]=4 2284 B4R0.2 CCCNO Amb20621997 [2,0,0,0,0,0|1,0,1]=4 2285 B4R0.2 CCCNO Amb24333131 [2,0,0,0,0,0|1,0,1]=4 2286 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,1]=4 2287 B4R0.2 CCO[13CH]=O Amb22351501 [2,0,0,0,0,0|1,0,1]=4 2288 B4R0.2 CNCNO Amb24392932 [2,0,0,0,0,0|2,0,0]=4 2289 B4R0.2 COCC=C Amb10070248 [2,0,0,0,0,0|2,0,0]=4 2290 B4R0.2 COCCO Amb22338563 [2,0,0,0,0,0|1,0,1]=4 2291 B4R0.2 C[Se]CC=C Amb22735092 [2,0,0,0,0,0|2,0,0]=4 2292 B4R0.2 C\C=C/C=C Amb22731863 [2,0,0,0,0,0|1,0,1]=4 2293 B4R0.2 C\C=C/C=C Amb24477227 [2,0,0,0,0,0|1,0,1]=4 2294 B4R0.2 C\C=C/CO Amb24089436 [2,0,0,0,0,0|0,0,2]=4 2295 B4R0.2 ClCCC=O Amb16233605 [2,0,0,0,0,0|1,0,1]=4 2296 B4R0.2 Cl\C=C\C=O Amb17593041 [2,0,0,0,0,0|1,0,1]=4 2297 B4R0.2 NCCC=O Amb24476871 [2,0,0,0,0,0|1,0,1]=4 2298 B4R0.2 NNCC=O Amb24550561 [2,0,0,0,0,0|2,0,0]=4 2299 B4R0.2 N\C=C/C=O Amb25246630 [2,0,0,0,0,0|1,0,1]=4 2300 B4R0.2 N\C=C\C=O Amb24596377 [2,0,0,0,0,0|1,0,1]=4 2301 B4R0.2 O=CCCBr Amb18124460 [2,0,0,0,0,0|1,0,1]=4 2302 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,1]=4 2303 B4R0.2 O=CCN=O Amb24477338 [2,0,0,0,0,0|1,0,0]=3 2304 B4R0.2 O=CNC=O Amb25721263 [2,0,0,0,0,0|1,0,0]=3 2305 B4R0.2 O=C\C=C/Cl Amb25222856 [2,0,0,0,0,0|1,0,1]=4 2306 B4R0.2 O=C\C=C/S Amb24477332 [2,0,0,0,0,0|0,1,1]=4 2307 B4R0.2 O=C\C=C\Br Amb24477124 [2,0,0,0,0,0|1,0,1]=4 2308 B4R0.2 O=C\C=C\I Amb24477297 [2,0,0,0,0,0|1,0,1]=4 2309 B4R0.2 O=C\C=C\P Amb24670391 [2,0,0,0,0,0|1,0,1]=4 2310 B4R0.2 O=C\C=C\S Amb24756696 [2,0,0,0,0,0|0,1,1]=4 2311 B4R0.2 OC=C=CO Amb24412119 [2,0,0,0,0,0|0,0,2]=4 2312 B4R0.2 OCCC=O Amb24412391 [2,0,0,0,0,0|0,0,1]=3 2313 B4R0.2 OCOC=O Amb25694134 [2,0,0,0,0,0|1,0,1]=4 2314 B4R0.2 ON=CC=O Amb25746308 [2,0,0,0,0,0|1,0,1]=4 2315 B4R0.2 O\C=C/C=O Amb24567056 [2,0,0,0,0,0|0,0,1]=3 2316 B4R0.2 O\C=C\C=S Amb25057743 [2,0,0,0,0,0|0,1,1]=4 2317 B4R0.2 [13CH3]O[13CH2][13CH2]O Amb22337754 [2,0,0,0,0,0|1,0,1]=4 2318 B6R0.1 C=C(CCO)C=O Amb25278289 [1,1,0,0,0,0|0,0,2]=4 2319 B6R0.1 C=C(CCO)CO Amb25825219 [1,1,0,0,0,0|1,0,1]=4 2320 B6R0.1 C=C(CF)CCO Amb25334760 [1,1,0,0,0,0|1,0,1]=4 2321 B6R0.1 C=CC(=C)CC=O Amb18120478 [1,1,0,0,0,0|1,0,1]=4 2322 B6R0.1 C=CC(=O)NC=O Amb24580359 [1,1,0,0,0,0|1,0,1]=4 2323 B6R0.1 C=CCC(=C)C=O Amb18120415 [1,1,0,0,0,0|1,0,1]=4 2324 B6R0.1 C=CCC(=C)CBr Amb24692702 [1,1,0,0,0,0|2,0,0]=4 2325 B6R0.1 C=CCC(=C)CN Amb24551059 [1,1,0,0,0,0|2,0,0]=4 2326 B6R0.1 C=CCC(=C)CO Amb25854150 [1,1,0,0,0,0|1,0,1]=4 2327 B6R0.1 C=CCC(=O)CCl Amb25703593 [1,1,0,0,0,0|1,0,0]=3 2328 B6R0.1 C=CCC(=O)NN Amb24654386 [1,1,0,0,0,0|1,0,1]=4 2329 B6R0.1 C=CCC(O)C=O Amb25356720 [1,1,0,0,0,0|0,0,2]=4 2330 B6R0.1 C=CC[C@H](O)C=O Amb25813766 [1,1,0,0,0,0|0,0,2]=4 2331 B6R0.1 C=CNC(=O)NO Amb25339032 [1,1,0,0,0,0|1,0,1]=4 2332 B6R0.1 C=COC(=O)CBr Amb22732072 [1,1,0,0,0,0|2,0,0]=4 2333 B6R0.1 C=COC(=O)CCl Amb22045210 [1,1,0,0,0,0|2,0,0]=4 2334 B6R0.1 C=COC(=O)CI Amb17934194 [1,1,0,0,0,0|2,0,0]=4 2335 B6R0.1 CC(=CC=O)C#C Amb24513040 [1,1,0,0,0,0|1,0,1]=4 2336 B6R0.1 CC(C=O)=C=CCl Amb25765240 [1,1,0,0,0,0|1,0,1]=4 2337 B6R0.1 CC(CBr)CC=O Amb18126382 [1,1,0,0,0,0|1,0,1]=4 2338 B6R0.1 CC(CC=O)=C=C Amb24434894 [1,1,0,0,0,0|1,0,0]=3 2339 B6R0.1 CC(CC=O)C#N Amb18638919 [1,1,0,0,0,0|1,0,1]=4 2340 B6R0.1 CC(CC=O)C=C Amb18120863 [1,1,0,0,0,0|1,0,1]=4 2341 B6R0.1 CC(CC=O)C=O Amb18121376 [1,1,0,0,0,0|0,0,1]=3 2342 B6R0.1 CC(CCl)CC=O Amb24332851 [1,1,0,0,0,0|1,0,1]=4 2343 B6R0.1 CC(CO)CC=O Amb18639949 [1,1,0,0,0,0|0,0,2]=4 2344 B6R0.1 CC(OC)CC=O Amb17593089 [1,1,0,0,0,0|0,0,2]=4 2345 B6R0.1 CC=C(C)CCO Amb22229371 [1,1,0,0,0,0|1,0,1]=4 2346 B6R0.1 CCC(=C)CC=O Amb24445213 [1,1,0,0,0,0|1,0,0]=3 2347 B6R0.1 CCC(=C)CCO Amb25261191 [1,1,0,0,0,0|1,0,1]=4 2348 B6R0.1 CCC(=O)CC#C Amb17670735 [1,1,0,0,0,0|1,0,1]=4 2349 B6R0.1 CCC(=O)CC=O Amb24333311 [1,1,0,0,0,0|0,0,0]=2 2350 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|1,0,1]=4 2351 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|0,1,1]=4 2352 B6R0.1 CCC(=O)COC Amb19515551 [1,1,0,0,0,0|2,0,0]=4 2353 B6R0.1 CCC(=O)N=C=O Amb17231803 [1,1,0,0,0,0|1,0,1]=4 2354 B6R0.1 CCC(=O)NC=O Amb24480668 [1,1,0,0,0,0|1,0,0]=3 2355 B6R0.1 CCC(=O)OCO Amb25080504 [1,1,0,0,0,0|1,0,1]=4 2356 B6R0.1 CCC(=O)\C=C/N Amb24625829 [1,1,0,0,0,0|1,0,1]=4 2357 B6R0.1 CCC(=O)\C=C\Br Amb25286103 [1,1,0,0,0,0|1,0,1]=4 2358 B6R0.1 CCC(=O)\C=C\Cl Amb17593220 [1,1,0,0,0,0|1,0,1]=4 2359 B6R0.1 CCC(=O)\C=C\O Amb25326651 [1,1,0,0,0,0|0,0,1]=3 2360 B6R0.1 CCC(Cl)=CC=O Amb25224351 [1,1,0,0,0,0|1,0,1]=4 2361 B6R0.1 CCCC(=C)C=O Amb18639170 [1,1,0,0,0,0|1,0,1]=4 2362 B6R0.1 CCCC(=N)NO Amb10069022 [1,1,0,0,0,0|1,0,1]=4 2363 B6R0.1 CCCC(=O)C#C Amb25696103 [1,1,0,0,0,0|1,0,1]=4 2364 B6R0.1 CCCC(=O)C=O Amb18639569 [1,1,0,0,0,0|0,0,2]=4 2365 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|1,0,1]=4 2366 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|1,0,1]=4 2367 B6R0.1 CCCC(=O)CF Amb25370812 [1,1,0,0,0,0|1,0,1]=4 2368 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|1,0,1]=4 2369 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,1]=3 2370 B6R0.1 CCCC(=O)CS Amb24631668 [1,1,0,0,0,0|0,1,1]=4 2371 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|0,1,1]=4 2372 B6R0.1 CCCC(C)=NO Amb24693854 [1,1,0,0,0,0|1,0,1]=4 2373 B6R0.1 CCCC(O)C=O Amb24531721 [1,1,0,0,0,0|0,0,2]=4 2374 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [1,1,0,0,0,0|0,0,1]=3 2375 B6R0.1 CCC\C(\N)=N\O Amb19890174 [1,1,0,0,0,0|1,0,1]=4 2376 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,1]=4 2377 B6R0.1 CCNC(=O)ON Amb25108031 [1,1,0,0,0,0|1,0,1]=4 2378 B6R0.1 CC[C@H](C)CC=O Amb25805988 [1,1,0,0,0,0|1,0,1]=4 2379 B6R0.1 CN(CC=C)C=O Amb25169499 [1,1,0,0,0,0|2,0,0]=4 2380 B6R0.1 CN(CCO)C=O Amb25849655 [1,1,0,0,0,0|1,0,1]=4 2381 B6R0.1 CNC(=N)CCO Amb25114075 [1,1,0,0,0,0|1,0,1]=4 2382 B6R0.1 CNC(=O)C=NO Amb25113098 [1,1,0,0,0,0|1,0,1]=4 2383 B6R0.1 CNC(=O)CC#C Amb25084525 [1,1,0,0,0,0|1,0,1]=4 2384 B6R0.1 CNC(=O)CC#N Amb1152273 [1,1,0,0,0,0|1,0,1]=4 2385 B6R0.1 CNC(=O)CC=C Amb24479782 [1,1,0,0,0,0|1,0,0]=3 2386 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|1,0,1]=4 2387 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|1,0,1]=4 2388 B6R0.1 CNC(=O)CCI Amb25205915 [1,1,0,0,0,0|1,0,1]=4 2389 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|1,0,1]=4 2390 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|0,0,1]=3 2391 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|0,1,1]=4 2392 B6R0.1 CNC(=O)CNN Amb24744455 [1,1,0,0,0,0|2,0,0]=4 2393 B6R0.1 CNC(=O)CNO Amb24654673 [1,1,0,0,0,0|1,0,0]=3 2394 B6R0.1 CNC(=O)COC Amb22275885 [1,1,0,0,0,0|2,0,0]=4 2395 B6R0.1 CNC(=O)CON Amb22740185 [1,1,0,0,0,0|2,0,0]=4 2396 B6R0.1 CNC(=O)CON Amb25259147 [1,1,0,0,0,0|2,0,0]=4 2397 B6R0.1 CNC(=O)OC=C Amb24334277 [1,1,0,0,0,0|2,0,0]=4 2398 B6R0.1 CNC(=O)\C=C/Cl Amb25082264 [1,1,0,0,0,0|1,0,1]=4 2399 B6R0.1 CNC(=O)\C=C\Cl Amb25244140 [1,1,0,0,0,0|1,0,1]=4 2400 B6R0.1 CNCC(=O)C#C Amb25675071 [1,1,0,0,0,0|2,0,0]=4 2401 B6R0.1 CNCC(=O)CN Amb25218252 [1,1,0,0,0,0|2,0,0]=4 2402 B6R0.1 CNCC(=O)NC Amb2371052 [1,1,0,0,0,0|2,0,0]=4 2403 B6R0.1 CNCC(=O)NN Amb16186920 [1,1,0,0,0,0|2,0,0]=4 2404 B6R0.1 CNCC(=O)NO Amb24640961 [1,1,0,0,0,0|1,0,0]=3 2405 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,0]=3 2406 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,0]=3 2407 B6R0.1 CNCC(N)=NO Amb24648670 [1,1,0,0,0,0|2,0,0]=4 2408 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 2409 B6R0.1 COC(=C)CCO Amb25024469 [1,1,0,0,0,0|1,0,1]=4 2410 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|1,0,1]=4 2411 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|0,0,0]=2 2412 B6R0.1 COC(=O)CCF Amb22748635 [1,1,0,0,0,0|1,0,1]=4 2413 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,1]=4 2414 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,1]=4 2415 B6R0.1 COC(=O)CCN Amb22489470 [1,1,0,0,0,0|1,0,1]=4 2416 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 2417 B6R0.1 COC(=O)N=C=O Amb16233562 [1,1,0,0,0,0|1,0,1]=4 2418 B6R0.1 COC(=O)NC=C Amb24479688 [1,1,0,0,0,0|1,0,1]=4 2419 B6R0.1 COC(=O)NC=O Amb20242244 [1,1,0,0,0,0|1,0,0]=3 2420 B6R0.1 COC(=O)NOC Amb24480502 [1,1,0,0,0,0|2,0,0]=4 2421 B6R0.1 COC(=O)OCC Amb22732530 [1,1,0,0,0,0|1,0,1]=4 2422 B6R0.1 COC(=O)\C=C/Br Amb10067501 [1,1,0,0,0,0|1,0,1]=4 2423 B6R0.1 COC(=O)\C=C/I Amb2455616 [1,1,0,0,0,0|1,0,1]=4 2424 B6R0.1 COC(=O)\C=C\Br Amb24641633 [1,1,0,0,0,0|1,0,1]=4 2425 B6R0.1 COC(=O)\C=C\I Amb20241347 [1,1,0,0,0,0|1,0,1]=4 2426 B6R0.1 COC(=O)\C=C\S Amb25680634 [1,1,0,0,0,0|0,1,1]=4 2427 B6R0.1 COC(C)=CC=O Amb25328678 [1,1,0,0,0,0|0,0,2]=4 2428 B6R0.1 COCC(=C)CO Amb24523815 [1,1,0,0,0,0|2,0,0]=4 2429 B6R0.1 COCC(=N)NO Amb21858420 [1,1,0,0,0,0|2,0,0]=4 2430 B6R0.1 COCC(=O)C#N Amb25744731 [1,1,0,0,0,0|2,0,0]=4 2431 B6R0.1 COCC(=O)C=C Amb22168158 [1,1,0,0,0,0|2,0,0]=4 2432 B6R0.1 COCC(=O)CCl Amb24523799 [1,1,0,0,0,0|2,0,0]=4 2433 B6R0.1 COCC(=O)CN Amb18833134 [1,1,0,0,0,0|2,0,0]=4 2434 B6R0.1 COCC(=O)CO Amb24364722 [1,1,0,0,0,0|1,0,0]=3 2435 B6R0.1 COCC(=O)O[Na] Amb2227682 [1,1,0,0,0,0|1,0,0]=3 2436 B6R0.1 COCC(C)=NO Amb24530685 [1,1,0,0,0,0|2,0,0]=4 2437 B6R0.1 COCC(N)=S=O Amb25843320 [1,1,0,0,0,0|2,0,0]=4 2438 B6R0.1 COCC(O)C=O Amb18122318 [1,1,0,0,0,0|1,0,1]=4 2439 B6R0.1 COS(=O)CCO Amb25713675 [1,1,0,0,0,0|1,0,1]=4 2440 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [1,1,0,0,0,0|1,0,0]=3 2441 B6R0.1 CO\C(\C)=C/C=O Amb25326199 [1,1,0,0,0,0|0,0,2]=4 2442 B6R0.1 CO\C(\C)=C\C=O Amb18121410 [1,1,0,0,0,0|0,0,2]=4 2443 B6R0.1 CSC(=C)CCO Amb24617472 [1,1,0,0,0,0|1,0,1]=4 2444 B6R0.1 CSC(=O)CCCl Amb24735675 [1,1,0,0,0,0|1,0,1]=4 2445 B6R0.1 CSC(=O)N=C=O Amb25311166 [1,1,0,0,0,0|1,0,1]=4 2446 B6R0.1 CSCC(=O)NN Amb22058723 [1,1,0,0,0,0|2,0,0]=4 2447 B6R0.1 CSCC(C)=NO Amb25316343 [1,1,0,0,0,0|2,0,0]=4 2448 B6R0.1 C[C@@H](CC=O)C=C Amb25746367 [1,1,0,0,0,0|1,0,1]=4 2449 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,0]=3 2450 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,0]=3 2451 B6R0.1 C\C(=C/C=O)\C#C Amb24332623 [1,1,0,0,0,0|1,0,1]=4 2452 B6R0.1 C\C(=C/C=O)\C#N Amb24736052 [1,1,0,0,0,0|1,0,1]=4 2453 B6R0.1 C\C(=C\C=O)\C#C Amb25081454 [1,1,0,0,0,0|1,0,1]=4 2454 B6R0.1 C\C(\C=C)=C/C=O Amb25695541 [1,1,0,0,0,0|1,0,1]=4 2455 B6R0.1 C\C(\C=C)=C\C=O Amb18638879 [1,1,0,0,0,0|1,0,1]=4 2456 B6R0.1 C\C(\C=O)=C/C=C Amb24559820 [1,1,0,0,0,0|1,0,1]=4 2457 B6R0.1 C\C(\C=O)=C\C=C Amb18638851 [1,1,0,0,0,0|1,0,1]=4 2458 B6R0.1 C\C(\C=O)=C\CO Amb18639610 [1,1,0,0,0,0|0,0,2]=4 2459 B6R0.1 C\C(\CBr)=C\C=O Amb18645750 [1,1,0,0,0,0|1,0,1]=4 2460 B6R0.1 C\C(\CC)=C\C=O Amb18120877 [1,1,0,0,0,0|1,0,1]=4 2461 B6R0.1 C\C(\CCl)=C\C=O Amb25326191 [1,1,0,0,0,0|1,0,1]=4 2462 B6R0.1 C\C(\CO)=C/C=O Amb24417925 [1,1,0,0,0,0|0,0,2]=4 2463 B6R0.1 C\C=C(/C)\CC=C Amb24479822 [1,1,0,0,0,0|2,0,0]=4 2464 B6R0.1 C\C=C(/C)\CC=O Amb18120886 [1,1,0,0,0,0|1,0,0]=3 2465 B6R0.1 C\C=C(/C)\CCO Amb24674649 [1,1,0,0,0,0|1,0,1]=4 2466 B6R0.1 C\C=C(\C)/CC=C Amb24099383 [1,1,0,0,0,0|2,0,0]=4 2467 B6R0.1 C\C=C/C(=O)CO Amb24530239 [1,1,0,0,0,0|0,0,1]=3 2468 B6R0.1 C\C=C\C(=C)OC Amb25333090 [1,1,0,0,0,0|1,0,1]=4 2469 B6R0.1 C\C=C\C(=N)NO Amb25024615 [1,1,0,0,0,0|1,0,1]=4 2470 B6R0.1 C\C=C\C(=O)C=C Amb25745529 [1,1,0,0,0,0|1,0,1]=4 2471 B6R0.1 C\C=C\C(=O)CO Amb24633379 [1,1,0,0,0,0|0,0,1]=3 2472 B6R0.1 C\C=C\C(=O)NC Amb25067932 [1,1,0,0,0,0|1,0,1]=4 2473 B6R0.1 C\C=C\C(=O)NN Amb25796185 [1,1,0,0,0,0|1,0,1]=4 2474 B6R0.1 C\C=C\C(=O)NO Amb25076258 [1,1,0,0,0,0|0,0,1]=3 2475 B6R0.1 ClC=CC(=O)CCl Amb13952715 [1,1,0,0,0,0|1,0,1]=4 2476 B6R0.1 N#CC(=O)CCO Amb25730943 [1,1,0,0,0,0|0,0,2]=4 2477 B6R0.1 N#CCC(=O)CBr Amb23453421 [1,1,0,0,0,0|1,0,1]=4 2478 B6R0.1 NCC(=O)CCN Amb18121893 [1,1,0,0,0,0|1,0,1]=4 2479 B6R0.1 NCC(=O)CCN Amb22227739 [1,1,0,0,0,0|1,0,1]=4 2480 B6R0.1 NCC(=O)CCN Amb22360700 [1,1,0,0,0,0|1,0,1]=4 2481 B6R0.1 NCC(=O)OCO Amb22233222 [1,1,0,0,0,0|1,0,1]=4 2482 B6R0.1 NCCC(=O)CBr Amb24479170 [1,1,0,0,0,0|1,0,1]=4 2483 B6R0.1 NCCC(=O)NO Amb22751684 [1,1,0,0,0,0|1,0,1]=4 2484 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|1,0,1]=4 2485 B6R0.1 O=C(CCCl)CCl Amb22395038 [1,1,0,0,0,0|1,0,1]=4 2486 B6R0.1 O=C(CCl)\C=C\Br Amb24595386 [1,1,0,0,0,0|1,0,1]=4 2487 B6R0.1 O=C(CCl)\C=C\Cl Amb20620940 [1,1,0,0,0,0|1,0,1]=4 2488 B6R0.1 O=CC(S)CC=O Amb25768520 [1,1,0,0,0,0|0,1,1]=4 2489 B6R0.1 O=CCC(Br)CBr Amb24671080 [1,1,0,0,0,0|1,0,1]=4 2490 B6R0.1 O=CNC(=O)CCl Amb25190070 [1,1,0,0,0,0|1,0,0]=3 2491 B6R0.1 O=NOC(=O)CCl Amb25759337 [1,1,0,0,0,0|2,0,0]=4 2492 B6R0.1 OCC(=O)CCO Amb24061314 [1,1,0,0,0,0|0,0,1]=3 2493 B6R0.1 OCC(=O)CCS Amb24332279 [1,1,0,0,0,0|0,1,1]=4 2494 B6R0.1 OCC(O)CC=O Amb25243032 [1,1,0,0,0,0|0,0,2]=4 2495 B6R0.1 OCCC(=O)CBr Amb25210851 [1,1,0,0,0,0|0,0,1]=3 2496 B6R0.1 OCCC(=O)CCl Amb24674169 [1,1,0,0,0,0|0,0,1]=3 2497 B6R0.1 OCCC(=O)CO Amb10603377 [1,1,0,0,0,0|0,0,1]=3 2498 B6R0.1 OCCS(=O)CC Amb10669566 [1,1,0,0,0,0|1,0,1]=4 2499 B6R0.1 OCNC(=O)CBr Amb25286051 [1,1,0,0,0,0|1,0,1]=4 2500 B6R0.1 OCNC(=O)CCl Amb1153096 [1,1,0,0,0,0|1,0,1]=4 2501 B6R0.1 OCNC(=O)CI Amb24374693 [1,1,0,0,0,0|1,0,1]=4 2502 B6R0.1 OC[C@H](O)CC=O Amb24595645 [1,1,0,0,0,0|0,0,2]=4 2503 B6R0.1 ON=CC(=O)CBr Amb25186952 [1,1,0,0,0,0|1,0,1]=4 2504 B6R0.1 O[C@@H](CC=O)C=O Amb25169555 [1,1,0,0,0,0|0,0,1]=3 2505 B6R0.1 O[C@@H](CCl)CC=O Amb25824190 [1,1,0,0,0,0|0,0,2]=4 2506 B6R0.1 O[C@H](CC=O)C=O Amb25373324 [1,1,0,0,0,0|0,0,1]=3 2507 B6R0.1 O\N=C\C(=O)CBr Amb24646452 [1,1,0,0,0,0|1,0,1]=4 2508 B6R0.3 C#CC(O)C(O)=O Amb22731622 [1,1,0,0,0,0|0,0,2]=4 2509 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [1,1,0,0,0,0|0,0,2]=4 2510 B6R0.3 C=C(C=C)C(O)=O Amb24394371 [1,1,0,0,0,0|0,0,2]=4 2511 B6R0.3 C=CC(=O)C(O)=O Amb22011796 [1,1,0,0,0,0|0,0,2]=4 2512 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [1,1,0,0,0,0|0,0,1]=3 2513 B6R0.3 C=CC(Cl)C(N)=O Amb24479818 [1,1,0,0,0,0|1,0,1]=4 2514 B6R0.3 C=CC(N)C(N)=O Amb24689093 [1,1,0,0,0,0|1,0,1]=4 2515 B6R0.3 C=CC(N)C(O)=O Amb20240543 [1,1,0,0,0,0|0,0,1]=3 2516 B6R0.3 C=CC(O)C(O)=O Amb24061247 [1,1,0,0,0,0|0,0,1]=3 2517 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [1,1,0,0,0,0|0,0,1]=3 2518 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [1,1,0,0,0,0|0,0,1]=3 2519 B6R0.3 C=C[C@@H](O)C(N)=O Amb25791152 [1,1,0,0,0,0|1,0,1]=4 2520 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [1,1,0,0,0,0|0,0,1]=3 2521 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [1,1,0,0,0,0|0,0,1]=3 2522 B6R0.3 CC(=C)C(Br)CO Amb25707965 [1,1,0,0,0,0|1,0,1]=4 2523 B6R0.3 CC(=C)C(O)C=C Amb25234791 [1,1,0,0,0,0|2,0,0]=4 2524 B6R0.3 CC(=C)C(O)C=O Amb24457056 [1,1,0,0,0,0|1,0,0]=3 2525 B6R0.3 CC(=C)C(O)CO Amb23570510 [1,1,0,0,0,0|1,0,1]=4 2526 B6R0.3 CC(=C)[C@@H](N)CO Amb25693320 [1,1,0,0,0,0|1,0,1]=4 2527 B6R0.3 CC(=C)[C@@H](O)C=C Amb24332743 [1,1,0,0,0,0|2,0,0]=4 2528 B6R0.3 CC(=C)[C@@H](O)CO Amb25747414 [1,1,0,0,0,0|1,0,1]=4 2529 B6R0.3 CC(=C)[C@H](O)C=C Amb25129819 [1,1,0,0,0,0|2,0,0]=4 2530 B6R0.3 CC(=C)[C@H](O)CO Amb24439174 [1,1,0,0,0,0|1,0,1]=4 2531 B6R0.3 CC(=CCl)C(C)=O Amb25807396 [1,1,0,0,0,0|1,0,1]=4 2532 B6R0.3 CC(=CCl)C(O)=O Amb25692582 [1,1,0,0,0,0|1,0,1]=4 2533 B6R0.3 CC(=CN)C(C)=O Amb25804374 [1,1,0,0,0,0|1,0,1]=4 2534 B6R0.3 CC(=CN)C(O)=O Amb25375168 [1,1,0,0,0,0|1,0,1]=4 2535 B6R0.3 CC(=CO)C(C)=O Amb25377802 [1,1,0,0,0,0|0,0,1]=3 2536 B6R0.3 CC(=CO)C(O)=O Amb25745269 [1,1,0,0,0,0|0,0,2]=4 2537 B6R0.3 CC(=O)C(=C)CO Amb24571845 [1,1,0,0,0,0|0,0,2]=4 2538 B6R0.3 CC(=O)C(=O)C=C Amb25169560 [1,1,0,0,0,0|1,0,1]=4 2539 B6R0.3 CC(=O)C(=O)C=O Amb25281133 [1,1,0,0,0,0|0,0,1]=3 2540 B6R0.3 CC(=O)C(Br)=CCl Amb25173100 [1,1,0,0,0,0|1,0,1]=4 2541 B6R0.3 CC(=O)C(Br)=CO Amb25233141 [1,1,0,0,0,0|0,0,1]=3 2542 B6R0.3 CC(=O)C(Br)=NO Amb25811082 [1,1,0,0,0,0|1,0,1]=4 2543 B6R0.3 CC(=O)C(Br)C#N Amb23453422 [1,1,0,0,0,0|1,0,1]=4 2544 B6R0.3 CC(=O)C(Br)CO Amb24649743 [1,1,0,0,0,0|0,0,1]=3 2545 B6R0.3 CC(=O)C(Br)N=O Amb24332992 [1,1,0,0,0,0|1,0,0]=3 2546 B6R0.3 CC(=O)C(C)=C=O Amb25735802 [1,1,0,0,0,0|0,0,2]=4 2547 B6R0.3 CC(=O)C(Cl)=CBr Amb25811590 [1,1,0,0,0,0|1,0,1]=4 2548 B6R0.3 CC(=O)C(Cl)=CCl Amb24078667 [1,1,0,0,0,0|1,0,1]=4 2549 B6R0.3 CC(=O)C(Cl)=NO Amb25790855 [1,1,0,0,0,0|1,0,1]=4 2550 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [1,1,0,0,0,0|1,0,1]=4 2551 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [1,1,0,0,0,0|0,0,1]=3 2552 B6R0.3 CC(=O)C(F)CO Amb24725289 [1,1,0,0,0,0|0,0,1]=3 2553 B6R0.3 CC(=O)C(N)=CO Amb25264865 [1,1,0,0,0,0|0,0,1]=3 2554 B6R0.3 CC(=O)C(N)C#N Amb25304788 [1,1,0,0,0,0|1,0,1]=4 2555 B6R0.3 CC(=O)C(N)CN Amb24479898 [1,1,0,0,0,0|1,0,1]=4 2556 B6R0.3 CC(=O)C(N)CO Amb18640011 [1,1,0,0,0,0|0,0,1]=3 2557 B6R0.3 CC(=O)C(N)CS Amb24479874 [1,1,0,0,0,0|0,1,1]=4 2558 B6R0.3 CC(=O)C(O)=CO Amb25302267 [1,1,0,0,0,0|0,0,1]=3 2559 B6R0.3 CC(=O)C(O)C#N Amb25094307 [1,1,0,0,0,0|1,0,1]=4 2560 B6R0.3 CC(=O)C(O)C=O Amb24715304 [1,1,0,0,0,0|0,0,0]=2 2561 B6R0.3 CC(=O)C(O)CN Amb24636554 [1,1,0,0,0,0|1,0,1]=4 2562 B6R0.3 CC(=O)C([Na])C#N Amb25662498 [1,1,0,0,0,0|1,0,1]=4 2563 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [1,1,0,0,0,0|0,0,0]=2 2564 B6R0.3 CC(=O)N(C)N=O Amb25259815 [1,1,0,0,0,0|2,0,0]=4 2565 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [1,1,0,0,0,0|0,0,1]=3 2566 B6R0.3 CC(=O)[C@@H](O)C=C Amb25662172 [1,1,0,0,0,0|1,0,0]=3 2567 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [1,1,0,0,0,0|1,0,1]=4 2568 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,1,0,0,0,0|0,0,1]=3 2569 B6R0.3 CC(=O)[C@H](O)C=C Amb24480657 [1,1,0,0,0,0|1,0,0]=3 2570 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [1,1,0,0,0,0|1,0,1]=4 2571 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [1,1,0,0,0,0|0,0,1]=3 2572 B6R0.3 CC(=O)\C(=C\O)\Br Amb17232510 [1,1,0,0,0,0|0,0,1]=3 2573 B6R0.3 CC(=O)\C(\Br)=C\N Amb25710227 [1,1,0,0,0,0|1,0,1]=4 2574 B6R0.3 CC(=O)\C(\Br)=N\O Amb25233762 [1,1,0,0,0,0|1,0,1]=4 2575 B6R0.3 CC(=O)\C(\Cl)=C/C Amb24736181 [1,1,0,0,0,0|1,0,1]=4 2576 B6R0.3 CC(=O)\C(\Cl)=N/O Amb24436488 [1,1,0,0,0,0|1,0,1]=4 2577 B6R0.3 CC(=O)\C(\O)=C\O Amb24621662 [1,1,0,0,0,0|0,0,1]=3 2578 B6R0.3 CC(Br)C(Cl)C=O Amb25828586 [1,1,0,0,0,0|1,0,1]=4 2579 B6R0.3 CC(C#C)C(O)=O Amb25085390 [1,1,0,0,0,0|0,0,2]=4 2580 B6R0.3 CC(C(=O)C)CO Amb10844844 [1,1,0,0,0,0|0,0,1]=3 2581 B6R0.3 CC(C(=O)O)C#N Amb17210512 [1,1,0,0,0,0|1,0,1]=4 2582 B6R0.3 CC(C)=C(Br)C=O Amb18645747 [1,1,0,0,0,0|1,0,1]=4 2583 B6R0.3 CC(C)=C(C)C=O Amb18639155 [1,1,0,0,0,0|1,0,1]=4 2584 B6R0.3 CC(C)=C(Cl)C=O Amb18640665 [1,1,0,0,0,0|1,0,1]=4 2585 B6R0.3 CC(C)C(Cl)C=O Amb18123761 [1,1,0,0,0,0|1,0,1]=4 2586 B6R0.3 CC(C)C(I)C=O Amb25745826 [1,1,0,0,0,0|1,0,1]=4 2587 B6R0.3 CC(C)C(N)C=O Amb25063407 [1,1,0,0,0,0|1,0,1]=4 2588 B6R0.3 CC(C)C(S)C=O Amb25827516 [1,1,0,0,0,0|1,0,1]=4 2589 B6R0.3 CC(C)[C@@H](Cl)C=O Amb25189961 [1,1,0,0,0,0|1,0,1]=4 2590 B6R0.3 CC(C)[C@@H](F)C=O Amb25358933 [1,1,0,0,0,0|1,0,1]=4 2591 B6R0.3 CC(C)[C@@H](I)C=O Amb24695477 [1,1,0,0,0,0|1,0,1]=4 2592 B6R0.3 CC(C)[C@H](Br)C=O Amb25360935 [1,1,0,0,0,0|1,0,1]=4 2593 B6R0.3 CC(C)[C@H](Cl)C=O Amb25053420 [1,1,0,0,0,0|1,0,1]=4 2594 B6R0.3 CC(C)[C@H](F)C=O Amb25169558 [1,1,0,0,0,0|1,0,1]=4 2595 B6R0.3 CC(C)[C@H](O)C=O Amb25292428 [1,1,0,0,0,0|1,0,1]=4 2596 B6R0.3 CC(C=C)C(C)=C Amb22228297 [1,1,0,0,0,0|2,0,0]=4 2597 B6R0.3 CC(C=C)C(O)=O Amb21618706 [1,1,0,0,0,0|0,0,1]=3 2598 B6R0.3 CC(C=O)=C(C)Br Amb25309571 [1,1,0,0,0,0|1,0,1]=4 2599 B6R0.3 CC(C=O)=C(C)S Amb24513083 [1,1,0,0,0,0|0,1,1]=4 2600 B6R0.3 CC(C=O)C(C)=C Amb18639176 [1,1,0,0,0,0|1,0,0]=3 2601 B6R0.3 CC(C=O)C(C)=O Amb18639572 [1,1,0,0,0,0|0,0,0]=2 2602 B6R0.3 CC(C=O)C(N)=O Amb24479831 [1,1,0,0,0,0|1,0,0]=3 2603 B6R0.3 CC(C=O)N(C)C Amb25771612 [1,1,0,0,0,0|2,0,0]=4 2604 B6R0.3 CC(CBr)C(C)=O Amb25296678 [1,1,0,0,0,0|1,0,1]=4 2605 B6R0.3 CC(CBr)C(O)=O Amb22002601 [1,1,0,0,0,0|1,0,1]=4 2606 B6R0.3 CC(CCl)C(O)=O Amb18522181 [1,1,0,0,0,0|1,0,1]=4 2607 B6R0.3 CC(CF)C(C)=O Amb25253758 [1,1,0,0,0,0|1,0,1]=4 2608 B6R0.3 CC(CF)C(O)=O Amb24432331 [1,1,0,0,0,0|1,0,1]=4 2609 B6R0.3 CC(CI)C(O)=O Amb25695307 [1,1,0,0,0,0|1,0,1]=4 2610 B6R0.3 CC(CN)C(C)=O Amb18639690 [1,1,0,0,0,0|1,0,1]=4 2611 B6R0.3 CC(CO)C(C)=C Amb24539367 [1,1,0,0,0,0|1,0,1]=4 2612 B6R0.3 CC(CO)C([O-])=O Amb24123145 [1,1,0,0,0,0|1,0,1]=4 2613 B6R0.3 CC(CO)S(C)=O Amb25173825 [1,1,0,0,0,0|1,0,1]=4 2614 B6R0.3 CC(CS)C(C)=O Amb25830693 [1,1,0,0,0,0|0,1,1]=4 2615 B6R0.3 CC(Cl)C(Br)C=O Amb25258050 [1,1,0,0,0,0|1,0,1]=4 2616 B6R0.3 CC(Cl)C(Cl)C=O Amb18643662 [1,1,0,0,0,0|1,0,1]=4 2617 B6R0.3 CC(N=C)C(O)=O Amb24591339 [1,1,0,0,0,0|1,0,1]=4 2618 B6R0.3 CC(NBr)C(O)=O Amb24677636 [1,1,0,0,0,0|2,0,0]=4 2619 B6R0.3 CC(NCl)C(O)=O Amb25267473 [1,1,0,0,0,0|2,0,0]=4 2620 B6R0.3 CC(NN)C(O)=O Amb18640367 [1,1,0,0,0,0|2,0,0]=4 2621 B6R0.3 CC(O)=C(Br)C=O Amb25810089 [1,1,0,0,0,0|0,0,2]=4 2622 B6R0.3 CC(O)=C(O)C=O Amb25747147 [1,1,0,0,0,0|0,0,2]=4 2623 B6R0.3 CC(O)C(Br)C=O Amb25702152 [1,1,0,0,0,0|0,0,2]=4 2624 B6R0.3 CC(O)C(N)C=O Amb24480424 [1,1,0,0,0,0|0,0,2]=4 2625 B6R0.3 CC(O)C(O)C=O Amb18122303 [1,1,0,0,0,0|0,0,2]=4 2626 B6R0.3 CC(ON)C(O)=O Amb24479235 [1,1,0,0,0,0|2,0,0]=4 2627 B6R0.3 CCC(=C)C(O)=O Amb18639591 [1,1,0,0,0,0|0,0,2]=4 2628 B6R0.3 CCC(=O)C(O)=O Amb22274199 [1,1,0,0,0,0|0,0,2]=4 2629 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,1,0,0,0,0|1,0,1]=4 2630 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,1,0,0,0,0|1,0,1]=4 2631 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [1,1,0,0,0,0|1,0,1]=4 2632 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [1,1,0,0,0,0|1,0,1]=4 2633 B6R0.3 CCC(C(=O)N)Br Amb13952819 [1,1,0,0,0,0|1,0,1]=4 2634 B6R0.3 CCC(C(=O)N)N Amb1914080 [1,1,0,0,0,0|1,0,1]=4 2635 B6R0.3 CCC(C(=O)O)S Amb17501370 [1,1,0,0,0,0|0,0,1]=3 2636 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,1,0,0,0,0|1,0,1]=4 2637 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,1,0,0,0,0|1,0,1]=4 2638 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,1,0,0,0,0|1,0,1]=4 2639 B6R0.3 CCC(F)C(C)=O Amb24736393 [1,1,0,0,0,0|1,0,1]=4 2640 B6R0.3 CCC(F)C(N)=O Amb25811426 [1,1,0,0,0,0|1,0,1]=4 2641 B6R0.3 CCC(F)C(O)=O Amb25716167 [1,1,0,0,0,0|0,0,1]=3 2642 B6R0.3 CCC(I)C(N)=O Amb25131171 [1,1,0,0,0,0|1,0,1]=4 2643 B6R0.3 CCC(N)C(=O)S Amb24479075 [1,1,0,0,0,0|0,1,1]=4 2644 B6R0.3 CCC(N)C(C)=O Amb18202785 [1,1,0,0,0,0|1,0,1]=4 2645 B6R0.3 CCC(N)P(O)=O Amb25269903 [1,1,0,0,0,0|1,0,1]=4 2646 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,1,0,0,0,0|1,0,1]=4 2647 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,1,0,0,0,0|1,0,1]=4 2648 B6R0.3 CCC(O)C(O)=O Amb22352315 [1,1,0,0,0,0|0,0,1]=3 2649 B6R0.3 CCC(O)C(O)=O Amb22360643 [1,1,0,0,0,0|0,0,1]=3 2650 B6R0.3 CCC(O)C([O-])=O Amb17943026 [1,1,0,0,0,0|0,0,2]=4 2651 B6R0.3 CCC(O)C([O-])=O Amb24325325 [1,1,0,0,0,0|0,0,2]=4 2652 B6R0.3 CCC(O)P(O)=O Amb25169578 [1,1,0,0,0,0|1,0,1]=4 2653 B6R0.3 CCC(S)C(N)=O Amb24479879 [1,1,0,0,0,0|1,0,1]=4 2654 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [1,1,0,0,0,0|1,0,1]=4 2655 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [1,1,0,0,0,0|1,0,1]=4 2656 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [1,1,0,0,0,0|1,0,1]=4 2657 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [1,1,0,0,0,0|1,0,1]=4 2658 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,1,0,0,0,0|1,0,1]=4 2659 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [1,1,0,0,0,0|0,0,1]=3 2660 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [1,1,0,0,0,0|0,0,1]=3 2661 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,1,0,0,0,0|1,0,1]=4 2662 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,1,0,0,0,0|1,0,1]=4 2663 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [1,1,0,0,0,0|1,0,1]=4 2664 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [1,1,0,0,0,0|0,0,1]=3 2665 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [1,1,0,0,0,0|1,0,1]=4 2666 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [1,1,0,0,0,0|0,0,1]=3 2667 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [1,1,0,0,0,0|0,0,1]=3 2668 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [1,1,0,0,0,0|1,0,1]=4 2669 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [1,1,0,0,0,0|1,0,1]=4 2670 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [1,1,0,0,0,0|0,0,1]=3 2671 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [1,1,0,0,0,0|0,0,1]=3 2672 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [1,1,0,0,0,0|1,0,1]=4 2673 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [1,1,0,0,0,0|1,0,1]=4 2674 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [1,1,0,0,0,0|1,0,1]=4 2675 B6R0.3 CNC(=C)C(O)=O Amb25743212 [1,1,0,0,0,0|1,0,1]=4 2676 B6R0.3 CNC(=N)C(O)=O Amb18639921 [1,1,0,0,0,0|1,0,1]=4 2677 B6R0.3 CNC(=S)C(O)=O Amb24479905 [1,1,0,0,0,0|1,0,1]=4 2678 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,1,0,0,0,0|2,0,0]=4 2679 B6R0.3 CNC(C)C(O)=O Amb19373699 [1,1,0,0,0,0|1,0,0]=3 2680 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,1,0,0,0,0|2,0,0]=4 2681 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,1,0,0,0,0|2,0,0]=4 2682 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,1,0,0,0,0|2,0,0]=4 2683 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,1,0,0,0,0|2,0,0]=4 2684 B6R0.3 COC(=C)C(O)=O Amb18639906 [1,1,0,0,0,0|1,0,1]=4 2685 B6R0.3 COC(=O)C(O)=O Amb22011503 [1,1,0,0,0,0|1,0,1]=4 2686 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,1,0,0,0,0|2,0,0]=4 2687 B6R0.3 COC(N)C(N)=O Amb25178891 [1,1,0,0,0,0|2,0,0]=4 2688 B6R0.3 COC(N)C(O)=O Amb24621851 [1,1,0,0,0,0|1,0,0]=3 2689 B6R0.3 COC(O)C(O)=O Amb24479754 [1,1,0,0,0,0|1,0,0]=3 2690 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [1,1,0,0,0,0|2,0,0]=4 2691 B6R0.3 CSC(=O)C(O)=O Amb24731100 [1,1,0,0,0,0|1,0,1]=4 2692 B6R0.3 CSC(=S)C(O)=O Amb25702678 [1,1,0,0,0,0|1,0,1]=4 2693 B6R0.3 CSC(Br)C(O)=O Amb25169549 [1,1,0,0,0,0|1,0,0]=3 2694 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [1,1,0,0,0,0|2,0,0]=4 2695 B6R0.3 CSC(F)C(O)=O Amb25043740 [1,1,0,0,0,0|1,0,0]=3 2696 B6R0.3 CSC(O)C(C)=O Amb24479166 [1,1,0,0,0,0|2,0,0]=4 2697 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [1,1,0,0,0,0|1,0,0]=3 2698 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [1,1,0,0,0,0|1,0,1]=4 2699 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [1,1,0,0,0,0|1,0,0]=3 2700 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [1,1,0,0,0,0|1,0,0]=3 2701 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [1,1,0,0,0,0|0,0,0]=2 2702 B6R0.3 C[C@@H](C=O)[C@@H](C)O Amb25714216 [1,1,0,0,0,0|0,0,2]=4 2703 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [1,1,0,0,0,0|1,0,1]=4 2704 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [1,1,0,0,0,0|1,0,1]=4 2705 B6R0.3 C[C@@H](CO)C(C)=C Amb25025795 [1,1,0,0,0,0|1,0,1]=4 2706 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [1,1,0,0,0,0|0,0,1]=3 2707 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [1,1,0,0,0,0|0,1,1]=4 2708 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [1,1,0,0,0,0|2,0,0]=4 2709 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [1,1,0,0,0,0|1,0,1]=4 2710 B6R0.3 C[C@@H](O)[C@H](O)C=O Amb24398705 [1,1,0,0,0,0|0,0,2]=4 2711 B6R0.3 C[C@H](Br)[C@H](Cl)C=O Amb25779134 [1,1,0,0,0,0|1,0,1]=4 2712 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [1,1,0,0,0,0|2,0,0]=4 2713 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [1,1,0,0,0,0|1,0,1]=4 2714 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [1,1,0,0,0,0|1,0,0]=3 2715 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [1,1,0,0,0,0|0,0,0]=2 2716 B6R0.3 C[C@H](C=O)N(C)C Amb24333507 [1,1,0,0,0,0|2,0,0]=4 2717 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [1,1,0,0,0,0|1,0,1]=4 2718 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [1,1,0,0,0,0|1,0,1]=4 2719 B6R0.3 C[C@H](CO)S(C)=O Amb24334035 [1,1,0,0,0,0|1,0,1]=4 2720 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [1,1,0,0,0,0|0,1,1]=4 2721 B6R0.3 C[C@H](Cl)[C@H](Br)C=O Amb24479005 [1,1,0,0,0,0|1,0,1]=4 2722 B6R0.3 C[C@H](Cl)[C@H](Cl)C=O Amb25810801 [1,1,0,0,0,0|1,0,1]=4 2723 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [1,1,0,0,0,0|1,0,1]=4 2724 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [1,1,0,0,0,0|2,0,0]=4 2725 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [1,1,0,0,0,0|2,0,0]=4 2726 B6R0.3 C\C(=C/Br)\C(C)=O Amb25061221 [1,1,0,0,0,0|1,0,1]=4 2727 B6R0.3 C\C(=C/N)\C(C)=O Amb24551470 [1,1,0,0,0,0|1,0,1]=4 2728 B6R0.3 C\C(=C/N)\C(O)=O Amb24507602 [1,1,0,0,0,0|1,0,1]=4 2729 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [1,1,0,0,0,0|0,0,2]=4 2730 B6R0.3 C\C(=C\C)\C(=O)Cl Amb25173910 [1,1,0,0,0,0|1,0,1]=4 2731 B6R0.3 C\C(=C\C)\C(C)=O Amb25718935 [1,1,0,0,0,0|1,0,1]=4 2732 B6R0.3 C\C(=C\O)\C(C)=O Amb24361303 [1,1,0,0,0,0|0,0,1]=3 2733 B6R0.3 C\C(=C\O)\C(N)=O Amb24479832 [1,1,0,0,0,0|1,0,1]=4 2734 B6R0.3 C\C(\C=O)=C(/C)\Br Amb18645749 [1,1,0,0,0,0|1,0,1]=4 2735 B6R0.3 C\C(\C=O)=C(/C)\Cl Amb18641884 [1,1,0,0,0,0|1,0,1]=4 2736 B6R0.3 C\C(\C=O)=C(/C)\S Amb18641908 [1,1,0,0,0,0|0,1,1]=4 2737 B6R0.3 C\C(\C=O)=C(\C)/Br Amb25257629 [1,1,0,0,0,0|1,0,1]=4 2738 B6R0.3 C\C(\O)=C(\O)/C=O Amb25119300 [1,1,0,0,0,0|0,0,2]=4 2739 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [1,1,0,0,0,0|0,0,1]=3 2740 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [1,1,0,0,0,0|0,0,1]=3 2741 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [1,1,0,0,0,0|0,0,1]=3 2742 B6R0.3 C\C=C(\N)/C(N)=O Amb24681313 [1,1,0,0,0,0|1,0,1]=4 2743 B6R0.3 C\C=C(\O)/C(N)=O Amb25314423 [1,1,0,0,0,0|1,0,1]=4 2744 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [1,1,0,0,0,0|1,0,1]=4 2745 B6R0.3 NC(=O)C(F)CO Amb24507432 [1,1,0,0,0,0|1,0,1]=4 2746 B6R0.3 NC(=O)N(O)C=O Amb24479864 [1,1,0,0,0,0|2,0,0]=4 2747 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [1,1,0,0,0,0|1,0,1]=4 2748 B6R0.3 NC(C#N)C(O)=O Amb25328320 [1,1,0,0,0,0|1,0,1]=4 2749 B6R0.3 NC(C(=O)N)CO Amb17593097 [1,1,0,0,0,0|1,0,1]=4 2750 B6R0.3 NC(C(=O)O)CF Amb10839589 [1,1,0,0,0,0|1,0,1]=4 2751 B6R0.3 NC(C(=O)O)CS Amb13961966 [1,1,0,0,0,0|0,1,1]=4 2752 B6R0.3 NC(C=O)C(O)=O Amb24349579 [1,1,0,0,0,0|0,0,0]=2 2753 B6R0.3 NC(C=S)C(O)=O Amb25227802 [1,1,0,0,0,0|0,1,0]=3 2754 B6R0.3 NC(CCl)C(O)=O Amb19651457 [1,1,0,0,0,0|1,0,1]=4 2755 B6R0.3 NC(CCl)C(O)=O Amb21961077 [1,1,0,0,0,0|1,0,1]=4 2756 B6R0.3 NC(CI)C(O)=O Amb25177412 [1,1,0,0,0,0|1,0,1]=4 2757 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [1,1,0,0,0,0|0,0,2]=4 2758 B6R0.3 NC(CS)C(O)=O Amb22489523 [1,1,0,0,0,0|0,1,1]=4 2759 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [1,1,0,0,0,0|0,1,1]=4 2760 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [1,1,0,0,0,0|1,0,1]=4 2761 B6R0.3 NCC(C(=O)O)S Amb17593238 [1,1,0,0,0,0|1,0,1]=4 2762 B6R0.3 NCC(F)C(O)=O Amb22733051 [1,1,0,0,0,0|1,0,1]=4 2763 B6R0.3 NCC(N)C(O)=O Amb22899095 [1,1,0,0,0,0|1,0,1]=4 2764 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [1,1,0,0,0,0|1,0,1]=4 2765 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [1,1,0,0,0,0|1,0,1]=4 2766 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [1,1,0,0,0,0|1,0,1]=4 2767 B6R0.3 NOC(F)C(O)=O Amb24446310 [1,1,0,0,0,0|2,0,0]=4 2768 B6R0.3 NOC(O)C(O)=O Amb24735537 [1,1,0,0,0,0|2,0,0]=4 2769 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [1,1,0,0,0,0|1,0,1]=4 2770 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [1,1,0,0,0,0|1,0,1]=4 2771 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [1,1,0,0,0,0|0,0,2]=4 2772 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [1,1,0,0,0,0|1,0,1]=4 2773 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [1,1,0,0,0,0|1,0,1]=4 2774 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [1,1,0,0,0,0|0,0,2]=4 2775 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [1,1,0,0,0,0|0,1,1]=4 2776 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [1,1,0,0,0,0|1,0,1]=4 2777 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [1,1,0,0,0,0|1,0,1]=4 2778 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [1,1,0,0,0,0|1,0,1]=4 2779 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [1,1,0,0,0,0|0,1,1]=4 2780 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [1,1,0,0,0,0|0,0,0]=2 2781 B6R0.3 O=CC(C(C)C)Br Amb17594091 [1,1,0,0,0,0|1,0,1]=4 2782 B6R0.3 O=CC(C(C)C)C Amb17593082 [1,1,0,0,0,0|1,0,1]=4 2783 B6R0.3 O=CC(C(C)C)O Amb17593092 [1,1,0,0,0,0|1,0,1]=4 2784 B6R0.3 OC(=CBr)C(O)=O Amb24479759 [1,1,0,0,0,0|1,0,1]=4 2785 B6R0.3 OC(=CS)C(O)=O Amb25340519 [1,1,0,0,0,0|0,1,1]=4 2786 B6R0.3 OC(=O)C(=O)C=O Amb25836179 [1,1,0,0,0,0|0,0,1]=3 2787 B6R0.3 OC(=O)C(Br)=CCl Amb24429120 [1,1,0,0,0,0|1,0,1]=4 2788 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [1,1,0,0,0,0|1,0,1]=4 2789 B6R0.3 OC(=O)C(CF)Br Amb10605519 [1,1,0,0,0,0|1,0,1]=4 2790 B6R0.3 OC(=O)C(Cl)=CBr Amb24478967 [1,1,0,0,0,0|1,0,1]=4 2791 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [1,1,0,0,0,0|0,0,0]=2 2792 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [1,1,0,0,0,0|1,0,1]=4 2793 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [1,1,0,0,0,0|1,0,1]=4 2794 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [1,1,0,0,0,0|1,0,1]=4 2795 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [1,1,0,0,0,0|0,1,1]=4 2796 B6R0.3 OC(=O)C(F)=CBr Amb24651069 [1,1,0,0,0,0|1,0,1]=4 2797 B6R0.3 OC(=O)C(F)=CCl Amb25805817 [1,1,0,0,0,0|1,0,1]=4 2798 B6R0.3 OC(=O)C(F)C=O Amb22055301 [1,1,0,0,0,0|0,0,0]=2 2799 B6R0.3 OC(=O)C(F)CF Amb24746801 [1,1,0,0,0,0|1,0,1]=4 2800 B6R0.3 OC(=O)C(S)=CS Amb24480963 [1,1,0,0,0,0|0,1,1]=4 2801 B6R0.3 OC(=O)C(S)CS Amb18643295 [1,1,0,0,0,0|0,1,1]=4 2802 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [1,1,0,0,0,0|1,0,1]=4 2803 B6R0.3 OC(=O)\C(=C/Cl)\Cl Amb17593560 [1,1,0,0,0,0|1,0,1]=4 2804 B6R0.3 OC(=O)\C(\Br)=C/Br Amb22469643 [1,1,0,0,0,0|1,0,1]=4 2805 B6R0.3 OC(=O)\C(\Cl)=C/O Amb24479774 [1,1,0,0,0,0|0,0,2]=4 2806 B6R0.3 OC(=O)\C(\F)=C\F Amb24393011 [1,1,0,0,0,0|1,0,1]=4 2807 B6R0.3 OC(C=O)C(O)=O Amb18640325 [1,1,0,0,0,0|0,0,0]=2 2808 B6R0.3 OC(CBr)C(O)=O Amb24061932 [1,1,0,0,0,0|1,0,1]=4 2809 B6R0.3 OC(CS)C(O)=O Amb18642053 [1,1,0,0,0,0|0,1,1]=4 2810 B6R0.3 OCC(Br)C(O)=O Amb18126327 [1,1,0,0,0,0|0,0,2]=4 2811 B6R0.3 OCC(C(=O)O)F Amb17593117 [1,1,0,0,0,0|0,0,2]=4 2812 B6R0.3 OCC(C(=O)O)O Amb17593103 [1,1,0,0,0,0|0,0,2]=4 2813 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [1,1,0,0,0,0|0,0,2]=4 2814 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [1,1,0,0,0,0|0,0,2]=4 2815 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [1,1,0,0,0,0|0,0,2]=4 2816 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [1,1,0,0,0,0|0,0,2]=4 2817 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [1,1,0,0,0,0|0,0,2]=4 2818 B6R0.3 ONC(O)C(O)=O Amb25832155 [1,1,0,0,0,0|1,0,1]=4 2819 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [1,1,0,0,0,0|1,0,1]=4 2820 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [1,1,0,0,0,0|1,0,1]=4 2821 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [1,1,0,0,0,0|0,1,1]=4 2822 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [1,1,0,0,0,0|1,0,1]=4 2823 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [1,1,0,0,0,0|0,0,1]=3 2824 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [1,1,0,0,0,0|0,1,1]=4 2825 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [1,1,0,0,0,0|0,0,2]=4 2826 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [1,1,0,0,0,0|1,0,1]=4 2827 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [1,1,0,0,0,0|1,0,1]=4 2828 B6R0.3 [O-]\C=C(/C(=O)C)\C Amb17617704 [1,1,0,0,0,0|0,0,2]=4 2829 B6R0.3 [O-]\C=C(\C(=O)C)/C Amb10552504 [1,1,0,0,0,0|0,0,2]=4 2830 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [1,1,0,0,0,0|0,0,2]=4 2831 B6R0.4 C=C(Br)CCC=O Amb18645745 [1,1,0,0,0,0|1,0,1]=4 2832 B6R0.4 C=C(Br)CNC=O Amb25169576 [1,1,0,0,0,0|1,0,1]=4 2833 B6R0.4 C=C(Cl)CCC=O Amb24525208 [1,1,0,0,0,0|1,0,1]=4 2834 B6R0.4 C=C(Cl)CNC=O Amb24376668 [1,1,0,0,0,0|1,0,1]=4 2835 B6R0.4 C=CC#CC(O)=O Amb24479724 [1,1,0,0,0,0|0,0,2]=4 2836 B6R0.4 C=CCSC(=O)Cl Amb22231425 [1,1,0,0,0,0|1,0,1]=4 2837 B6R0.4 C=COCC(N)=O Amb25075789 [1,1,0,0,0,0|1,0,1]=4 2838 B6R0.4 C=NCCC(O)=O Amb24480865 [1,1,0,0,0,0|0,0,2]=4 2839 B6R0.4 CC#CCC(N)=O Amb24761404 [1,1,0,0,0,0|1,0,1]=4 2840 B6R0.4 CC#CCC(O)=O Amb17939740 [1,1,0,0,0,0|0,0,1]=3 2841 B6R0.4 CC(=C)CCC=C Amb22228883 [1,1,0,0,0,0|2,0,0]=4 2842 B6R0.4 CC(=C)CCC=O Amb18120891 [1,1,0,0,0,0|1,0,0]=3 2843 B6R0.4 CC(=C)CCCO Amb22886814 [1,1,0,0,0,0|1,0,1]=4 2844 B6R0.4 CC(=C)CNC=O Amb24448470 [1,1,0,0,0,0|1,0,0]=3 2845 B6R0.4 CC(=C)CNC=S Amb25789831 [1,1,0,0,0,0|1,1,0]=4 2846 B6R0.4 CC(=C)C\C=C/Cl Amb24332781 [1,1,0,0,0,0|2,0,0]=4 2847 B6R0.4 CC(=C)C\C=C\Cl Amb24519433 [1,1,0,0,0,0|2,0,0]=4 2848 B6R0.4 CC(=C)NCC=C Amb24721856 [1,1,0,0,0,0|2,0,0]=4 2849 B6R0.4 CC(=C)NCCO Amb25127040 [1,1,0,0,0,0|1,0,1]=4 2850 B6R0.4 CC(=C)\C=C/C=O Amb25785232 [1,1,0,0,0,0|1,0,1]=4 2851 B6R0.4 CC(=C)\C=C\C=O Amb18120435 [1,1,0,0,0,0|1,0,1]=4 2852 B6R0.4 CC(=N)NCC=C Amb24618156 [1,1,0,0,0,0|2,0,0]=4 2853 B6R0.4 CC(=O)C=C=CBr Amb25772659 [1,1,0,0,0,0|1,0,1]=4 2854 B6R0.4 CC(=O)CC=C=C Amb25746318 [1,1,0,0,0,0|1,0,0]=3 2855 B6R0.4 CC(=O)CC=NO Amb25024487 [1,1,0,0,0,0|0,0,0]=2 2856 B6R0.4 CC(=O)CCC=O Amb18639597 [1,1,0,0,0,0|0,0,0]=2 2857 B6R0.4 CC(=O)CCC=S Amb25662155 [1,1,0,0,0,0|0,1,0]=3 2858 B6R0.4 CC(=O)CCCF Amb25068187 [1,1,0,0,0,0|1,0,1]=4 2859 B6R0.4 CC(=O)CCCI Amb25346994 [1,1,0,0,0,0|1,0,1]=4 2860 B6R0.4 CC(=O)CCCN Amb18121547 [1,1,0,0,0,0|1,0,1]=4 2861 B6R0.4 CC(=O)CCON Amb25186994 [1,1,0,0,0,0|0,0,1]=3 2862 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [1,1,0,0,0,0|2,0,0]=4 2863 B6R0.4 CC(=O)CNC=O Amb23442787 [1,1,0,0,0,0|0,0,0]=2 2864 B6R0.4 CC(=O)COC=O Amb24736861 [1,1,0,0,0,0|0,0,0]=2 2865 B6R0.4 CC(=O)CSC=C Amb24479150 [1,1,0,0,0,0|1,0,0]=3 2866 B6R0.4 CC(=O)C\C=C/Cl Amb25276014 [1,1,0,0,0,0|1,0,0]=3 2867 B6R0.4 CC(=O)C\C=C\Cl Amb25094325 [1,1,0,0,0,0|1,0,0]=3 2868 B6R0.4 CC(=O)C\C=N/O Amb25066399 [1,1,0,0,0,0|0,0,0]=2 2869 B6R0.4 CC(=O)N=CCO Amb24420730 [1,1,0,0,0,0|1,0,0]=3 2870 B6R0.4 CC(=O)NCC#C Amb20623038 [1,1,0,0,0,0|1,0,1]=4 2871 B6R0.4 CC(=O)NCC=O Amb25757509 [1,1,0,0,0,0|0,0,0]=2 2872 B6R0.4 CC(=O)NCCF Amb25832238 [1,1,0,0,0,0|1,0,1]=4 2873 B6R0.4 CC(=O)NCCI Amb25761166 [1,1,0,0,0,0|1,0,1]=4 2874 B6R0.4 CC(=O)NCCN Amb1218225 [1,1,0,0,0,0|1,0,1]=4 2875 B6R0.4 CC(=O)NCCS Amb22230992 [1,1,0,0,0,0|0,1,1]=4 2876 B6R0.4 CC(=O)NNC=O Amb25663184 [1,1,0,0,0,0|1,0,0]=3 2877 B6R0.4 CC(=O)OCCF Amb25123333 [1,1,0,0,0,0|1,0,1]=4 2878 B6R0.4 CC(=O)OCCI Amb17673987 [1,1,0,0,0,0|1,0,1]=4 2879 B6R0.4 CC(=O)OCCN Amb18121947 [1,1,0,0,0,0|1,0,1]=4 2880 B6R0.4 CC(=O)OCCP Amb25810695 [1,1,0,0,0,0|1,0,1]=4 2881 B6R0.4 CC(=O)ON=CCl Amb24677824 [1,1,0,0,0,0|2,0,0]=4 2882 B6R0.4 CC(=O)ON=CN Amb25732130 [1,1,0,0,0,0|2,0,0]=4 2883 B6R0.4 CC(=O)O\C=C/Cl Amb25190035 [1,1,0,0,0,0|1,0,1]=4 2884 B6R0.4 CC(=O)O\N=C/Cl Amb24373196 [1,1,0,0,0,0|2,0,0]=4 2885 B6R0.4 CC(=O)SCC=C Amb24531624 [1,1,0,0,0,0|1,0,0]=3 2886 B6R0.4 CC(=O)SCCBr Amb24608039 [1,1,0,0,0,0|1,0,1]=4 2887 B6R0.4 CC(=O)SCCCl Amb24746776 [1,1,0,0,0,0|1,0,1]=4 2888 B6R0.4 CC(=O)SCCN Amb21953963 [1,1,0,0,0,0|1,0,1]=4 2889 B6R0.4 CC(=O)SCCN Amb22011516 [1,1,0,0,0,0|1,0,1]=4 2890 B6R0.4 CC(=O)\C=C/C#C Amb24584422 [1,1,0,0,0,0|1,0,1]=4 2891 B6R0.4 CC(=O)\C=C\C#C Amb25735826 [1,1,0,0,0,0|1,0,1]=4 2892 B6R0.4 CC(=O)\C=C\C#N Amb18638658 [1,1,0,0,0,0|1,0,1]=4 2893 B6R0.4 CC(=O)\C=C\C=N Amb24722970 [1,1,0,0,0,0|1,0,1]=4 2894 B6R0.4 CC(=O)\C=C\C=O Amb18120765 [1,1,0,0,0,0|0,0,1]=3 2895 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,1,0,0,0,0|1,0,1]=4 2896 B6R0.4 CC(=O)\C=C\CO Amb24414835 [1,1,0,0,0,0|0,0,1]=3 2897 B6R0.4 CC(=S)NCC=C Amb25083646 [1,1,0,0,0,0|1,1,0]=4 2898 B6R0.4 CC(=S)NCCO Amb25747406 [1,1,0,0,0,0|0,1,1]=4 2899 B6R0.4 CC(=S)OCC=C Amb22230177 [1,1,0,0,0,0|1,1,0]=4 2900 B6R0.4 CC(Br)=CCCO Amb24734140 [1,1,0,0,0,0|1,0,1]=4 2901 B6R0.4 CC(Br)CCC=O Amb18645866 [1,1,0,0,0,0|1,0,1]=4 2902 B6R0.4 CC(Br)COC=O Amb24634016 [1,1,0,0,0,0|1,0,1]=4 2903 B6R0.4 CC(C)=C=CC=O Amb25082892 [1,1,0,0,0,0|1,0,1]=4 2904 B6R0.4 CC(C)=CC=CO Amb25746627 [1,1,0,0,0,0|1,0,1]=4 2905 B6R0.4 CC(C)=CCC=C Amb22230004 [1,1,0,0,0,0|2,0,0]=4 2906 B6R0.4 CC(C)=CCC=O Amb18120881 [1,1,0,0,0,0|1,0,0]=3 2907 B6R0.4 CC(C)=CCCO Amb22002283 [1,1,0,0,0,0|1,0,1]=4 2908 B6R0.4 CC(C)CCC=O Amb17673735 [1,1,0,0,0,0|1,0,1]=4 2909 B6R0.4 CC(C)OCC=O Amb25820659 [1,1,0,0,0,0|1,0,1]=4 2910 B6R0.4 CC(C)SCC=O Amb24479811 [1,1,0,0,0,0|1,0,1]=4 2911 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,1,0,0,0,0|1,0,1]=4 2912 B6R0.4 CC(I)CCC=O Amb24333933 [1,1,0,0,0,0|1,0,1]=4 2913 B6R0.4 CC(N)=NCCO Amb25083393 [1,1,0,0,0,0|1,0,1]=4 2914 B6R0.4 CC(N)CCC=O Amb24443883 [1,1,0,0,0,0|1,0,1]=4 2915 B6R0.4 CC(O)CNC=O Amb20622242 [1,1,0,0,0,0|0,0,2]=4 2916 B6R0.4 CC(S)CNC=O Amb24388784 [1,1,0,0,0,0|0,1,1]=4 2917 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,1,0,0,0,0|0,0,1]=3 2918 B6R0.4 CC=NCC(C)O Amb25213778 [1,1,0,0,0,0|1,0,1]=4 2919 B6R0.4 CC=NNC(N)=O Amb24351023 [1,1,0,0,0,0|2,0,0]=4 2920 B6R0.4 CCC=CC(C)=O Amb22731698 [1,1,0,0,0,0|1,0,1]=4 2921 B6R0.4 CCCCC(=O)Br Amb22730323 [1,1,0,0,0,0|1,0,1]=4 2922 B6R0.4 CCCCC(O)=S Amb24682342 [1,1,0,0,0,0|0,1,1]=4 2923 B6R0.4 CCCCC([O-])=O Amb19879370 [1,1,0,0,0,0|0,0,2]=4 2924 B6R0.4 CCCCC([O-])=O Amb22056343 [1,1,0,0,0,0|0,0,2]=4 2925 B6R0.4 CCCCC([O-])=O Amb22729192 [1,1,0,0,0,0|0,0,2]=4 2926 B6R0.4 CCCCC([O-])=O Amb22731639 [1,1,0,0,0,0|0,0,2]=4 2927 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,1,0,0,0,0|0,0,1]=3 2928 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,1,0,0,0,0|1,0,1]=4 2929 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,1,0,0,0,0|1,0,1]=4 2930 B6R0.4 CCCNC(=O)N Amb1152241 [1,1,0,0,0,0|1,0,1]=4 2931 B6R0.4 CCCNC(O)=S Amb25302945 [1,1,0,0,0,0|0,1,1]=4 2932 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,1,0,0,0,0|1,0,1]=4 2933 B6R0.4 CCCOP(O)=O Amb25366595 [1,1,0,0,0,0|1,0,1]=4 2934 B6R0.4 CCCSC(C)=O Amb22043301 [1,1,0,0,0,0|1,0,1]=4 2935 B6R0.4 CCNCC(=O)N Amb1128676 [1,1,0,0,0,0|1,0,1]=4 2936 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|0,0,1]=3 2937 B6R0.4 CCNCC(C)=O Amb24545893 [1,1,0,0,0,0|1,0,1]=4 2938 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|0,0,1]=3 2939 B6R0.4 CCSCC(N)=O Amb24420234 [1,1,0,0,0,0|1,0,1]=4 2940 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,1,0,0,0,0|0,0,1]=3 2941 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,1,0,0,0,0|1,0,1]=4 2942 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,1,0,0,0,0|2,0,0]=4 2943 B6R0.4 CN(C)CC=C=O Amb22733182 [1,1,0,0,0,0|2,0,0]=4 2944 B6R0.4 CN(C)CCC=O Amb22001057 [1,1,0,0,0,0|2,0,0]=4 2945 B6R0.4 CN=CCC(C)=O Amb25261368 [1,1,0,0,0,0|1,0,0]=3 2946 B6R0.4 CN=CNC(N)=O Amb24561634 [1,1,0,0,0,0|2,0,0]=4 2947 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|0,0,1]=3 2948 B6R0.4 CNCCC(C)=O Amb24560306 [1,1,0,0,0,0|1,0,1]=4 2949 B6R0.4 CNCCC(N)=O Amb19959913 [1,1,0,0,0,0|1,0,1]=4 2950 B6R0.4 CNNCC(N)=O Amb25773971 [1,1,0,0,0,0|2,0,0]=4 2951 B6R0.4 CNNCC(O)=O Amb21929288 [1,1,0,0,0,0|1,0,0]=3 2952 B6R0.4 CNOCC(O)=O Amb25104714 [1,1,0,0,0,0|1,0,0]=3 2953 B6R0.4 CN\C=C/C(C)=O Amb24646447 [1,1,0,0,0,0|1,0,1]=4 2954 B6R0.4 CN\C=C\C(=O)C Amb17593076 [1,1,0,0,0,0|1,0,1]=4 2955 B6R0.4 CN\C=C\C(N)=O Amb24621805 [1,1,0,0,0,0|1,0,1]=4 2956 B6R0.4 COCNC(C)=O Amb24659843 [1,1,0,0,0,0|1,0,1]=4 2957 B6R0.4 COCNC(N)=O Amb25744350 [1,1,0,0,0,0|2,0,0]=4 2958 B6R0.4 CON=CC(C)=O Amb25236948 [1,1,0,0,0,0|1,0,1]=4 2959 B6R0.4 CON=CC(O)=O Amb25292253 [1,1,0,0,0,0|1,0,1]=4 2960 B6R0.4 CONCC(C)=C Amb24479610 [1,1,0,0,0,0|2,0,0]=4 2961 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [1,1,0,0,0,0|1,0,1]=4 2962 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,1,0,0,0,0|0,0,1]=3 2963 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,1]=4 2964 B6R0.4 CP(=O)OCCO Amb25221445 [1,1,0,0,0,0|1,0,1]=4 2965 B6R0.4 CS(=O)CCON Amb25368924 [1,1,0,0,0,0|1,0,1]=4 2966 B6R0.4 CS(=O)NCC=C Amb24603076 [1,1,0,0,0,0|2,0,0]=4 2967 B6R0.4 CS(=O)\C=C\CO Amb25794648 [1,1,0,0,0,0|1,0,1]=4 2968 B6R0.4 CSCCC(N)=O Amb24479809 [1,1,0,0,0,0|1,0,1]=4 2969 B6R0.4 CSCNC(C)=O Amb24561383 [1,1,0,0,0,0|2,0,0]=4 2970 B6R0.4 CSCNC(N)=O Amb24612362 [1,1,0,0,0,0|2,0,0]=4 2971 B6R0.4 CSCOC(C)=O Amb19884027 [1,1,0,0,0,0|2,0,0]=4 2972 B6R0.4 CSSCC(N)=O Amb24480454 [1,1,0,0,0,0|2,0,0]=4 2973 B6R0.4 CSSCC(O)=O Amb25378801 [1,1,0,0,0,0|1,0,0]=3 2974 B6R0.4 CS\C=C\C(C)=O Amb25768455 [1,1,0,0,0,0|0,1,1]=4 2975 B6R0.4 CS\C=C\C(N)=O Amb24507669 [1,1,0,0,0,0|1,0,1]=4 2976 B6R0.4 CS\C=C\C(O)=O Amb18641964 [1,1,0,0,0,0|0,0,1]=3 2977 B6R0.4 C[C@@H](O)CNC=O Amb25259151 [1,1,0,0,0,0|0,0,2]=4 2978 B6R0.4 C[C@H](O)CNC=O Amb25131739 [1,1,0,0,0,0|0,0,2]=4 2979 B6R0.4 C[C@H](O)COC=O Amb25662147 [1,1,0,0,0,0|0,0,2]=4 2980 B6R0.4 C\C(\Br)=C/CC=O Amb25811514 [1,1,0,0,0,0|1,0,0]=3 2981 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,1,0,0,0,0|1,0,0]=3 2982 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,1,0,0,0,0|0,0,0]=2 2983 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,1,0,0,0,0|1,0,0]=3 2984 B6R0.4 C\C=C\CC(C)O Amb24480541 [1,1,0,0,0,0|1,0,1]=4 2985 B6R0.4 C\C=C\CC(N)=N Amb25176208 [1,1,0,0,0,0|2,0,0]=4 2986 B6R0.4 C\C=C\CC(N)=S Amb24401512 [1,1,0,0,0,0|1,1,0]=4 2987 B6R0.4 C\C=C\CC(O)O Amb25803009 [1,1,0,0,0,0|0,0,2]=4 2988 B6R0.4 C\C=C\NC(N)=O Amb25340023 [1,1,0,0,0,0|1,0,1]=4 2989 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,1,0,0,0,0|0,0,0]=2 2990 B6R0.4 ClCCCC(=O)N Amb1138237 [1,1,0,0,0,0|1,0,1]=4 2991 B6R0.4 FCCCC(=O)O Amb17593104 [1,1,0,0,0,0|0,0,1]=3 2992 B6R0.4 N#CCCC(=O)C Amb17334046 [1,1,0,0,0,0|1,0,1]=4 2993 B6R0.4 N#CNCC(O)=O Amb25173813 [1,1,0,0,0,0|1,0,1]=4 2994 B6R0.4 N#CSCC(O)=O Amb24480976 [1,1,0,0,0,0|1,0,1]=4 2995 B6R0.4 N#C\C=C\C(O)=O Amb25853809 [1,1,0,0,0,0|0,0,2]=4 2996 B6R0.4 N=CNCC(O)=O Amb24670244 [1,1,0,0,0,0|1,0,0]=3 2997 B6R0.4 NC(=O)CC=NO Amb24605273 [1,1,0,0,0,0|1,0,0]=3 2998 B6R0.4 NC(=O)CCCBr Amb25779163 [1,1,0,0,0,0|1,0,1]=4 2999 B6R0.4 NC(=O)CCCO Amb20623438 [1,1,0,0,0,0|1,0,1]=4 3000 B6R0.4 NC(=O)CNC=O Amb25770889 [1,1,0,0,0,0|1,0,0]=3 3001 B6R0.4 NC(=O)CSCCl Amb25135617 [1,1,0,0,0,0|2,0,0]=4 3002 B6R0.4 NC(=O)NCCO Amb1146041 [1,1,0,0,0,0|1,0,1]=4 3003 B6R0.4 NC(=O)NCN=O Amb22490284 [1,1,0,0,0,0|2,0,0]=4 3004 B6R0.4 NC(=O)OCC=O Amb24446581 [1,1,0,0,0,0|1,0,0]=3 3005 B6R0.4 NC(=O)OCCO Amb20623788 [1,1,0,0,0,0|1,0,1]=4 3006 B6R0.4 NC(=O)\C=C\C=O Amb24480849 [1,1,0,0,0,0|1,0,1]=4 3007 B6R0.4 NC(=O)\C=C\CBr Amb25109131 [1,1,0,0,0,0|1,0,1]=4 3008 B6R0.4 NC(=O)\C=C\CCl Amb25328319 [1,1,0,0,0,0|1,0,1]=4 3009 B6R0.4 NC(=S)CNC=O Amb24479904 [1,1,0,0,0,0|1,1,0]=4 3010 B6R0.4 NC(=S)SCC=O Amb24713465 [1,1,0,0,0,0|1,1,0]=4 3011 B6R0.4 NCC#CC(O)=O Amb25703096 [1,1,0,0,0,0|0,0,2]=4 3012 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,1,0,0,0,0|1,0,1]=4 3013 B6R0.4 NCCCC(=O)N Amb2099583 [1,1,0,0,0,0|1,0,1]=4 3014 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|0,0,1]=3 3015 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,1,0,0,0,0|1,0,1]=4 3016 B6R0.4 NCCCP(O)=O Amb22370049 [1,1,0,0,0,0|1,0,1]=4 3017 B6R0.4 NCCCS(O)=O Amb25185942 [1,1,0,0,0,0|1,0,1]=4 3018 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,1,0,0,0,0|0,0,1]=3 3019 B6R0.4 NC\C=C/P(O)=O Amb22011758 [1,1,0,0,0,0|1,0,1]=4 3020 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,1,0,0,0,0|0,0,1]=3 3021 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,1,0,0,0,0|0,0,1]=3 3022 B6R0.4 NC\C=C\P(O)=O Amb25136979 [1,1,0,0,0,0|1,0,1]=4 3023 B6R0.4 NN\C=C\C(O)=O Amb25849332 [1,1,0,0,0,0|1,0,1]=4 3024 B6R0.4 NOCCC(=O)O Amb17569891 [1,1,0,0,0,0|0,0,2]=4 3025 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,1,0,0,0,0|1,0,1]=4 3026 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,1,0,0,0,0|1,0,1]=4 3027 B6R0.4 O=C(Cl)C\C=C\Cl Amb24531407 [1,1,0,0,0,0|1,0,1]=4 3028 B6R0.4 O=C(Cl)\C=C\CBr Amb25747116 [1,1,0,0,0,0|1,0,1]=4 3029 B6R0.4 O=C(Cl)\C=C\CCl Amb24531479 [1,1,0,0,0,0|1,0,1]=4 3030 B6R0.4 O=C(S)CCCCl Amb24683280 [1,1,0,0,0,0|0,1,1]=4 3031 B6R0.4 O=CCCC(O)C Amb17593090 [1,1,0,0,0,0|0,0,2]=4 3032 B6R0.4 O=CCOC(=O)C Amb10070247 [1,1,0,0,0,0|0,0,0]=2 3033 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|0,0,0]=2 3034 B6R0.4 O=CNN=C(C)C Amb2419224 [1,1,0,0,0,0|2,0,0]=4 3035 B6R0.4 OC(=O)CCC=O Amb17673897 [1,1,0,0,0,0|0,0,0]=2 3036 B6R0.4 OC(=O)CCCI Amb22295911 [1,1,0,0,0,0|0,0,1]=3 3037 B6R0.4 OC(=O)CCCP Amb24717184 [1,1,0,0,0,0|0,0,1]=3 3038 B6R0.4 OC(=O)CCNCl Amb24437846 [1,1,0,0,0,0|1,0,1]=4 3039 B6R0.4 OC(=O)CN=C=S Amb25024397 [1,1,0,0,0,0|0,1,1]=4 3040 B6R0.4 OC(=O)CSN=O Amb24368923 [1,1,0,0,0,0|1,0,0]=3 3041 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,1,0,0,0,0|0,0,1]=3 3042 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|0,0,1]=3 3043 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,1,0,0,0,0|0,0,1]=3 3044 B6R0.4 OC(=O)\C=C/OI Amb24418427 [1,1,0,0,0,0|0,0,2]=4 3045 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|0,0,1]=3 3046 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|0,0,1]=3 3047 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,1,0,0,0,0|0,0,1]=3 3048 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,1,0,0,0,0|0,0,1]=3 3049 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,1,0,0,0,0|0,0,1]=3 3050 B6R0.4 OC(=O)\C=C\I=O Amb25075597 [1,1,0,0,0,0|0,0,1]=3 3051 B6R0.4 OC(=O)\C=C\OI Amb24655000 [1,1,0,0,0,0|0,0,2]=4 3052 B6R0.4 OCC#CC(O)=O Amb22002375 [1,1,0,0,0,0|0,0,2]=4 3053 B6R0.4 OCC=C=C(C)C Amb17593073 [1,1,0,0,0,0|1,0,1]=4 3054 B6R0.4 OCCCC(=O)O Amb17615189 [1,1,0,0,0,0|0,0,1]=3 3055 B6R0.4 OCCCC(O)=O Amb18640332 [1,1,0,0,0,0|0,0,1]=3 3056 B6R0.4 OCCOC(=O)S Amb25106059 [1,1,0,0,0,0|1,0,1]=4 3057 B6R0.4 ON=NCC(O)=O Amb25204101 [1,1,0,0,0,0|1,0,1]=4 3058 B6R0.4 ON\C=C\C(O)=O Amb25058383 [1,1,0,0,0,0|0,0,2]=4 3059 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,1,0,0,0,0|0,0,1]=3 3060 B6R0.4 SCCCC(=O)O Amb16185429 [1,1,0,0,0,0|0,0,1]=3 3061 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,1,0,0,0,0|2,0,0]=4 3062 B6R0.4 [O-][N+](=O)CCC=O Amb24052990 [1,1,0,0,0,0|1,0,1]=4 3063 B6R0.4 [O-][N+](=O)C\C=N\O Amb22490495 [1,1,0,0,0,0|2,0,0]=4 3064 B6R0.5 C=CCP(O)(O)=O Amb24120618 [1,1,0,0,0,0|1,0,1]=4 3065 B6R0.5 C=CCP([O-])(O)=O Amb22353886 [1,1,0,0,0,0|1,0,1]=4 3066 B6R0.5 C=CCS(=O)(=O)C Amb17226556 [1,1,0,0,0,0|2,0,0]=4 3067 B6R0.5 C=CC[As](O)(O)=O Amb17933916 [1,1,0,0,0,0|1,0,1]=4 3068 B6R0.5 CC(C)(F)CC=O Amb25281907 [1,1,0,0,0,0|1,0,1]=4 3069 B6R0.5 CC(C)(N)CC=O Amb24604793 [1,1,0,0,0,0|1,0,1]=4 3070 B6R0.5 CC(C)(O)CC=O Amb18121857 [1,1,0,0,0,0|0,0,2]=4 3071 B6R0.5 CCCP(O)(O)=O Amb22230045 [1,1,0,0,0,0|1,0,1]=4 3072 B6R0.5 CN(C)(C)CC=O Amb22349791 [1,1,0,0,0,0|2,0,0]=4 3073 B6R0.5 COCP(O)(O)=O Amb24580709 [1,1,0,0,0,0|2,0,0]=4 3074 B6R0.5 CP(O)(=O)CCO Amb25085578 [1,1,0,0,0,0|1,0,1]=4 3075 B6R0.5 CS(=O)(=O)CC=O Amb23452908 [1,1,0,0,0,0|1,0,0]=3 3076 B6R0.5 C[N+](C)(C)CC=O Amb22735153 [1,1,0,0,0,0|2,0,0]=4 3077 B6R0.5 C\C=C/P(O)(O)=O Amb22234303 [1,1,0,0,0,0|1,0,1]=4 3078 B6R0.5 C\C=C\P(O)(O)=O Amb24480500 [1,1,0,0,0,0|1,0,1]=4 3079 B6R0.5 NS(=O)(=O)CC=O Amb24469369 [1,1,0,0,0,0|1,0,1]=4 3080 B6R0.5 O=CCS(=O)(=O)O Amb17593267 [1,1,0,0,0,0|1,0,0]=3 3081 B6R0.5 O=CC[N+](C)(C)C Amb10069442 [1,1,0,0,0,0|2,0,0]=4 3082 B6R0.5 OP(O)(=S)CC=O Amb25119153 [1,1,0,0,0,0|1,0,1]=4 3083 B6R0.7 CC(=C)P(O)(O)=O Amb22388780 [0,1,0,0,1,0|2,0,0]=4 3084 B6R0.7 CC(=O)C(C)(O)O Amb25237362 [0,1,0,0,1,0|0,0,2]=4 3085 B6R0.7 CC(=O)C(O)(O)O Amb24569677 [0,1,0,0,1,0|0,0,2]=4 3086 B6R0.7 CC(=O)P(O)(O)=O Amb25229259 [0,1,0,0,1,0|1,0,0]=3 3087 B6R0.7 CC(C)(C)C(O)=O Amb22360669 [0,1,0,0,1,0|1,0,1]=4 3088 B6R0.7 CC(C)(P)C(O)=O Amb25836244 [0,1,0,0,1,0|1,0,1]=4 3089 B6R0.7 CC(C)([15NH2])C(O)=O Amb22367632 [0,1,0,0,1,0|1,0,1]=4 3090 B6R0.7 CC(Cl)(Br)C(O)=O Amb24739657 [0,1,0,0,1,0|1,0,1]=4 3091 B6R0.7 CC(Cl)(Cl)C(O)=O Amb22352970 [0,1,0,0,1,0|1,0,1]=4 3092 B6R0.7 CC(F)(Br)C(O)=O Amb19895446 [0,1,0,0,1,0|1,0,1]=4 3093 B6R0.7 CC(F)(Cl)C(O)=O Amb22011870 [0,1,0,0,1,0|1,0,1]=4 3094 B6R0.7 CC(N)(Cl)C(O)=O Amb25040032 [0,1,0,0,1,0|1,0,1]=4 3095 B6R0.7 CC(N)(N)C(O)=O Amb24479882 [0,1,0,0,1,0|1,0,1]=4 3096 B6R0.7 CC(O)(O)C(O)=O Amb25337924 [0,1,0,0,1,0|0,0,2]=4 3097 B6R0.7 CC(P)(P)C(O)=O Amb25330045 [0,1,0,0,1,0|1,0,1]=4 3098 B6R0.7 CC(S)(S)C(O)=O Amb24687073 [0,1,0,0,1,0|0,1,1]=4 3099 B6R0.7 CS(=O)(=O)C(N)=O Amb24761430 [0,1,0,0,1,0|2,0,0]=4 3100 B6R0.7 C[C@@](N)(Cl)C(O)=O Amb24479866 [0,1,0,0,1,0|1,0,1]=4 3101 B6R0.7 C[C@@](N)(F)C(O)=O Amb25810196 [0,1,0,0,1,0|1,0,1]=4 3102 B6R0.7 C[C@@](N)(S)C(O)=O Amb25108484 [0,1,0,0,1,0|0,1,1]=4 3103 B6R0.7 C[C@](N)(F)C(O)=O Amb24333513 [0,1,0,0,1,0|1,0,1]=4 3104 B6R0.7 OC(=O)C(O)(C)C Amb1159101 [0,1,0,0,1,0|0,0,2]=4 3105 B6R0.7 OC(=O)C(S)(C)C Amb17501520 [0,1,0,0,1,0|0,1,1]=4 3106 B6R0.7 [2H]C(C)(N)C(O)=O Amb22353531 [0,1,0,0,1,0|1,0,1]=4 3107 B6R0.7 [2H]C(C)(N)[13C](O)=O Amb22367245 [0,1,0,0,1,0|1,0,1]=4 3108 B6R0.7 [2H]C([13CH3])(N)C(O)=O Amb22351832 [0,1,0,0,1,0|1,0,1]=4 3109 B6R0.7 [2H]C([2H])(C)C(O)=O Amb22366992 [0,1,0,0,1,0|1,0,1]=4 3110 B6R0.7 [2H][13C](C)(N)C(O)=O Amb22367247 [0,1,0,0,1,0|1,0,1]=4 3111 B6R0.7 [2H][C@@](C)(N)C(O)=O Amb22800178 [0,1,0,0,1,0|1,0,1]=4 3112 B8R0.9 BC(=O)NCC(=O)OC Amb22343192 [0,1,0,0,0,1|1,0,0]=3 3113 B8R0.9 BC(=O)NCC(=O)OC Amb25264831 [0,1,0,0,0,1|1,0,0]=3 3114 B8R0.9 BOC(O)=CCC(O)=O Amb25179903 [0,1,0,0,0,1|1,0,1]=4 3115 B8R0.9 C#CC(=O)NCC(N)=O Amb24732631 [0,1,0,0,0,1|1,0,1]=4 3116 B8R0.9 C=C(Br)CNC(=O)CBr Amb23570568 [0,1,0,0,0,1|2,0,0]=4 3117 B8R0.9 C=C(Br)CNC(=O)CCl Amb23570567 [0,1,0,0,0,1|2,0,0]=4 3118 B8R0.9 C=C(Br)CNC(=O)CN Amb23570566 [0,1,0,0,0,1|2,0,0]=4 3119 B8R0.9 C=C(CCC(O)=O)C#N Amb24465180 [0,1,0,0,0,1|1,0,1]=4 3120 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [0,1,0,0,0,1|1,0,1]=4 3121 B8R0.9 C=C(Cl)CNC(=O)CCl Amb25299176 [0,1,0,0,0,1|2,0,0]=4 3122 B8R0.9 C=C(Cl)COC(=O)CBr Amb25742540 [0,1,0,0,0,1|2,0,0]=4 3123 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [0,1,0,0,0,1|0,0,1]=3 3124 B8R0.9 CC(=C)CNC(=O)C#C Amb24481871 [0,1,0,0,0,1|2,0,0]=4 3125 B8R0.9 CC(=C)CNC(=O)C=C Amb24594709 [0,1,0,0,0,1|2,0,0]=4 3126 B8R0.9 CC(=C)CNC(=O)CBr Amb24411635 [0,1,0,0,0,1|2,0,0]=4 3127 B8R0.9 CC(=C)CNC(=O)CCl Amb25178055 [0,1,0,0,0,1|2,0,0]=4 3128 B8R0.9 CC(=C)CNC(=O)CI Amb24082572 [0,1,0,0,0,1|2,0,0]=4 3129 B8R0.9 CC(=C)CNC(=O)NC Amb25662508 [0,1,0,0,0,1|2,0,0]=4 3130 B8R0.9 CC(=C)CNC(=O)NN Amb24461633 [0,1,0,0,0,1|2,0,0]=4 3131 B8R0.9 CC(=C)COC(=O)C=C Amb17934090 [0,1,0,0,0,1|2,0,0]=4 3132 B8R0.9 CC(=C)COC(=O)CC Amb25345772 [0,1,0,0,0,1|2,0,0]=4 3133 B8R0.9 CC(=C)COC(=O)NN Amb24449248 [0,1,0,0,0,1|2,0,0]=4 3134 B8R0.9 CC(=C)CSC(=O)NC Amb24598440 [0,1,0,0,0,1|2,0,0]=4 3135 B8R0.9 CC(=C)CSC(=S)OC Amb25369291 [0,1,0,0,0,1|1,1,0]=4 3136 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,1,0,0,0,1|1,0,0]=3 3137 B8R0.9 CC(=CCl)OCC(C)=O Amb25233389 [0,1,0,0,0,1|2,0,0]=4 3138 B8R0.9 CC(=CCl)\C=C\C(O)=O Amb24397298 [0,1,0,0,0,1|1,0,1]=4 3139 B8R0.9 CC(=N)SCC(=O)CCl Amb24113053 [0,1,0,0,0,1|2,0,0]=4 3140 B8R0.9 CC(=O)C#CC(=O)OC Amb25031911 [0,1,0,0,0,1|0,0,1]=3 3141 B8R0.9 CC(=O)C=CC(=O)C=C Amb24061722 [0,1,0,0,0,1|1,0,1]=4 3142 B8R0.9 CC(=O)CCC(=C)C#N Amb25086729 [0,1,0,0,0,1|2,0,0]=4 3143 B8R0.9 CC(=O)CCC(=C)C=O Amb24640352 [0,1,0,0,0,1|1,0,0]=3 3144 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,1,0,0,0,1|2,0,0]=4 3145 B8R0.9 CC(=O)CCC(=O)C=C Amb10562681 [0,1,0,0,0,1|1,0,0]=3 3146 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [0,1,0,0,0,1|0,0,1]=3 3147 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,1|1,0,0]=3 3148 B8R0.9 CC(=O)CCC(Cl)C=O Amb25275061 [0,1,0,0,0,1|1,0,1]=4 3149 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,1,0,0,0,1|1,0,1]=4 3150 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,1|1,0,1]=4 3151 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,1,0,0,0,1|1,0,1]=4 3152 B8R0.9 CC(=O)CCC(O)C=C Amb24614737 [0,1,0,0,0,1|1,0,1]=4 3153 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,1,0,0,0,1|1,0,1]=4 3154 B8R0.9 CC(=O)CNC(=O)C=C Amb25162799 [0,1,0,0,0,1|1,0,0]=3 3155 B8R0.9 CC(=O)CNC(=O)CC Amb25292227 [0,1,0,0,0,1|1,0,0]=3 3156 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,1|1,0,0]=3 3157 B8R0.9 CC(=O)CNC(=O)NC Amb25228227 [0,1,0,0,0,1|1,0,0]=3 3158 B8R0.9 CC(=O)COC(=O)C=O Amb18642738 [0,1,0,0,0,1|0,0,1]=3 3159 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,1,0,0,0,1|0,0,0]=2 3160 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,1,0,0,0,1|0,0,0]=2 3161 B8R0.9 CC(=O)CSC(Cl)=CCl Amb24677761 [0,1,0,0,0,1|2,0,0]=4 3162 B8R0.9 CC(=O)CS\C(\N)=N\N Amb24763741 [0,1,0,0,0,1|2,0,0]=4 3163 B8R0.9 CC(=O)C\C=C(/C)\C=C Amb25198446 [0,1,0,0,0,1|2,0,0]=4 3164 B8R0.9 CC(=O)C\C=C(\C)/C=C Amb24686521 [0,1,0,0,0,1|2,0,0]=4 3165 B8R0.9 CC(=O)NCC(=C)C#N Amb18642197 [0,1,0,0,0,1|2,0,0]=4 3166 B8R0.9 CC(=O)NCC(=O)CBr Amb24590234 [0,1,0,0,0,1|1,0,0]=3 3167 B8R0.9 CC(=O)NCC(=O)CC Amb23555728 [0,1,0,0,0,1|1,0,0]=3 3168 B8R0.9 CC(=O)NCC(=O)NN Amb24524168 [0,1,0,0,0,1|1,0,0]=3 3169 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,1|0,0,0]=2 3170 B8R0.9 CC(=O)NCC(=S)OC Amb25041236 [0,1,0,0,0,1|0,1,0]=3 3171 B8R0.9 CC(=O)NCC(N)=NN Amb24680987 [0,1,0,0,0,1|2,0,0]=4 3172 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,1,0,0,0,1|1,0,1]=4 3173 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,1,0,0,0,1|1,0,1]=4 3174 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,1,0,0,0,1|1,0,1]=4 3175 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,1,0,0,0,1|0,0,2]=4 3176 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,1,0,0,0,1|1,0,1]=4 3177 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,1|1,0,1]=4 3178 B8R0.9 CC(=O)NC\C(\N)=N/O Amb19650814 [0,1,0,0,0,1|1,0,0]=3 3179 B8R0.9 CC(=O)NC\C(\N)=N\O Amb21912454 [0,1,0,0,0,1|1,0,0]=3 3180 B8R0.9 CC(=O)NNC(=O)CBr Amb19957358 [0,1,0,0,0,1|2,0,0]=4 3181 B8R0.9 CC(=O)NNC(=O)CCl Amb1154170 [0,1,0,0,0,1|2,0,0]=4 3182 B8R0.9 CC(=O)NNC(=O)CI Amb25770653 [0,1,0,0,0,1|2,0,0]=4 3183 B8R0.9 CC(=O)NNC(=O)CN Amb17334122 [0,1,0,0,0,1|2,0,0]=4 3184 B8R0.9 CC(=O)NNC(=O)OC Amb24677256 [0,1,0,0,0,1|1,0,0]=3 3185 B8R0.9 CC(=O)N\C=C(\C)/C=O Amb18642508 [0,1,0,0,0,1|1,0,1]=4 3186 B8R0.9 CC(=O)OCC(=C)C=O Amb25050286 [0,1,0,0,0,1|1,0,0]=3 3187 B8R0.9 CC(=O)OCC(=C)CBr Amb25685305 [0,1,0,0,0,1|2,0,0]=4 3188 B8R0.9 CC(=O)OCC(=C)CC Amb24571642 [0,1,0,0,0,1|2,0,0]=4 3189 B8R0.9 CC(=O)OCC(=C)CCl Amb24409101 [0,1,0,0,0,1|2,0,0]=4 3190 B8R0.9 CC(=O)OCC(=O)C=C Amb17607380 [0,1,0,0,0,1|1,0,0]=3 3191 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,1,0,0,0,1|1,0,0]=3 3192 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,1,0,0,0,1|1,0,0]=3 3193 B8R0.9 CC(=O)OCC(=O)CS Amb24456592 [0,1,0,0,0,1|0,1,0]=3 3194 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,1,0,0,0,1|1,0,1]=4 3195 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,1,0,0,0,1|1,0,1]=4 3196 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,1,0,0,0,1|1,0,1]=4 3197 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,1|0,0,2]=4 3198 B8R0.9 CC(=O)OCN(C)N=O Amb22732377 [0,1,0,0,0,1|2,0,0]=4 3199 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,1,0,0,0,1|1,0,1]=4 3200 B8R0.9 CC(=O)OC[C@H](O)C=C Amb24395445 [0,1,0,0,0,1|1,0,1]=4 3201 B8R0.9 CC(=O)ONC(=O)CC Amb22232333 [0,1,0,0,0,1|2,0,0]=4 3202 B8R0.9 CC(=O)ONC(=O)CO Amb24431913 [0,1,0,0,0,1|1,0,0]=3 3203 B8R0.9 CC(=O)O\C=C(/Br)\C=O Amb25785618 [0,1,0,0,0,1|1,0,1]=4 3204 B8R0.9 CC(=O)O\C=C(/C)\C=O Amb24426274 [0,1,0,0,0,1|1,0,1]=4 3205 B8R0.9 CC(=O)O\C=C(/F)\C=O Amb25132702 [0,1,0,0,0,1|1,0,1]=4 3206 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,1,0,0,0,1|1,0,1]=4 3207 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,1,0,0,0,1|0,0,2]=4 3208 B8R0.9 CC(=O)\C=C/C(=O)C=O Amb25756958 [0,1,0,0,0,1|0,0,2]=4 3209 B8R0.9 CC(=O)\C=C/C(=O)CC Amb24649767 [0,1,0,0,0,1|1,0,1]=4 3210 B8R0.9 CC(=O)\C=C/C(=O)OC Amb25031885 [0,1,0,0,0,1|0,0,1]=3 3211 B8R0.9 CC(=O)\C=C/C(C)=S=O Amb25318848 [0,1,0,0,0,1|1,0,1]=4 3212 B8R0.9 CC(=O)\C=C/C(O)C=O Amb24478568 [0,1,0,0,0,1|0,0,2]=4 3213 B8R0.9 CC(=O)\C=C\C(=O)C=O Amb18642365 [0,1,0,0,0,1|0,0,2]=4 3214 B8R0.9 CC(=O)\C=C\C(=O)CO Amb24686389 [0,1,0,0,0,1|0,0,1]=3 3215 B8R0.9 CC(=O)\C=C\C(=O)OC Amb22336182 [0,1,0,0,0,1|0,0,1]=3 3216 B8R0.9 CC(C#C)OCC(O)=O Amb25092433 [0,1,0,0,0,1|1,0,1]=4 3217 B8R0.9 CC(C#N)NCC(O)=O Amb18293465 [0,1,0,0,0,1|1,0,1]=4 3218 B8R0.9 CC(C#N)SCC(O)=O Amb18293809 [0,1,0,0,0,1|1,0,1]=4 3219 B8R0.9 CC(C)=CCC(=C)C=O Amb25092965 [0,1,0,0,0,1|2,0,0]=4 3220 B8R0.9 CC(C)=CNC(=O)OC Amb25146144 [0,1,0,0,0,1|1,0,1]=4 3221 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,1|1,0,1]=4 3222 B8R0.9 CC(C)COC(=O)NO Amb24481916 [0,1,0,0,0,1|1,0,1]=4 3223 B8R0.9 CC(C)SCC(=O)NO Amb25741291 [0,1,0,0,0,1|1,0,1]=4 3224 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,1,0,0,0,1|1,0,1]=4 3225 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,1,0,0,0,1|1,0,1]=4 3226 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,1,0,0,0,1|1,0,1]=4 3227 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,1,0,0,0,1|1,0,1]=4 3228 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,1,0,0,0,1|1,0,1]=4 3229 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [0,1,0,0,0,1|2,0,0]=4 3230 B8R0.9 CC(CCC(C)=O)=NO Amb24760824 [0,1,0,0,0,1|1,0,0]=3 3231 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,1,0,0,0,1|1,0,1]=4 3232 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,1,0,0,0,1|1,0,0]=3 3233 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,1,0,0,0,1|0,0,1]=3 3234 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,1,0,0,0,1|1,0,1]=4 3235 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,1,0,0,0,1|1,0,1]=4 3236 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,1,0,0,0,1|1,0,1]=4 3237 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,1,0,0,0,1|1,0,1]=4 3238 B8R0.9 CC(CNC(=O)CBr)O Amb17322852 [0,1,0,0,0,1|1,0,1]=4 3239 B8R0.9 CC(CNC(=O)CCl)O Amb17324265 [0,1,0,0,0,1|1,0,1]=4 3240 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,1,0,0,0,1|1,0,1]=4 3241 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,1,0,0,0,1|1,0,1]=4 3242 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,1,0,0,0,1|0,0,2]=4 3243 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,1,0,0,0,1|1,0,1]=4 3244 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,1,0,0,0,1|0,0,2]=4 3245 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,1,0,0,0,1|1,0,1]=4 3246 B8R0.9 CC(CSC(C)=O)=CCl Amb24634070 [0,1,0,0,0,1|2,0,0]=4 3247 B8R0.9 CC(O)CNC(=O)CO Amb25703101 [0,1,0,0,0,1|0,0,2]=4 3248 B8R0.9 CC(O)CNC(=O)CS Amb24744011 [0,1,0,0,0,1|1,0,1]=4 3249 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,1,0,0,0,1|1,0,1]=4 3250 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,1,0,0,0,1|1,0,1]=4 3251 B8R0.9 CC(\C=C\C(C)=O)=NO Amb24513914 [0,1,0,0,0,1|1,0,1]=4 3252 B8R0.9 CCC(=O)CCB(O)O Amb24736642 [0,1,0,0,0,1|1,0,1]=4 3253 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,1,0,0,0,1|1,0,0]=3 3254 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,1,0,0,0,1|1,0,0]=3 3255 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,1|0,0,0]=2 3256 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,1,0,0,0,1|1,0,0]=3 3257 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,1,0,0,0,1|1,0,0]=3 3258 B8R0.9 CCC(=O)CC[N+]([O-])=O Amb25236332 [0,1,0,0,0,1|1,0,1]=4 3259 B8R0.9 CCC(=O)NCC(=C)Cl Amb25346537 [0,1,0,0,0,1|2,0,0]=4 3260 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,1,0,0,0,1|1,0,0]=3 3261 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,1|0,0,0]=2 3262 B8R0.9 CCC(=O)NCC(=S)N Amb17232011 [0,1,0,0,0,1|1,1,0]=4 3263 B8R0.9 CCC(=O)NC[C@@H](C)O Amb25297640 [0,1,0,0,0,1|1,0,1]=4 3264 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,1,0,0,0,1|0,0,0]=2 3265 B8R0.9 CCC(=O)\C=C\C(O)=O Amb18642585 [0,1,0,0,0,1|0,0,1]=3 3266 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,1,0,0,0,1|0,1,0]=3 3267 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,1,0,0,0,1|2,0,0]=4 3268 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,1,0,0,0,1|1,0,1]=4 3269 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,1,0,0,0,1|1,0,1]=4 3270 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,1,0,0,0,1|1,0,0]=3 3271 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,1,0,0,0,1|1,0,1]=4 3272 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,1,0,0,0,1|1,0,1]=4 3273 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,1,0,0,0,1|1,0,1]=4 3274 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,1,0,0,0,1|0,0,2]=4 3275 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,1,0,0,0,1|2,0,0]=4 3276 B8R0.9 CCS(=O)NCC(C)=O Amb25177389 [0,1,0,0,0,1|2,0,0]=4 3277 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,1,0,0,0,1|1,0,1]=4 3278 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,1,0,0,0,1|1,0,1]=4 3279 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,1,0,0,0,1|1,0,1]=4 3280 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,1,0,0,0,1|1,0,1]=4 3281 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,1,0,0,0,1|2,0,0]=4 3282 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,1,0,0,0,1|2,0,0]=4 3283 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,1,0,0,0,1|2,0,0]=4 3284 B8R0.9 CN(CCC(N)=O)C=O Amb25146008 [0,1,0,0,0,1|2,0,0]=4 3285 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,1,0,0,0,1|1,0,0]=3 3286 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [0,1,0,0,0,1|1,0,0]=3 3287 B8R0.9 CN(CNC(N)=O)N=O Amb24424786 [0,1,0,0,0,1|2,0,0]=4 3288 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,1,0,0,0,1|1,0,0]=3 3289 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,1,0,0,0,1|1,0,0]=3 3290 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,1,0,0,0,1|1,0,0]=3 3291 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,1,0,0,0,1|1,0,0]=3 3292 B8R0.9 CNC(=O)CCC(O)C Amb17334125 [0,1,0,0,0,1|1,0,1]=4 3293 B8R0.9 CNC(=O)CCS(C)=O Amb24476726 [0,1,0,0,0,1|2,0,0]=4 3294 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,1,0,0,0,1|0,0,0]=2 3295 B8R0.9 CNC(=O)CSC(N)=N Amb25106852 [0,1,0,0,0,1|2,0,0]=4 3296 B8R0.9 CNC(=O)NCC(=C)Br Amb25185103 [0,1,0,0,0,1|2,0,0]=4 3297 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,1|0,0,0]=2 3298 B8R0.9 CNC(=O)NCC(N)=N Amb25114509 [0,1,0,0,0,1|2,0,0]=4 3299 B8R0.9 CNC(=O)NCC(N)=O Amb24481795 [0,1,0,0,0,1|1,0,0]=3 3300 B8R0.9 CNC(=O)NCS([O-])=O Amb24547022 [0,1,0,0,0,1|1,0,1]=4 3301 B8R0.9 CNC(=O)NOC(N)=O Amb25672371 [0,1,0,0,0,1|2,0,0]=4 3302 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,1,0,0,0,1|0,0,0]=2 3303 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,1,0,0,0,1|0,1,0]=3 3304 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,1,0,0,0,1|1,0,1]=4 3305 B8R0.9 COC(=N)CNC(N)=O Amb24515695 [0,1,0,0,0,1|2,0,0]=4 3306 B8R0.9 COC(=O)C#CC(O)=O Amb22492669 [0,1,0,0,0,1|0,0,1]=3 3307 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,1,0,0,0,1|1,0,1]=4 3308 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,1,0,0,0,1|0,0,0]=2 3309 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,1|1,0,1]=4 3310 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,1|1,0,1]=4 3311 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,1|1,0,1]=4 3312 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,1|1,0,0]=3 3313 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,1,0,0,0,1|1,1,0]=4 3314 B8R0.9 COC(=O)CCS([O-])=O Amb21520328 [0,1,0,0,0,1|1,0,1]=4 3315 B8R0.9 COC(=O)CC[C@@H](C)Cl Amb24480241 [0,1,0,0,0,1|1,0,1]=4 3316 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,1|1,0,1]=4 3317 B8R0.9 COC(=O)CC[C@@H](C)O Amb22388487 [0,1,0,0,0,1|0,0,2]=4 3318 B8R0.9 COC(=O)CC[C@H](C)O Amb24351118 [0,1,0,0,0,1|0,0,2]=4 3319 B8R0.9 COC(=O)CNC(=O)N Amb1126846 [0,1,0,0,0,1|1,0,0]=3 3320 B8R0.9 COC(=O)CNN(C)C Amb24693623 [0,1,0,0,0,1|2,0,0]=4 3321 B8R0.9 COC(=O)CNS(C)=O Amb24536728 [0,1,0,0,0,1|1,0,0]=3 3322 B8R0.9 COC(=O)CSC(C)O Amb25032211 [0,1,0,0,0,1|0,0,2]=4 3323 B8R0.9 COC(=O)CSC(N)=N Amb20676059 [0,1,0,0,0,1|2,0,0]=4 3324 B8R0.9 COC(=O)CSC(N)=O Amb24672643 [0,1,0,0,0,1|1,0,0]=3 3325 B8R0.9 COC(=O)NCC(C)C Amb17861777 [0,1,0,0,0,1|1,0,1]=4 3326 B8R0.9 COC(=O)NCC(N)=N Amb24436947 [0,1,0,0,0,1|2,0,0]=4 3327 B8R0.9 COC(=O)NC[C@H](C)O Amb25111936 [0,1,0,0,0,1|0,0,2]=4 3328 B8R0.9 COC(=O)OCC(C)C Amb24416487 [0,1,0,0,0,1|1,0,1]=4 3329 B8R0.9 COC(=O)\C=C\C(=O)Cl Amb25060248 [0,1,0,0,0,1|1,0,1]=4 3330 B8R0.9 COC(=O)\C=C\C(=O)O Amb10071357 [0,1,0,0,0,1|0,0,1]=3 3331 B8R0.9 COC(=O)\C=C\C(N)=O Amb24458702 [0,1,0,0,0,1|1,0,1]=4 3332 B8R0.9 COC(=O)\C=C\C([O-])=O Amb24121535 [0,1,0,0,0,1|0,0,2]=4 3333 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,1,0,0,0,1|0,1,0]=3 3334 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,1,0,0,0,1|0,0,2]=4 3335 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,1,0,0,0,1|1,0,1]=4 3336 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,1|1,0,1]=4 3337 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,1|1,0,1]=4 3338 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,1,0,0,0,1|0,0,2]=4 3339 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,1,0,0,0,1|1,0,1]=4 3340 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,1,0,0,0,1|0,0,2]=4 3341 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,1,0,0,0,1|0,1,0]=3 3342 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,1,0,0,0,1|0,1,0]=3 3343 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,1,0,0,0,1|0,1,1]=4 3344 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,1,0,0,0,1|1,0,1]=4 3345 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,1,0,0,0,1|1,0,1]=4 3346 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,1,0,0,0,1|1,0,1]=4 3347 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,1,0,0,0,1|1,0,1]=4 3348 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,1,0,0,0,1|1,0,1]=4 3349 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,1,0,0,0,1|1,0,1]=4 3350 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,1,0,0,0,1|1,0,1]=4 3351 B8R0.9 C[C@H](O)CNC(=O)CBr Amb24567754 [0,1,0,0,0,1|1,0,1]=4 3352 B8R0.9 C\C(=C/CC(C)=O)\C#C Amb25767766 [0,1,0,0,0,1|2,0,0]=4 3353 B8R0.9 C\C(=C/CC(C)=O)\C#N Amb25735739 [0,1,0,0,0,1|2,0,0]=4 3354 B8R0.9 C\C(=C\Cl)\OCC(C)=O Amb25061238 [0,1,0,0,0,1|2,0,0]=4 3355 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,1,0,0,0,1|1,0,0]=3 3356 B8R0.9 C\C(\C=CC(O)=O)=N\O Amb24640839 [0,1,0,0,0,1|0,0,2]=4 3357 B8R0.9 C\C(\C=C\C(C)=O)=N/O Amb25243565 [0,1,0,0,0,1|1,0,1]=4 3358 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [0,1,0,0,0,1|1,0,1]=4 3359 B8R0.9 C\C(\C=O)=C\CC(C)=C Amb18642231 [0,1,0,0,0,1|2,0,0]=4 3360 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,1,0,0,0,1|1,0,0]=3 3361 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,1,0,0,0,1|2,0,0]=4 3362 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,1,0,0,0,1|2,0,0]=4 3363 B8R0.9 C\C(\CCC(C)=O)=N/O Amb24422445 [0,1,0,0,0,1|1,0,0]=3 3364 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,1,0,0,0,1|1,0,0]=3 3365 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,1,0,0,0,1|1,0,0]=3 3366 B8R0.9 C\C(\COC(=O)Cl)=C\Cl Amb24480147 [0,1,0,0,0,1|2,0,0]=4 3367 B8R0.9 C\C(\COC(C)=O)=C/Br Amb25200999 [0,1,0,0,0,1|2,0,0]=4 3368 B8R0.9 C\C(\Cl)=C\CC(=O)CC Amb25377805 [0,1,0,0,0,1|2,0,0]=4 3369 B8R0.9 C\C(\N)=N\OC(=O)OC Amb25728140 [0,1,0,0,0,1|2,0,0]=4 3370 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,1,0,0,0,1|1,0,0]=3 3371 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,1,0,0,0,1|1,0,0]=3 3372 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,1,0,0,0,1|1,0,0]=3 3373 B8R0.9 NC(=O)CCC(=O)N=O Amb24445359 [0,1,0,0,0,1|1,0,1]=4 3374 B8R0.9 NC(=O)CCC(=O)NBr Amb24390936 [0,1,0,0,0,1|2,0,0]=4 3375 B8R0.9 NC(=O)CCC(=O)NCl Amb24425513 [0,1,0,0,0,1|2,0,0]=4 3376 B8R0.9 NC(=O)CCC(=O)NO Amb24340146 [0,1,0,0,0,1|1,0,0]=3 3377 B8R0.9 NC(=O)CNC(=O)CBr Amb25201255 [0,1,0,0,0,1|1,0,0]=3 3378 B8R0.9 NC(=O)CNC(=O)CN Amb22730172 [0,1,0,0,0,1|1,0,0]=3 3379 B8R0.9 NC(=O)CNC(=O)CN Amb22734748 [0,1,0,0,0,1|1,0,0]=3 3380 B8R0.9 NC(=O)CNC(=O)CS Amb24405222 [0,1,0,0,0,1|1,0,0]=3 3381 B8R0.9 NC(=O)COC(=O)CO Amb25739390 [0,1,0,0,0,1|1,0,0]=3 3382 B8R0.9 NC(=O)NCC(=O)NN Amb24477825 [0,1,0,0,0,1|2,0,0]=4 3383 B8R0.9 NC(=O)NNC(=O)CO Amb25328968 [0,1,0,0,0,1|2,0,0]=4 3384 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,1,0,0,0,1|1,0,1]=4 3385 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,1,0,0,0,1|1,0,1]=4 3386 B8R0.9 NC(NCC(N)=O)=NO Amb25759831 [0,1,0,0,0,1|2,0,0]=4 3387 B8R0.9 NC(NCC(O)=O)=NO Amb24568694 [0,1,0,0,0,1|1,0,1]=4 3388 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,1,0,0,0,1|0,0,0]=2 3389 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,1|0,0,0]=2 3390 B8R0.9 NCC(=O)NCP(O)O Amb24424485 [0,1,0,0,0,1|1,0,1]=4 3391 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,1,0,0,0,1|0,0,0]=2 3392 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,1,0,0,0,1|0,0,0]=2 3393 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,1,0,0,0,1|0,1,0]=3 3394 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,1,0,0,0,1|1,0,1]=4 3395 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,1,0,0,0,1|0,0,2]=4 3396 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,1,0,0,0,1|0,0,2]=4 3397 B8R0.9 NNC(=N)NCC(O)=O Amb24477722 [0,1,0,0,0,1|2,0,0]=4 3398 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,1,0,0,0,1|1,0,0]=3 3399 B8R0.9 NNC(=O)CNC(O)=O Amb25093417 [0,1,0,0,0,1|1,0,0]=3 3400 B8R0.9 NNC(=O)\C=C/C(O)=O Amb25046308 [0,1,0,0,0,1|1,0,1]=4 3401 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,1,0,0,0,1|0,0,0]=2 3402 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,1,0,0,0,1|1,0,1]=4 3403 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,1,0,0,0,1|1,0,1]=4 3404 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,1,0,0,0,1|1,0,1]=4 3405 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,1,0,0,0,1|1,0,1]=4 3406 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,1,0,0,0,1|1,0,1]=4 3407 B8R0.9 O=C(CCl)CC=C(Cl)Cl Amb24635418 [0,1,0,0,0,1|2,0,0]=4 3408 B8R0.9 O=C(Cl)COC(=O)CCl Amb24339381 [0,1,0,0,0,1|1,0,0]=3 3409 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [0,1,0,0,0,1|1,0,0]=3 3410 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [0,1,0,0,0,1|0,0,1]=3 3411 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,1,0,0,0,1|0,0,0]=2 3412 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,1|0,0,0]=2 3413 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,1,0,0,0,1|0,0,0]=2 3414 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,1,0,0,0,1|1,0,1]=4 3415 B8R0.9 OC(=O)CNC(=O)C=O Amb25328169 [0,1,0,0,0,1|0,0,1]=3 3416 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,1,0,0,0,1|0,0,0]=2 3417 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,1|0,0,0]=2 3418 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,1,0,0,0,1|0,0,0]=2 3419 B8R0.9 OC(=O)CNC(=O)NO Amb25228420 [0,1,0,0,0,1|1,0,0]=3 3420 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,1,0,0,0,1|0,0,0]=2 3421 B8R0.9 OC(=O)\C=C\C(=O)CBr Amb25718709 [0,1,0,0,0,1|0,0,1]=3 3422 B8R0.9 OC(=O)\C=C\C(=O)CO Amb18642735 [0,1,0,0,0,1|0,0,1]=3 3423 B8R0.9 OC(=O)\C=C\C(=O)O[Na] Amb22337964 [0,1,0,0,0,1|1,0,1]=4 3424 B8R0.9 OC(=O)\C=C\C(=O)O[Na] Amb22338796 [0,1,0,0,0,1|1,0,1]=4 3425 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [0,1,0,0,0,1|1,0,1]=4 3426 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,1,0,0,0,1|0,0,2]=4 3427 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,1,0,0,0,1|0,0,2]=4 3428 B8R0.9 ONC(=O)/C=C\C(O)=O Amb17673396 [0,1,0,0,0,1|1,0,1]=4 3429 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,1,0,0,0,1|1,0,1]=4 3430 B8R0.23 C=C(Br)C(O)CC(O)=O Amb24648348 [0,1,0,0,0,1|1,0,1]=4 3431 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,1,0,0,0,1|1,0,1]=4 3432 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,1,0,0,0,1|1,0,1]=4 3433 B8R0.23 C=C(CC(=O)Cl)C(O)=O Amb25227983 [0,1,0,0,0,1|1,0,0]=3 3434 B8R0.23 C=C(CC(N)=O)C(N)=O Amb25338425 [0,1,0,0,0,1|2,0,0]=4 3435 B8R0.23 C=C(CC(N)=O)C(O)=O Amb24333452 [0,1,0,0,0,1|1,0,0]=3 3436 B8R0.23 C=C(CC(O)=O)C(N)=O Amb22011744 [0,1,0,0,0,1|1,0,0]=3 3437 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22731973 [0,1,0,0,0,1|1,0,1]=4 3438 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22732122 [0,1,0,0,0,1|1,0,1]=4 3439 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22732709 [0,1,0,0,0,1|1,0,1]=4 3440 B8R0.23 C=C(CC([O-])=O)C([O-])=O Amb22734239 [0,1,0,0,0,1|1,0,1]=4 3441 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,1,0,0,0,1|1,0,1]=4 3442 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,1,0,0,0,1|1,0,1]=4 3443 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,1,0,0,0,1|1,0,1]=4 3444 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,1,0,0,0,1|1,0,0]=3 3445 B8R0.23 CC(=C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,1|2,0,0]=4 3446 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,1,0,0,0,1|1,0,0]=3 3447 B8R0.23 CC(=C)CC(=C)C(O)=O Amb24669131 [0,1,0,0,0,1|1,0,0]=3 3448 B8R0.23 CC(=C)CC(C)C(N)=O Amb24475657 [0,1,0,0,0,1|2,0,0]=4 3449 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,1,0,0,0,1|1,0,0]=3 3450 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,1,0,0,0,1|1,0,0]=3 3451 B8R0.23 CC(=C)CN(C)C(N)=O Amb25734583 [0,1,0,0,0,1|2,0,0]=4 3452 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,1,0,0,0,1|1,0,0]=3 3453 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,1,0,0,0,1|1,0,0]=3 3454 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,1,0,0,0,1|1,0,0]=3 3455 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,1,0,0,0,1|1,0,0]=3 3456 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,1,0,0,0,1|1,0,0]=3 3457 B8R0.23 CC(=CC(N)=O)C(O)=O Amb24744881 [0,1,0,0,0,1|1,0,1]=4 3458 B8R0.23 CC(=O)C(=C)NC(C)=O Amb24096350 [0,1,0,0,0,1|1,0,1]=4 3459 B8R0.23 CC(=O)C(=O)CC(C)=O Amb25806867 [0,1,0,0,0,1|1,0,0]=3 3460 B8R0.23 CC(=O)C(=O)NC(N)=O Amb24411479 [0,1,0,0,0,1|1,0,1]=4 3461 B8R0.23 CC(=O)C(C)=NC(C)=O Amb25349449 [0,1,0,0,0,1|1,0,1]=4 3462 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,1,0,0,0,1|0,0,0]=2 3463 B8R0.23 CC(=O)C(C)OC(=O)Cl Amb24721759 [0,1,0,0,0,1|1,0,0]=3 3464 B8R0.23 CC(=O)C(C)SC(C)=O Amb25833387 [0,1,0,0,0,1|1,0,0]=3 3465 B8R0.23 CC(=O)C(Cl)C=C(Cl)Cl Amb24479967 [0,1,0,0,0,1|2,0,0]=4 3466 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,1,0,0,0,1|0,0,0]=2 3467 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,1|1,0,0]=3 3468 B8R0.23 CC(=O)C(O)=CC(O)=O Amb25261166 [0,1,0,0,0,1|0,0,1]=3 3469 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,1,0,0,0,1|0,0,0]=2 3470 B8R0.23 CC(=O)CC(=O)C(C)=C Amb17934088 [0,1,0,0,0,1|2,0,0]=4 3471 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,1,0,0,0,1|0,0,0]=2 3472 B8R0.23 CC(=O)CC(=O)N(C)O Amb24096670 [0,1,0,0,0,1|2,0,0]=4 3473 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,1,0,0,0,1|0,0,0]=2 3474 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,1,0,0,0,1|0,1,0]=3 3475 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,1,0,0,0,1|0,0,0]=2 3476 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,1,0,0,0,1|0,0,0]=2 3477 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,1,0,0,0,1|0,0,0]=2 3478 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,1,0,0,0,1|2,0,0]=4 3479 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,1,0,0,0,1|0,0,0]=2 3480 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,1,0,0,0,1|0,0,0]=2 3481 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,1,0,0,0,1|0,0,0]=2 3482 B8R0.23 CC(=O)N(C)CC(=C)Br Amb25180872 [0,1,0,0,0,1|2,0,0]=4 3483 B8R0.23 CC(=O)N(C)CC(C)=C Amb24481797 [0,1,0,0,0,1|2,0,0]=4 3484 B8R0.23 CC(=O)NC(C(=O)N)N Amb10558230 [0,1,0,0,0,1|1,0,0]=3 3485 B8R0.23 CC(=O)NC(C(=S)N)C Amb17399904 [0,1,0,0,0,1|1,1,0]=4 3486 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,1,0,0,0,1|0,0,0]=2 3487 B8R0.23 CC(=O)NN(C)C(N)=O Amb24449373 [0,1,0,0,0,1|2,0,0]=4 3488 B8R0.23 CC(=O)N[C@@H](C)C(=O)Cl Amb25032144 [0,1,0,0,0,1|1,0,0]=3 3489 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,1,0,0,0,1|1,0,0]=3 3490 B8R0.23 CC(=O)N[C@H](C)C(N)=O Amb24478101 [0,1,0,0,0,1|1,0,0]=3 3491 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,1,0,0,0,1|0,0,0]=2 3492 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,1,0,0,0,1|0,0,0]=2 3493 B8R0.23 CC(=O)O[C@@H](C)C(N)=O Amb25733380 [0,1,0,0,0,1|1,0,0]=3 3494 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,1,0,0,0,1|0,0,0]=2 3495 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,1,0,0,0,1|0,0,0]=2 3496 B8R0.23 CC(=O)[C@@H](C)OC(C)=O Amb25205804 [0,1,0,0,0,1|1,0,0]=3 3497 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,1|0,0,0]=2 3498 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,1,0,0,0,1|0,0,0]=2 3499 B8R0.23 CC(=O)[C@H](C)NC(C)=O Amb24072918 [0,1,0,0,0,1|1,0,0]=3 3500 B8R0.23 CC(=O)\C(\C)=C/C(C)=O Amb24447751 [0,1,0,0,0,1|1,0,1]=4 3501 B8R0.23 CC(=O)\C(\C)=C\C(C)=O Amb25773462 [0,1,0,0,0,1|1,0,1]=4 3502 B8R0.23 CC(=O)\C(\C)=C\C(O)=O Amb22359749 [0,1,0,0,0,1|0,0,1]=3 3503 B8R0.23 CC(=O)\C(\C)=N/C(C)=O Amb24072927 [0,1,0,0,0,1|1,0,1]=4 3504 B8R0.23 CC(=O)\C=C(/Br)\C(O)=O Amb24739508 [0,1,0,0,0,1|0,0,1]=3 3505 B8R0.23 CC(=O)\C=C(/C)\C(O)=O Amb18642577 [0,1,0,0,0,1|0,0,1]=3 3506 B8R0.23 CC(=O)\C=C(\C)/C(O)=O Amb24582978 [0,1,0,0,0,1|0,0,1]=3 3507 B8R0.23 CC(=O)\C=C(\O)/C(O)=O Amb25856143 [0,1,0,0,0,1|0,0,1]=3 3508 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,1,0,0,0,1|0,1,0]=3 3509 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,1,0,0,0,1|0,1,0]=3 3510 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,1,0,0,0,1|1,0,1]=4 3511 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,1,0,0,0,1|1,0,1]=4 3512 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,1,0,0,0,1|1,0,1]=4 3513 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,1|1,0,1]=4 3514 B8R0.23 CC(C)=C(Br)CC(N)=O Amb24478813 [0,1,0,0,0,1|2,0,0]=4 3515 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,1,0,0,0,1|1,0,0]=3 3516 B8R0.23 CC(C)=C(Cl)CC(N)=O Amb24679667 [0,1,0,0,0,1|2,0,0]=4 3517 B8R0.23 CC(C)=CC(=O)C(O)=O Amb18642579 [0,1,0,0,0,1|1,0,1]=4 3518 B8R0.23 CC(C)=CC(C)C(C)=O Amb25749549 [0,1,0,0,0,1|2,0,0]=4 3519 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,1,0,0,0,1|1,0,0]=3 3520 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,1,0,0,0,1|1,0,0]=3 3521 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,1,0,0,0,1|1,0,1]=4 3522 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,1,0,0,0,1|1,0,1]=4 3523 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,1,0,0,0,1|1,0,1]=4 3524 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,1,0,0,0,1|1,0,1]=4 3525 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,1,0,0,0,1|1,0,1]=4 3526 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,1,0,0,0,1|1,0,1]=4 3527 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,1,0,0,0,1|1,0,1]=4 3528 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,1,0,0,0,1|1,0,1]=4 3529 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,1,0,0,0,1|1,0,1]=4 3530 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,1,0,0,0,1|1,0,1]=4 3531 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,1,0,0,0,1|1,0,1]=4 3532 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,1,0,0,0,1|1,0,1]=4 3533 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,1,0,0,0,1|1,0,1]=4 3534 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,1,0,0,0,1|1,0,1]=4 3535 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,1,0,0,0,1|1,0,1]=4 3536 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,1,0,0,0,1|1,0,1]=4 3537 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,1,0,0,0,1|1,0,1]=4 3538 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,1,0,0,0,1|1,0,1]=4 3539 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,1,0,0,0,1|1,0,1]=4 3540 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,1,0,0,0,1|1,0,1]=4 3541 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,1,0,0,0,1|1,0,1]=4 3542 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,1,0,0,0,1|1,0,1]=4 3543 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,1,0,0,0,1|1,0,1]=4 3544 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,1,0,0,0,1|1,0,1]=4 3545 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,1,0,0,0,1|1,0,1]=4 3546 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,1,0,0,0,1|2,0,0]=4 3547 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,1,0,0,0,1|1,0,1]=4 3548 B8R0.23 CC(CC(C)=O)S(C)=O Amb25712236 [0,1,0,0,0,1|2,0,0]=4 3549 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,1,0,0,0,1|1,0,1]=4 3550 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,1,0,0,0,1|1,0,1]=4 3551 B8R0.23 CC(CC(O)=O)=P(O)=O Amb25264110 [0,1,0,0,0,1|2,0,0]=4 3552 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,1|1,0,1]=4 3553 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,1,0,0,0,1|1,0,0]=3 3554 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,1,0,0,0,1|2,0,0]=4 3555 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,1,0,0,0,1|1,0,0]=3 3556 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,1,0,0,0,1|1,0,1]=4 3557 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,1,0,0,0,1|1,0,0]=3 3558 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,1,0,0,0,1|1,0,1]=4 3559 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,1,0,0,0,1|1,0,1]=4 3560 B8R0.23 CC(N)=[N+](C)CC([O-])=O Amb25339595 [0,1,0,0,0,1|1,0,1]=4 3561 B8R0.23 CC(N=C(N)S)C(O)=O Amb22229340 [0,1,0,0,0,1|1,1,0]=4 3562 B8R0.23 CC(NC(=O)Cl)C(=O)Cl Amb25049171 [0,1,0,0,0,1|2,0,0]=4 3563 B8R0.23 CC(NC(C)=O)B(O)O Amb25125858 [0,1,0,0,0,1|1,0,1]=4 3564 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,1,0,0,0,1|1,0,1]=4 3565 B8R0.23 CC(NC(N)=N)C(O)=O Amb22522920 [0,1,0,0,0,1|2,0,0]=4 3566 B8R0.23 CC(NC(S)=S)C(O)=O Amb25336384 [0,1,0,0,0,1|1,1,0]=4 3567 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,1,0,0,0,1|2,0,0]=4 3568 B8R0.23 CC(NS(C)=O)C(C)=O Amb25263940 [0,1,0,0,0,1|2,0,0]=4 3569 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,1,0,0,0,1|1,0,0]=3 3570 B8R0.23 CC(O)=CC(=O)C(O)=O Amb25047399 [0,1,0,0,0,1|0,0,2]=4 3571 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,1|0,0,2]=4 3572 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,1,0,0,0,1|1,0,1]=4 3573 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,1,0,0,0,1|0,0,2]=4 3574 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,1,0,0,0,1|0,0,2]=4 3575 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,1,0,0,0,1|0,0,2]=4 3576 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,1,0,0,0,1|1,0,1]=4 3577 B8R0.23 CC(OC(N)=S)C(O)=O Amb25732591 [0,1,0,0,0,1|1,1,0]=4 3578 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,1,0,0,0,1|1,0,1]=4 3579 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,1,0,0,0,1|0,1,1]=4 3580 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,1,0,0,0,1|2,0,0]=4 3581 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,1,0,0,0,1|2,0,0]=4 3582 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,1,0,0,0,1|2,0,0]=4 3583 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,1,0,0,0,1|2,0,0]=4 3584 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,1,0,0,0,1|2,0,0]=4 3585 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,1,0,0,0,1|2,0,0]=4 3586 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,1,0,0,0,1|2,0,0]=4 3587 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,1,0,0,0,1|2,0,0]=4 3588 B8R0.23 CN(CC(O)=O)C(N)=N Amb22002328 [0,1,0,0,0,1|2,0,0]=4 3589 B8R0.23 CN(CC(O)=O)C(N)=N Amb22167307 [0,1,0,0,0,1|2,0,0]=4 3590 B8R0.23 CN(CC(O)=O)C(N)=S Amb25115737 [0,1,0,0,0,1|1,1,0]=4 3591 B8R0.23 CN(CC(O)=O)[13C](N)=N Amb22367285 [0,1,0,0,0,1|2,0,0]=4 3592 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,1,0,0,0,1|2,0,0]=4 3593 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,1,0,0,0,1|2,0,0]=4 3594 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,1,0,0,0,1|1,0,0]=3 3595 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,1,0,0,0,1|1,0,0]=3 3596 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,1,0,0,0,1|1,0,0]=3 3597 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,1,0,0,0,1|1,0,0]=3 3598 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,1,0,0,0,1|1,0,1]=4 3599 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,1|1,0,1]=4 3600 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,1,0,0,0,1|1,0,0]=3 3601 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,1,0,0,0,1|1,0,1]=4 3602 B8R0.23 C[C@@H](NC(C)=O)B(O)O Amb24741011 [0,1,0,0,0,1|1,0,1]=4 3603 B8R0.23 C[C@@H](NC(S)=S)C(O)=O Amb25073818 [0,1,0,0,0,1|1,1,0]=4 3604 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,1,0,0,0,1|0,0,2]=4 3605 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,1,0,0,0,1|1,0,1]=4 3606 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,1,0,0,0,1|0,0,2]=4 3607 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,1,0,0,0,1|0,0,2]=4 3608 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,1,0,0,0,1|0,0,2]=4 3609 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,1,0,0,0,1|0,0,2]=4 3610 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,1,0,0,0,1|1,0,1]=4 3611 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,1,0,0,0,1|1,0,1]=4 3612 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,1,0,0,0,1|2,0,0]=4 3613 B8R0.23 C[C@H](CC(N)=O)C(N)=O Amb25126983 [0,1,0,0,0,1|2,0,0]=4 3614 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,1,0,0,0,1|1,0,0]=3 3615 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,1,0,0,0,1|1,0,0]=3 3616 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,1,0,0,0,1|1,0,1]=4 3617 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,1,0,0,0,1|1,0,1]=4 3618 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,1,0,0,0,1|1,0,1]=4 3619 B8R0.23 C[C@H](NC(N)=N)C(O)=O Amb24388432 [0,1,0,0,0,1|2,0,0]=4 3620 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,1,0,0,0,1|0,0,2]=4 3621 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,1,0,0,0,1|1,0,1]=4 3622 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,1,0,0,0,1|0,0,2]=4 3623 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,1,0,0,0,1|0,0,2]=4 3624 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,1,0,0,0,1|1,0,1]=4 3625 B8R0.23 C[C@H](OC(N)=O)C(O)=O Amb24427686 [0,1,0,0,0,1|1,0,0]=3 3626 B8R0.23 C[S+](C)CC(=O)C(O)=O Amb24524581 [0,1,0,0,0,1|2,0,0]=4 3627 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,1,0,0,0,1|2,0,0]=4 3628 B8R0.23 C\C(=C/C(C)=C)\C(O)=O Amb24523653 [0,1,0,0,0,1|1,0,1]=4 3629 B8R0.23 C\C(=C\C(N)=O)\C(O)=O Amb25199871 [0,1,0,0,0,1|1,0,1]=4 3630 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,1,0,0,0,1|1,0,0]=3 3631 B8R0.23 ClC(=O)CC(=C)C(Cl)=O Amb17938995 [0,1,0,0,0,1|2,0,0]=4 3632 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,1,0,0,0,1|1,0,1]=4 3633 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,1,0,0,0,1|1,0,1]=4 3634 B8R0.23 NC(=O)C(Br)CC(N)=O Amb24373945 [0,1,0,0,0,1|2,0,0]=4 3635 B8R0.23 NC(=O)C(N)CC(N)=O Amb18289248 [0,1,0,0,0,1|2,0,0]=4 3636 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,1,0,0,0,1|1,0,0]=3 3637 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,1,0,0,0,1|1,0,0]=3 3638 B8R0.23 NC(=O)CC(=O)C(O)=O Amb25146116 [0,1,0,0,0,1|1,0,0]=3 3639 B8R0.23 NC(=O)C[C@@H](C(=O)N)N Amb16183882 [0,1,0,0,0,1|2,0,0]=4 3640 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,1,0,0,0,1|1,0,0]=3 3641 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,1,0,0,0,1|1,0,0]=3 3642 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,1,0,0,0,1|1,0,0]=3 3643 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,1,0,0,0,1|1,0,0]=3 3644 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,1,0,0,0,1|1,0,0]=3 3645 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,1,0,0,0,1|1,0,0]=3 3646 B8R0.23 NC(=O)NC(=O)C(O)=O Amb18124345 [0,1,0,0,0,1|1,0,1]=4 3647 B8R0.23 NC(=O)NC(N)C(O)=O Amb24418886 [0,1,0,0,0,1|1,0,0]=3 3648 B8R0.23 NC(=O)NC(O)C(O)=O Amb22350130 [0,1,0,0,0,1|1,0,0]=3 3649 B8R0.23 NC(=O)NC(O)C(O)=O Amb24592607 [0,1,0,0,0,1|1,0,0]=3 3650 B8R0.23 NC(=O)[C@@H](N)CC(N)=O Amb22801077 [0,1,0,0,0,1|2,0,0]=4 3651 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,1,0,0,0,1|1,0,0]=3 3652 B8R0.23 NC(=O)[C@@H](O)CC(N)=O Amb24435465 [0,1,0,0,0,1|2,0,0]=4 3653 B8R0.23 NC(=O)[C@H](Br)CC(N)=O Amb24480049 [0,1,0,0,0,1|2,0,0]=4 3654 B8R0.23 NC(=O)\C=C(\Cl)/C(O)=O Amb24540540 [0,1,0,0,0,1|1,0,1]=4 3655 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,1,0,0,0,1|1,1,0]=4 3656 B8R0.23 NC(=S)CN(C(=O)C)C Amb17232013 [0,1,0,0,0,1|1,1,0]=4 3657 B8R0.23 NC(=S)N(N)CC(O)=O Amb24744103 [0,1,0,0,0,1|1,1,0]=4 3658 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,1,0,0,0,1|1,0,1]=4 3659 B8R0.23 NC(C=C(Cl)Cl)C(O)=O Amb22350718 [0,1,0,0,0,1|2,0,0]=4 3660 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,1,0,0,0,1|1,0,0]=3 3661 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,1,0,0,0,1|1,0,0]=3 3662 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,1,0,0,0,1|1,0,0]=3 3663 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,1,0,0,0,1|1,0,0]=3 3664 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,1,0,0,0,1|1,0,0]=3 3665 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,1,0,0,0,1|1,0,0]=3 3666 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,1,0,0,0,1|1,0,0]=3 3667 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,1,0,0,0,1|1,0,0]=3 3668 B8R0.23 NC(CC([O-])=O)C([O-])=O Amb22168247 [0,1,0,0,0,1|1,0,1]=4 3669 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,1,0,0,0,1|2,0,0]=4 3670 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,1,0,0,0,1|2,0,0]=4 3671 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,1,0,0,0,1|2,0,0]=4 3672 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,1,0,0,0,1|1,0,0]=3 3673 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,1,0,0,0,1|1,0,0]=3 3674 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,1,0,0,0,1|2,0,0]=4 3675 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,1,0,0,0,1|1,0,0]=3 3676 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,1,0,0,0,1|1,0,0]=3 3677 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,1,0,0,0,1|1,0,0]=3 3678 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,1,0,0,0,1|1,0,1]=4 3679 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,1,0,0,0,1|1,0,0]=3 3680 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,1,0,0,0,1|1,0,0]=3 3681 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,1,0,0,0,1|1,0,0]=3 3682 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,1,0,0,0,1|1,0,0]=3 3683 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,1,0,0,0,1|1,0,0]=3 3684 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,1,0,0,0,1|1,0,0]=3 3685 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,1,0,0,0,1|1,0,0]=3 3686 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb17772217 [0,1,0,0,0,1|1,0,1]=4 3687 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb17912733 [0,1,0,0,0,1|1,0,1]=4 3688 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb22750690 [0,1,0,0,0,1|1,0,1]=4 3689 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb22757383 [0,1,0,0,0,1|1,0,1]=4 3690 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,1,0,0,0,1|1,0,0]=3 3691 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,1,0,0,0,1|2,0,0]=4 3692 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,1,0,0,0,1|1,0,0]=3 3693 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,1,0,0,0,1|1,0,1]=4 3694 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,1,0,0,0,1|1,0,0]=3 3695 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,1,0,0,0,1|2,0,0]=4 3696 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,1,0,0,0,1|2,0,0]=4 3697 B8R0.23 O=C(Cl)[C@H](Cl)CC(=O)Cl Amb24710716 [0,1,0,0,0,1|2,0,0]=4 3698 B8R0.23 OC(=O)C(=S)CC(O)=O Amb25304511 [0,1,0,0,0,1|1,0,0]=3 3699 B8R0.23 OC(=O)C(Cl)C=C(Cl)Cl Amb24635775 [0,1,0,0,0,1|2,0,0]=4 3700 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,1,0,0,0,1|2,0,0]=4 3701 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,1,0,0,0,1|1,0,0]=3 3702 B8R0.23 OC(=O)C(O)C=C(Cl)Cl Amb24355502 [0,1,0,0,0,1|2,0,0]=4 3703 B8R0.23 OC(=O)C(O)CC(=O)S Amb25690206 [0,1,0,0,0,1|1,0,0]=3 3704 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,1,0,0,0,1|1,0,0]=3 3705 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,1,0,0,0,1|1,0,0]=3 3706 B8R0.23 OC(=O)CC(=C(Cl)Cl)Cl Amb2227973 [0,1,0,0,0,1|2,0,0]=4 3707 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,1,0,0,0,1|0,0,0]=2 3708 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,1,0,0,0,1|1,0,0]=3 3709 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,1,0,0,0,1|1,0,0]=3 3710 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,1,0,0,0,1|1,0,0]=3 3711 B8R0.23 OC(=O)CC([N+](=O)[O-])O Amb2222216 [0,1,0,0,0,1|2,0,0]=4 3712 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,1,0,0,0,1|0,0,0]=2 3713 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,1,0,0,0,1|1,0,0]=3 3714 B8R0.23 OC(=O)CN(C(=S)S)C Amb1042470 [0,1,0,0,0,1|1,1,0]=4 3715 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,1,0,0,0,1|1,0,0]=3 3716 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,1,0,0,0,1|0,0,2]=4 3717 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,1,0,0,0,1|1,0,0]=3 3718 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,1,0,0,0,1|1,0,0]=3 3719 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,1,0,0,0,1|1,0,0]=3 3720 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,1,0,0,0,1|1,0,0]=3 3721 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,1,0,0,0,1|1,0,0]=3 3722 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,1,0,0,0,1|1,0,0]=3 3723 B8R0.23 OC(=O)\C(\Br)=C/C(O)=O Amb25746120 [0,1,0,0,0,1|1,0,1]=4 3724 B8R0.23 OC(=O)\C(\Cl)=C/C(O)=O Amb24481892 [0,1,0,0,0,1|1,0,1]=4 3725 B8R0.23 OC(=O)\C(\F)=C/C(O)=O Amb18124397 [0,1,0,0,0,1|1,0,1]=4 3726 B8R0.23 OC(=O)\C(\I)=C/C(O)=O Amb25736420 [0,1,0,0,0,1|1,0,1]=4 3727 B8R0.23 OC(=O)\C=C(\C(=C)C)/C Amb17593311 [0,1,0,0,0,1|1,0,1]=4 3728 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,1,0,0,0,1|1,0,1]=4 3729 B8R0.23 OC(CC(=O)Cl)C(=O)Cl Amb25680528 [0,1,0,0,0,1|2,0,0]=4 3730 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,1,0,0,0,1|1,0,0]=3 3731 B8R0.23 O[C@@H](CC(=O)Cl)C(=O)Cl Amb25832731 [0,1,0,0,0,1|2,0,0]=4 3732 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,1,0,0,0,1|1,0,1]=4 3733 B8R0.23 [13CH3]N(CC(O)=O)C(N)=N Amb22367286 [0,1,0,0,0,1|2,0,0]=4 3734 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,1,0,0,0,1|1,0,1]=4 3735 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,1,0,0,0,1|1,0,0]=3 3736 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,1,0,0,0,1|1,0,0]=3 3737 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,1,0,0,0,1|1,0,0]=3 3738 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,1,0,0,0,1|1,0,0]=3 3739 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,1,0,0,0,1|1,0,0]=3 3740 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,1,0,0,0,1|1,0,0]=3 3741 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,1,0,0,0,1|1,0,0]=3 3742 B8R0.23 [O-]C(=O)C(O)CC([O-])=O Amb22230371 [0,1,0,0,0,1|1,0,1]=4 3743 B8R0.23 [O-]C(=O)C([S-])CC([O-])=O Amb22337769 [0,1,0,0,0,1|1,0,1]=4 3744 B8R0.23 [O-]C(=O)CC(O)C(O)=O Amb22734911 [0,1,0,0,0,1|1,0,0]=3 3745 B8R0.23 [O-]C(=O)[C@@H](O)CC([O-])=O Amb22351833 [0,1,0,0,0,1|1,0,1]=4 3746 B8R0.23 [O-]C(=O)[C@@H](O)CC([O-])=O Amb22801345 [0,1,0,0,0,1|1,0,1]=4 3747 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,1,0,0,0,1|1,0,1]=4 3748 B8R0.29 CC(=O)CCS(N)(=O)=O Amb25204902 [0,1,0,0,0,1|1,0,1]=4 3749 B8R0.29 CC(=O)CNS(C)(=O)=O Amb25723730 [0,1,0,0,0,1|1,0,1]=4 3750 B8R0.29 CC(=O)COS(C)(=O)=O Amb24737069 [0,1,0,0,0,1|1,0,1]=4 3751 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,1|1,0,1]=4 3752 B8R0.29 CC(=O)NCS(C)(=O)=O Amb24356559 [0,1,0,0,0,1|1,0,1]=4 3753 B8R0.29 CC(=O)NCS(O)(=O)=O Amb25235237 [0,1,0,0,0,1|1,0,0]=3 3754 B8R0.29 CC(C)(Cl)CCC(O)=O Amb18644451 [0,1,0,0,0,1|1,0,1]=4 3755 B8R0.29 CC(C)(S)CCC(O)=O Amb22489759 [0,1,0,0,0,1|0,1,1]=4 3756 B8R0.29 CC(C)([NH3+])CCC(O)=O Amb22372040 [0,1,0,0,0,1|1,0,1]=4 3757 B8R0.29 CC(C)=CCP(O)(O)=O Amb25308177 [0,1,0,0,0,1|2,0,0]=4 3758 B8R0.29 CC(N)(F)CCC(O)=O Amb24672870 [0,1,0,0,0,1|1,0,1]=4 3759 B8R0.29 CC(O)(O)NCC(O)=O Amb24715373 [0,1,0,0,0,1|0,0,2]=4 3760 B8R0.29 CS(=O)(=O)OCC(N)=O Amb24601490 [0,1,0,0,0,1|2,0,0]=4 3761 B8R0.29 CS(=O)(=O)OCC(O)=O Amb25783884 [0,1,0,0,0,1|1,0,0]=3 3762 B8R0.29 CS(=O)(=O)\C=C\C(O)=O Amb23511152 [0,1,0,0,0,1|1,0,1]=4 3763 B8R0.29 CS(C)(=O)=NCC(N)=O Amb24572132 [0,1,0,0,0,1|2,0,0]=4 3764 B8R0.29 C[N+](C)(C)CCC(O)=O Amb24117222 [0,1,0,0,0,1|2,0,0]=4 3765 B8R0.29 C[Si](C)(C)CCC(O)=O Amb19894136 [0,1,0,0,0,1|1,1,0]=4 3766 B8R0.29 C[Si](C)(C)CCC(O)=O Amb22274047 [0,1,0,0,0,1|1,1,0]=4 3767 B8R0.29 C[Si](C)(O)CCC(O)=O Amb24680973 [0,1,0,0,0,1|0,1,1]=4 3768 B8R0.29 NC(=O)CCS(O)(=O)=O Amb24678269 [0,1,0,0,0,1|2,0,0]=4 3769 B8R0.29 NC(=O)CNS(=O)(=O)C Amb17232098 [0,1,0,0,0,1|2,0,0]=4 3770 B8R0.29 NC(=O)COS(O)(=O)=O Amb24425511 [0,1,0,0,0,1|2,0,0]=4 3771 B8R0.29 NC(=O)NCP(O)(O)=O Amb25311924 [0,1,0,0,0,1|2,0,0]=4 3772 B8R0.29 OC(=O)CCC(N)(C)C Amb13951332 [0,1,0,0,0,1|1,0,1]=4 3773 B8R0.29 OC(=O)CCP(=O)(O)C Amb1792559 [0,1,0,0,0,1|1,0,0]=3 3774 B8R0.29 OC(=O)CCP(=O)(O)O Amb2228990 [0,1,0,0,0,1|2,0,0]=4 3775 B8R0.29 OC(=O)CCS(=O)(=O)Cl Amb24481869 [0,1,0,0,0,1|2,0,0]=4 3776 B8R0.29 OC(=O)CCS(=O)(=O)O Amb17399954 [0,1,0,0,0,1|2,0,0]=4 3777 B8R0.29 OC(=O)CCS(=O)(=O)S Amb24627680 [0,1,0,0,0,1|2,0,0]=4 3778 B8R0.29 OC(=O)CNC(C)(C)C Amb10610332 [0,1,0,0,0,1|1,0,1]=4 3779 B8R0.29 OC(=O)CNP(O)(O)=O Amb25831517 [0,1,0,0,0,1|2,0,0]=4 3780 B8R0.29 OC(=O)CNS(=O)(=O)C Amb1120433 [0,1,0,0,0,1|1,0,0]=3 3781 B8R0.29 OC(=O)CNS(O)(=O)=O Amb25233409 [0,1,0,0,0,1|2,0,0]=4 3782 B8R0.29 OC(=O)COCl(=O)(=O)=O Amb24532150 [0,1,0,0,0,1|2,0,0]=4 3783 B8R0.29 OC(=O)COP(O)(O)=O Amb24442945 [0,1,0,0,0,1|2,0,0]=4 3784 B8R0.29 OC(=O)COS(O)(=O)=O Amb25210824 [0,1,0,0,0,1|2,0,0]=4 3785 B8R0.29 OC(=O)CSS(=O)(=O)C Amb17610576 [0,1,0,0,0,1|1,0,0]=3 3786 B8R0.29 OC(=O)CSS(O)(=O)=O Amb24339336 [0,1,0,0,0,1|2,0,0]=4 3787 B8R0.29 OC(=O)NCP(O)(=O)=O Amb22359211 [0,1,0,0,0,1|2,0,0]=4 3788 B8R0.2 C=C(C(=O)NO)C(O)=O Amb24340135 [0,2,0,0,0,0|1,0,1]=4 3789 B8R0.2 C=C(C(N)=O)C(=O)NO Amb24674027 [0,2,0,0,0,0|1,0,1]=4 3790 B8R0.2 C=C(C=C)[C@H](N)C(O)=O Amb24580353 [0,2,0,0,0,0|1,0,1]=4 3791 B8R0.2 CC(=C(O)CC)C(C)=O Amb25264815 [0,2,0,0,0,0|1,0,1]=4 3792 B8R0.2 CC(=C)C(C)C(=O)C#N Amb24454401 [0,2,0,0,0,0|2,0,0]=4 3793 B8R0.2 CC(=C)C(C)C(=O)CO Amb25262676 [0,2,0,0,0,0|1,0,0]=3 3794 B8R0.2 CC(=C)C(C)C(=O)NC Amb24477751 [0,2,0,0,0,0|2,0,0]=4 3795 B8R0.2 CC(=C)[C@@H](N)C(=O)OC Amb24744947 [0,2,0,0,0,0|1,0,0]=3 3796 B8R0.2 CC(=NO)C(C)C(C)=O Amb24572272 [0,2,0,0,0,0|1,0,0]=3 3797 B8R0.2 CC(=NO)C(C)C(N)=O Amb24476690 [0,2,0,0,0,0|1,0,1]=4 3798 B8R0.2 CC(=O)C(=C)C(=O)OC Amb22734869 [0,2,0,0,0,0|0,0,1]=3 3799 B8R0.2 CC(=O)C(Br)C(=O)OC Amb22499701 [0,2,0,0,0,0|0,0,0]=2 3800 B8R0.2 CC(=O)C(C)=C(C)C=O Amb25275053 [0,2,0,0,0,0|1,0,1]=4 3801 B8R0.2 CC(=O)C(C)C(=O)NC Amb25303120 [0,2,0,0,0,0|1,0,0]=3 3802 B8R0.2 CC(=O)C(C)C(=O)NO Amb24096632 [0,2,0,0,0,0|0,0,0]=2 3803 B8R0.2 CC(=O)C(C)C(=O)SC Amb25334908 [0,2,0,0,0,0|0,1,0]=3 3804 B8R0.2 CC(=O)C(C)C(=S)SC Amb25842196 [0,2,0,0,0,0|0,2,0]=4 3805 B8R0.2 CC(=O)C(Cl)C(=C)OC Amb24480172 [0,2,0,0,0,0|1,0,0]=3 3806 B8R0.2 CC(=O)C(Cl)C(=O)CC Amb24373790 [0,2,0,0,0,0|1,0,0]=3 3807 B8R0.2 CC(=O)C(N)C(=O)CC Amb24744767 [0,2,0,0,0,0|1,0,0]=3 3808 B8R0.2 CC(=O)C(N)C(=O)NC Amb25146054 [0,2,0,0,0,0|1,0,0]=3 3809 B8R0.2 CC(=O)C(N)C(=O)OC Amb21520335 [0,2,0,0,0,0|0,0,0]=2 3810 B8R0.2 CC(=O)C(N)C(=O)OC Amb22491080 [0,2,0,0,0,0|0,0,0]=2 3811 B8R0.2 CC(=O)C(O)C(=O)CO Amb25082771 [0,2,0,0,0,0|0,0,0]=2 3812 B8R0.2 CC(=O)C(O)C(O)C=O Amb24633454 [0,2,0,0,0,0|0,0,1]=3 3813 B8R0.2 CC(=O)N(C)C(=O)CCl Amb25743997 [0,2,0,0,0,0|2,0,0]=4 3814 B8R0.2 CC(=O)N(C)C(=O)CN Amb24073565 [0,2,0,0,0,0|2,0,0]=4 3815 B8R0.2 CC(=O)[C-](C)C(=O)OC Amb24422496 [0,2,0,0,0,0|0,0,1]=3 3816 B8R0.2 CC(=O)[C@@H](O)[C@@H](O)C=O Amb25032290 [0,2,0,0,0,0|0,0,1]=3 3817 B8R0.2 CC(=O)[C@H](C)C(=O)OC Amb24378331 [0,2,0,0,0,0|0,0,0]=2 3818 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,2,0,0,0,0|0,0,0]=2 3819 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,2,0,0,0,0|0,0,2]=4 3820 B8R0.2 CC(C#C)C(N)C(O)=O Amb25726710 [0,2,0,0,0,0|1,0,1]=4 3821 B8R0.2 CC(C#C)C(O)C(O)=O Amb24417906 [0,2,0,0,0,0|1,0,1]=4 3822 B8R0.2 CC(C(=O)CC)=C(C)O Amb25234472 [0,2,0,0,0,0|1,0,1]=4 3823 B8R0.2 CC(C(C)Br)C(=O)OC Amb25046683 [0,2,0,0,0,0|1,0,1]=4 3824 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,2,0,0,0,0|1,0,1]=4 3825 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,2,0,0,0,0|1,0,1]=4 3826 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,2,0,0,0,0|1,0,1]=4 3827 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,2,0,0,0,0|0,0,1]=3 3828 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,2,0,0,0,0|1,0,1]=4 3829 B8R0.2 CC(C(C)Cl)C(=O)OC Amb24635801 [0,2,0,0,0,0|1,0,1]=4 3830 B8R0.2 CC(C(C)N)C(=O)NO Amb24355745 [0,2,0,0,0,0|1,0,1]=4 3831 B8R0.2 CC(C(C)N)C(=O)OC Amb18642841 [0,2,0,0,0,0|1,0,1]=4 3832 B8R0.2 CC(C(C)O)C(=O)OC Amb22059109 [0,2,0,0,0,0|0,0,2]=4 3833 B8R0.2 CC(C(C)S)C(=O)OC Amb25682049 [0,2,0,0,0,0|0,1,1]=4 3834 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,2,0,0,0,0|1,0,1]=4 3835 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,2,0,0,0,0|1,0,1]=4 3836 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,2,0,0,0,0|1,0,1]=4 3837 B8R0.2 CC(C(O)=O)=C(Br)C=O Amb24571694 [0,2,0,0,0,0|1,0,1]=4 3838 B8R0.2 CC(C(O)=O)=C(Cl)CC Amb24719968 [0,2,0,0,0,0|1,0,1]=4 3839 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,2,0,0,0,0|1,0,0]=3 3840 B8R0.2 CC(C(O)=O)N(C)N=O Amb25041960 [0,2,0,0,0,0|1,0,0]=3 3841 B8R0.2 CC(C([O-])=O)C(=O)NN Amb25274275 [0,2,0,0,0,0|1,0,1]=4 3842 B8R0.2 CC(C)=C(C)C(=O)OC Amb25706600 [0,2,0,0,0,0|1,0,1]=4 3843 B8R0.2 CC(C)C(Cl)C(=O)OC Amb18799367 [0,2,0,0,0,0|1,0,1]=4 3844 B8R0.2 CC(C)C(F)C(=O)NO Amb25092451 [0,2,0,0,0,0|1,0,1]=4 3845 B8R0.2 CC(C)C(F)C(=O)OC Amb25144176 [0,2,0,0,0,0|1,0,1]=4 3846 B8R0.2 CC(C)C(N)C(=O)OCl Amb25211695 [0,2,0,0,0,0|1,0,1]=4 3847 B8R0.2 CC(C)C(O)C(=O)NO Amb25071171 [0,2,0,0,0,0|1,0,1]=4 3848 B8R0.2 CC(C)C(O)C(=O)OC Amb24093829 [0,2,0,0,0,0|1,0,1]=4 3849 B8R0.2 CC(C)[C@@H](N)C(=O)NO Amb24476696 [0,2,0,0,0,0|1,0,1]=4 3850 B8R0.2 CC(C)[C@@H](O)C(=O)OC Amb22388621 [0,2,0,0,0,0|1,0,1]=4 3851 B8R0.2 CC(C)[C@H](N)C(=O)OBr Amb25337637 [0,2,0,0,0,0|1,0,1]=4 3852 B8R0.2 CC(C)[C@H](O)C(=O)OC Amb22228179 [0,2,0,0,0,0|1,0,1]=4 3853 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,2,0,0,0,0|1,0,1]=4 3854 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,2,0,0,0,0|1,0,1]=4 3855 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,2,0,0,0,0|1,0,1]=4 3856 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,2,0,0,0,0|1,0,1]=4 3857 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,2,0,0,0,0|0,0,1]=3 3858 B8R0.2 CC(CC)=C(F)C(O)=O Amb25305731 [0,2,0,0,0,0|1,0,1]=4 3859 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,2,0,0,0,0|1,0,1]=4 3860 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,2,0,0,0,0|1,0,1]=4 3861 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,2,0,0,0,0|1,0,1]=4 3862 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,2,0,0,0,0|1,0,1]=4 3863 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,2,0,0,0,0|1,0,1]=4 3864 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,2,0,0,0,0|1,0,1]=4 3865 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,2,0,0,0,0|1,0,1]=4 3866 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,2,0,0,0,0|1,0,1]=4 3867 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,2,0,0,0,0|1,0,1]=4 3868 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,2,0,0,0,0|1,0,1]=4 3869 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,2,0,0,0,0|1,0,1]=4 3870 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,2,0,0,0,0|0,0,2]=4 3871 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,2,0,0,0,0|0,0,2]=4 3872 B8R0.2 CC(Cl)C(Br)C(=O)OC Amb25123870 [0,2,0,0,0,0|1,0,1]=4 3873 B8R0.2 CC(Cl)C(N)C(=O)OC Amb18644494 [0,2,0,0,0,0|1,0,1]=4 3874 B8R0.2 CC(Cl)C(S)C(=O)OC Amb24595377 [0,2,0,0,0,0|1,0,1]=4 3875 B8R0.2 CC(F)C(Br)C(=O)OC Amb25086610 [0,2,0,0,0,0|1,0,1]=4 3876 B8R0.2 CC(F)C(O)C(=O)OC Amb24648246 [0,2,0,0,0,0|1,0,1]=4 3877 B8R0.2 CC(N)=C(Cl)C(=O)OC Amb25340460 [0,2,0,0,0,0|1,0,1]=4 3878 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,2,0,0,0,0|1,0,1]=4 3879 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,2,0,0,0,0|1,0,1]=4 3880 B8R0.2 CC(O)C(Br)C(=O)OC Amb24415051 [0,2,0,0,0,0|0,0,2]=4 3881 B8R0.2 CC(O)C(Cl)C(=O)OC Amb25269533 [0,2,0,0,0,0|0,0,2]=4 3882 B8R0.2 CC(O)C(F)C(=O)OC Amb24481911 [0,2,0,0,0,0|0,0,2]=4 3883 B8R0.2 CC(O)C(N)C(=O)NC Amb24705029 [0,2,0,0,0,0|1,0,1]=4 3884 B8R0.2 CC(O)[C@H](N)C(=O)NC Amb25366384 [0,2,0,0,0,0|1,0,1]=4 3885 B8R0.2 CC(O)[C@H](N)C(=O)OC Amb25213074 [0,2,0,0,0,0|0,0,2]=4 3886 B8R0.2 CC(OC)=C(Cl)C(C)=O Amb24631620 [0,2,0,0,0,0|1,0,1]=4 3887 B8R0.2 CC(OC)C(Cl)C(C)=O Amb24480084 [0,2,0,0,0,0|1,0,1]=4 3888 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,2,0,0,0,0|0,0,2]=4 3889 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,2,0,0,0,0|0,1,1]=4 3890 B8R0.2 CC([C@@H](C)O)C(=O)OC Amb25077967 [0,2,0,0,0,0|0,0,2]=4 3891 B8R0.2 CC([C@H](C)O)C(=O)OC Amb25788911 [0,2,0,0,0,0|0,0,2]=4 3892 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,2,0,0,0,0|1,0,0]=3 3893 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,2,0,0,0,0|1,0,0]=3 3894 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,2,0,0,0,0|1,0,0]=3 3895 B8R0.2 CCC(=O)C(=O)C(=O)C Amb17593337 [0,2,0,0,0,0|1,0,1]=4 3896 B8R0.2 CCC(=O)C(C)C(=O)Cl Amb24340219 [0,2,0,0,0,0|1,0,0]=3 3897 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,2,0,0,0,0|1,0,0]=3 3898 B8R0.2 CCC(=O)C(C)C(N)=O Amb24524504 [0,2,0,0,0,0|1,0,0]=3 3899 B8R0.2 CCC(=O)C(C)S(C)=O Amb24394596 [0,2,0,0,0,0|2,0,0]=4 3900 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,2,0,0,0,0|0,1,0]=3 3901 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,2,0,0,0,0|1,0,1]=4 3902 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,2,0,0,0,0|0,0,2]=4 3903 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,2,0,0,0,0|1,0,1]=4 3904 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,2,0,0,0,0|1,0,1]=4 3905 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,2,0,0,0,0|1,0,1]=4 3906 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,2,0,0,0,0|0,0,2]=4 3907 B8R0.2 CCC(O)C(O)C(C)=O Amb24736298 [0,2,0,0,0,0|1,0,1]=4 3908 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,2,0,0,0,0|0,0,2]=4 3909 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,2,0,0,0,0|0,0,2]=4 3910 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,2,0,0,0,0|0,0,2]=4 3911 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,2,0,0,0,0|0,1,1]=4 3912 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,2,0,0,0,0|0,1,1]=4 3913 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,2,0,0,0,0|1,0,1]=4 3914 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,2,0,0,0,0|1,0,1]=4 3915 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,2,0,0,0,0|1,0,1]=4 3916 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,2,0,0,0,0|2,0,0]=4 3917 B8R0.2 CCS(=O)C(C)C(C)=O Amb25772477 [0,2,0,0,0,0|2,0,0]=4 3918 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,2,0,0,0,0|1,0,0]=3 3919 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,2,0,0,0,0|1,0,1]=4 3920 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,2,0,0,0,0|0,0,2]=4 3921 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,2,0,0,0,0|0,0,2]=4 3922 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,2,0,0,0,0|0,0,2]=4 3923 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,2,0,0,0,0|1,0,1]=4 3924 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,2,0,0,0,0|1,0,1]=4 3925 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,2,0,0,0,0|1,0,1]=4 3926 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,2,0,0,0,0|1,0,1]=4 3927 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,2,0,0,0,0|1,0,1]=4 3928 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,2,0,0,0,0|1,0,1]=4 3929 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,2,0,0,0,0|1,0,1]=4 3930 B8R0.2 CN(C(=O)F)C(=O)CCl Amb24406678 [0,2,0,0,0,0|2,0,0]=4 3931 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,2,0,0,0,0|1,0,0]=3 3932 B8R0.2 CNC(=O)C(=O)C(O)=O Amb25075425 [0,2,0,0,0,0|0,0,1]=3 3933 B8R0.2 CNC(=O)C(N)C(N)=O Amb18124333 [0,2,0,0,0,0|1,0,0]=3 3934 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,2,0,0,0,0|1,0,1]=4 3935 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,2,0,0,0,0|1,0,1]=4 3936 B8R0.2 COC(=O)C(=C(C)C)Br Amb17610027 [0,2,0,0,0,0|1,0,1]=4 3937 B8R0.2 COC(=O)C(=O)C(=O)C Amb17569865 [0,2,0,0,0,0|0,0,1]=3 3938 B8R0.2 COC(=O)C(=O)C(O)=O Amb18124343 [0,2,0,0,0,0|0,0,1]=3 3939 B8R0.2 COC(=O)C(C(C)C)N Amb1104996 [0,2,0,0,0,0|1,0,1]=4 3940 B8R0.2 COC(=O)C(C)C(C)=O Amb17939472 [0,2,0,0,0,0|0,0,0]=2 3941 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,2,0,0,0,0|0,0,0]=2 3942 B8R0.2 COC(=O)C(C)S(=O)Cl Amb24725099 [0,2,0,0,0,0|2,0,0]=4 3943 B8R0.2 COC(=O)C(C)S(C)=O Amb18181669 [0,2,0,0,0,0|1,0,0]=3 3944 B8R0.2 COC(=O)C(C)S([O-])=O Amb24626145 [0,2,0,0,0,0|1,0,1]=4 3945 B8R0.2 COC(=O)C(C)[N+]([O-])=O Amb25322922 [0,2,0,0,0,0|1,0,1]=4 3946 B8R0.2 COC(=O)C(Cl)C(=O)Cl Amb24373872 [0,2,0,0,0,0|1,0,0]=3 3947 B8R0.2 COC(=O)C(Cl)C(N)=O Amb24589473 [0,2,0,0,0,0|1,0,0]=3 3948 B8R0.2 COC(=O)C(F)C(N)=O Amb24587657 [0,2,0,0,0,0|1,0,0]=3 3949 B8R0.2 COC(=O)C(N)C(=C)N Amb24542847 [0,2,0,0,0,0|1,0,1]=4 3950 B8R0.2 COC(=O)C(N)C(N)=O Amb24478682 [0,2,0,0,0,0|1,0,0]=3 3951 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,2,0,0,0,0|0,0,0]=2 3952 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,2,0,0,0,0|0,0,0]=2 3953 B8R0.2 COC(=O)N(Cl)C(N)=O Amb24480054 [0,2,0,0,0,0|2,0,0]=4 3954 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb10604149 [0,2,0,0,0,0|1,0,1]=4 3955 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb16183873 [0,2,0,0,0,0|1,0,1]=4 3956 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,2,0,0,0,0|0,0,0]=2 3957 B8R0.2 COC(=O)[C@H]([C@H](O)C)N Amb10844890 [0,2,0,0,0,0|0,0,2]=4 3958 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,2,0,0,0,0|0,0,2]=4 3959 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,2,0,0,0,0|0,0,2]=4 3960 B8R0.2 COC(C)=C(C)C(C)=O Amb24678123 [0,2,0,0,0,0|1,0,1]=4 3961 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,2,0,0,0,0|0,0,2]=4 3962 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,2,0,0,0,0|0,0,2]=4 3963 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,2,0,0,0,0|0,0,2]=4 3964 B8R0.2 CO[C@@H](Cl)[C@H](Cl)C(C)=O Amb25162294 [0,2,0,0,0,0|1,0,1]=4 3965 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,2,0,0,0,0|0,0,2]=4 3966 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,2,0,0,0,0|0,0,2]=4 3967 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,2,0,0,0,0|0,0,2]=4 3968 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,2,0,0,0,0|0,0,2]=4 3969 B8R0.2 CO\C(\C)=C(/C)\C(C)=O Amb25683972 [0,2,0,0,0,0|1,0,1]=4 3970 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,2,0,0,0,0|0,1,1]=4 3971 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,2,0,0,0,0|0,1,1]=4 3972 B8R0.2 C[C@@H](C#C)[C@H](N)C(O)=O Amb25783160 [0,2,0,0,0,0|1,0,1]=4 3973 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,2,0,0,0,0|1,0,0]=3 3974 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,2,0,0,0,0|1,0,1]=4 3975 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,2,0,0,0,0|0,0,1]=3 3976 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,2,0,0,0,0|1,0,1]=4 3977 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,2,0,0,0,0|1,0,1]=4 3978 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,2,0,0,0,0|1,0,1]=4 3979 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,2,0,0,0,0|1,0,1]=4 3980 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,2,0,0,0,0|1,0,1]=4 3981 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,2,0,0,0,0|1,0,1]=4 3982 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,2,0,0,0,0|1,0,1]=4 3983 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,2,0,0,0,0|1,0,1]=4 3984 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,2,0,0,0,0|0,0,2]=4 3985 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,2,0,0,0,0|0,0,2]=4 3986 B8R0.2 C[C@@H](Cl)[C@@H](N)C(=O)NO Amb24694002 [0,2,0,0,0,0|1,0,1]=4 3987 B8R0.2 C[C@@H](Cl)[C@H](Cl)C(=O)OC Amb24366616 [0,2,0,0,0,0|1,0,1]=4 3988 B8R0.2 C[C@@H](Cl)[C@H](O)C(=O)OC Amb25347697 [0,2,0,0,0,0|1,0,1]=4 3989 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,2,0,0,0,0|1,0,1]=4 3990 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,2,0,0,0,0|1,0,1]=4 3991 B8R0.2 C[C@@H](O)[C@@H](Cl)C(=O)OC Amb24479996 [0,2,0,0,0,0|0,0,2]=4 3992 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)OC Amb22744992 [0,2,0,0,0,0|0,0,2]=4 3993 B8R0.2 C[C@@H](O)[C@@H](O)C(=O)OC Amb25320663 [0,2,0,0,0,0|0,0,2]=4 3994 B8R0.2 C[C@@H](O)[C@H](Br)C(=O)OC Amb25109342 [0,2,0,0,0,0|0,0,2]=4 3995 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NC Amb24671233 [0,2,0,0,0,0|1,0,1]=4 3996 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,2,0,0,0,0|0,0,2]=4 3997 B8R0.2 C[C@@H](O)[C@H](O)C(=O)CO Amb24625788 [0,2,0,0,0,0|0,0,2]=4 3998 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,2,0,0,0,0|0,0,2]=4 3999 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,2,0,0,0,0|0,0,2]=4 4000 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,2,0,0,0,0|0,0,2]=4 4001 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,2,0,0,0,0|0,0,2]=4 4002 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,2,0,0,0,0|0,1,1]=4 4003 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,2,0,0,0,0|1,0,1]=4 4004 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,2,0,0,0,0|0,0,1]=3 4005 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,2,0,0,0,0|0,0,2]=4 4006 B8R0.2 C[C@@H]([C@@H](C)N)C(=O)OC Amb24698063 [0,2,0,0,0,0|1,0,1]=4 4007 B8R0.2 C[C@@H]([C@@H](C)O)C(=O)OC Amb24363609 [0,2,0,0,0,0|0,0,2]=4 4008 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,2,0,0,0,0|0,0,2]=4 4009 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,2,0,0,0,0|1,0,1]=4 4010 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,2,0,0,0,0|0,0,2]=4 4011 B8R0.2 C[C@H](C(C)Br)C(=O)OC Amb25061347 [0,2,0,0,0,0|1,0,1]=4 4012 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,2,0,0,0,0|1,0,1]=4 4013 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,2,0,0,0,0|1,0,1]=4 4014 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,2,0,0,0,0|1,0,1]=4 4015 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,2,0,0,0,0|1,0,1]=4 4016 B8R0.2 C[C@H](C=O)[C@@H](O)C(C)=O Amb25768475 [0,2,0,0,0,0|1,0,1]=4 4017 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,2,0,0,0,0|1,0,1]=4 4018 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,2,0,0,0,0|1,0,1]=4 4019 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,2,0,0,0,0|1,0,1]=4 4020 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,2,0,0,0,0|1,0,1]=4 4021 B8R0.2 C[C@H](Cl)[C@@H](N)C(=O)OC Amb24366062 [0,2,0,0,0,0|1,0,1]=4 4022 B8R0.2 C[C@H](Cl)[C@H](O)C(=O)OC Amb24479929 [0,2,0,0,0,0|1,0,1]=4 4023 B8R0.2 C[C@H](N)C(O)C(=O)OC Amb25238441 [0,2,0,0,0,0|1,0,1]=4 4024 B8R0.2 C[C@H](N)[C@H](O)C(=O)OC Amb24477818 [0,2,0,0,0,0|1,0,1]=4 4025 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,2,0,0,0,0|1,0,1]=4 4026 B8R0.2 C[C@H](O)C(N)C(=O)OC Amb25302264 [0,2,0,0,0,0|0,0,2]=4 4027 B8R0.2 C[C@H](O)[C@@H](N)C(=O)NO Amb25063917 [0,2,0,0,0,0|0,0,2]=4 4028 B8R0.2 C[C@H](O)[C@@H](O)C(=O)OC Amb25763009 [0,2,0,0,0,0|0,0,2]=4 4029 B8R0.2 C[C@H](O)[C@H](O)C(=O)OC Amb25327481 [0,2,0,0,0,0|0,0,2]=4 4030 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,2,0,0,0,0|0,0,2]=4 4031 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,2,0,0,0,0|0,0,2]=4 4032 B8R0.2 C[C@H](S)[C@@H](N)C(=O)OC Amb24420424 [0,2,0,0,0,0|0,1,1]=4 4033 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,2,0,0,0,0|1,0,1]=4 4034 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,2,0,0,0,0|1,0,1]=4 4035 B8R0.2 C[C@H]([C@H](C)O)C(=O)CC Amb25086603 [0,2,0,0,0,0|1,0,1]=4 4036 B8R0.2 C[C@H]([C@H](C)O)C(=O)OC Amb25762229 [0,2,0,0,0,0|0,0,2]=4 4037 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,2,0,0,0,0|1,0,1]=4 4038 B8R0.2 C\C(=C(\O)/CC)\C(C)=O Amb25318800 [0,2,0,0,0,0|1,0,1]=4 4039 B8R0.2 C\C(=C/C)\C(C)C(C)=O Amb24689489 [0,2,0,0,0,0|2,0,0]=4 4040 B8R0.2 C\C(=C/C)\C(C)C(N)=O Amb24477780 [0,2,0,0,0,0|2,0,0]=4 4041 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,2,0,0,0,0|1,0,0]=3 4042 B8R0.2 C\C(=C/C)\C(O)C(C)=O Amb25708298 [0,2,0,0,0,0|2,0,0]=4 4043 B8R0.2 C\C(=C/C)\C(O)C(N)=O Amb25082841 [0,2,0,0,0,0|2,0,0]=4 4044 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,2,0,0,0,0|1,0,0]=3 4045 B8R0.2 C\C(=C\C)\C(O)C(C)=O Amb24561282 [0,2,0,0,0,0|2,0,0]=4 4046 B8R0.2 C\C(=C\C)\C(O)C(N)=O Amb25243454 [0,2,0,0,0,0|2,0,0]=4 4047 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,2,0,0,0,0|1,0,0]=3 4048 B8R0.2 C\C(\C(=O)CC)=C(/C)\O Amb25373297 [0,2,0,0,0,0|1,0,1]=4 4049 B8R0.2 C\C(\C(=O)OC)=C(\C)/N Amb24340241 [0,2,0,0,0,0|1,0,1]=4 4050 B8R0.2 C\C(\C(O)=O)=C(\Br)/C=O Amb25200989 [0,2,0,0,0,0|1,0,1]=4 4051 B8R0.2 C\C(\OC)=C(\Cl)/C(C)=O Amb25024494 [0,2,0,0,0,0|1,0,1]=4 4052 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,2,0,0,0,0|0,0,2]=4 4053 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,2,0,0,0,0|0,0,2]=4 4054 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,2,0,0,0,0|0,0,2]=4 4055 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,2,0,0,0,0|1,0,1]=4 4056 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,2,0,0,0,0|1,0,1]=4 4057 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,2,0,0,0,0|1,0,1]=4 4058 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,2,0,0,0,0|1,0,1]=4 4059 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,2,0,0,0,0|0,0,2]=4 4060 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,2,0,0,0,0|0,0,2]=4 4061 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,2,0,0,0,0|0,0,2]=4 4062 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,2,0,0,0,0|0,0,2]=4 4063 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,2,0,0,0,0|1,0,1]=4 4064 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,2,0,0,0,0|0,0,2]=4 4065 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,2,0,0,0,0|0,0,2]=4 4066 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,2,0,0,0,0|1,0,1]=4 4067 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,2,0,0,0,0|0,0,2]=4 4068 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,2,0,0,0,0|0,0,2]=4 4069 B8R0.2 N[C@H](C(=O)NO)C(O)=O Amb24476649 [0,2,0,0,0,0|1,0,0]=3 4070 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,2,0,0,0,0|1,0,1]=4 4071 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,2,0,0,0,0|0,0,2]=4 4072 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,2,0,0,0,0|0,0,2]=4 4073 B8R0.2 O=C(Cl)C(Cl)C(=O)CCl Amb24433455 [0,2,0,0,0,0|1,0,0]=3 4074 B8R0.2 O=C\C(=C(\C(=O)O)/Br)\Br Amb1981387 [0,2,0,0,0,0|1,0,1]=4 4075 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,2,0,0,0,0|1,0,1]=4 4076 B8R0.2 OC(=O)C(Cl)=C(Br)C=O Amb24591769 [0,2,0,0,0,0|1,0,1]=4 4077 B8R0.2 OC(=O)C(O)=C(Cl)C=O Amb24518465 [0,2,0,0,0,0|1,0,1]=4 4078 B8R0.2 OC(=O)\C(\Cl)=C(/Cl)\C=O Amb18602727 [0,2,0,0,0,0|1,0,1]=4 4079 B8R0.2 OC(=O)\C(\Cl)=C(\Br)/C=O Amb18657499 [0,2,0,0,0,0|1,0,1]=4 4080 B8R0.2 OC(=O)\C(\O)=C(\Cl)/C=O Amb25361999 [0,2,0,0,0,0|1,0,1]=4 4081 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,2,0,0,0,0|1,0,1]=4 4082 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,2,0,0,0,0|0,0,2]=4 4083 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,2,0,0,0,0|0,0,2]=4 4084 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,2,0,0,0,0|0,0,2]=4 4085 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,2,0,0,0,0|0,0,2]=4 4086 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,2,0,0,0,0|0,0,2]=4 4087 B8R0.2 ONC(=O)C(C(C)C)N Amb2439843 [0,2,0,0,0,0|1,0,1]=4 4088 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,2,0,0,0,0|0,0,2]=4 4089 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,2,0,0,0,0|0,0,2]=4 4090 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,2,0,0,0,0|0,1,1]=4 4091 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,2,0,0,0,0|1,0,1]=4 4092 B8R0.2 [O-][N+](=O)C(C(=O)CC)C Amb17618436 [0,2,0,0,0,0|1,0,1]=4 4093 B8R0.5 C#CCS(=O)CC(O)=O Amb24417332 [0,2,0,0,0,0|1,0,0]=3 4094 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,2,0,0,0,0|1,0,1]=4 4095 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,2,0,0,0,0|1,0,1]=4 4096 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,2,0,0,0,0|1,0,1]=4 4097 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,2,0,0,0,0|1,0,1]=4 4098 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [0,2,0,0,0,0|1,0,0]=3 4099 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,2,0,0,0,0|1,0,1]=4 4100 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,2,0,0,0,0|0,0,2]=4 4101 B8R0.5 C=CCS(=O)CC(=O)O Amb10608086 [0,2,0,0,0,0|1,0,0]=3 4102 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,2,0,0,0,0|1,0,1]=4 4103 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,2,0,0,0,0|1,0,1]=4 4104 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,2,0,0,0,0|1,0,1]=4 4105 B8R0.5 CC#CC(O)CC(C)=O Amb24736733 [0,2,0,0,0,0|1,0,1]=4 4106 B8R0.5 CC(=C)CC(=O)CCC Amb24377405 [0,2,0,0,0,0|2,0,0]=4 4107 B8R0.5 CC(=C)CC(=O)CCN Amb24496397 [0,2,0,0,0,0|2,0,0]=4 4108 B8R0.5 CC(=C)CC(=O)COC Amb25142356 [0,2,0,0,0,0|1,0,0]=3 4109 B8R0.5 CC(=C)CC(=O)NOC Amb24573843 [0,2,0,0,0,0|1,0,0]=3 4110 B8R0.5 CC(=C)NC(=O)OCC Amb25324994 [0,2,0,0,0,0|2,0,0]=4 4111 B8R0.5 CC(=CC(C)=O)NOC Amb24713475 [0,2,0,0,0,0|1,0,1]=4 4112 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [0,2,0,0,0,0|0,0,2]=4 4113 B8R0.5 CC(=CC(O)=O)SCC Amb25229812 [0,2,0,0,0,0|0,1,1]=4 4114 B8R0.5 CC(=O)C=C(N)COC Amb24540259 [0,2,0,0,0,0|1,0,1]=4 4115 B8R0.5 CC(=O)C=C(N)OCC Amb24561013 [0,2,0,0,0,0|1,0,1]=4 4116 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [0,2,0,0,0,0|1,0,0]=3 4117 B8R0.5 CC(=O)CC(=O)C=NO Amb25298403 [0,2,0,0,0,0|0,0,0]=2 4118 B8R0.5 CC(=O)CC(=O)CC#N Amb24456593 [0,2,0,0,0,0|1,0,0]=3 4119 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [0,2,0,0,0,0|1,0,0]=3 4120 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,2,0,0,0,0|0,0,0]=2 4121 B8R0.5 CC(=O)CC(=O)NC=O Amb24096615 [0,2,0,0,0,0|0,0,1]=3 4122 B8R0.5 CC(=O)CC(=O)NOC Amb24096697 [0,2,0,0,0,0|0,0,0]=2 4123 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,2,0,0,0,0|0,0,0]=2 4124 B8R0.5 CC(=O)CC(=O)OOC Amb24096083 [0,2,0,0,0,0|0,0,0]=2 4125 B8R0.5 CC(=O)CC(=O)\C=C\C Amb25807638 [0,2,0,0,0,0|1,0,0]=3 4126 B8R0.5 CC(=O)CC(=O)\C=N\O Amb25713027 [0,2,0,0,0,0|0,0,0]=2 4127 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [0,2,0,0,0,0|0,1,0]=3 4128 B8R0.5 CC(=O)CC(Cl)=CCCl Amb25056100 [0,2,0,0,0,0|2,0,0]=4 4129 B8R0.5 CC(=O)C[C@H](O)CCBr Amb24634001 [0,2,0,0,0,0|1,0,1]=4 4130 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,2,0,0,0,0|0,0,2]=4 4131 B8R0.5 CC(=O)C\C(\Br)=C\CCl Amb24370172 [0,2,0,0,0,0|2,0,0]=4 4132 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,2,0,0,0,0|2,0,0]=4 4133 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,2,0,0,0,0|2,0,0]=4 4134 B8R0.5 CC(=O)NC(=O)C#CBr Amb25046989 [0,2,0,0,0,0|2,0,0]=4 4135 B8R0.5 CC(=O)NC(=O)CCBr Amb25188997 [0,2,0,0,0,0|2,0,0]=4 4136 B8R0.5 CC(=O)NC(=O)CCC Amb25324995 [0,2,0,0,0,0|2,0,0]=4 4137 B8R0.5 CC(=O)NC(=O)CNC Amb24593410 [0,2,0,0,0,0|2,0,0]=4 4138 B8R0.5 CC(=O)NC(=O)\C=C\C Amb25266462 [0,2,0,0,0,0|2,0,0]=4 4139 B8R0.5 CC(=O)NC(=S)OCC Amb24356625 [0,2,0,0,0,0|1,1,0]=4 4140 B8R0.5 CC(=O)OC(=O)CC#N Amb25676428 [0,2,0,0,0,0|2,0,0]=4 4141 B8R0.5 CC(=O)OC(=O)NC#N Amb25772946 [0,2,0,0,0,0|2,0,0]=4 4142 B8R0.5 CC(=O)\C=C(/N)\COC Amb24340140 [0,2,0,0,0,0|1,0,1]=4 4143 B8R0.5 CC(=O)\C=C(/N)\OCC Amb24451604 [0,2,0,0,0,0|1,0,1]=4 4144 B8R0.5 CC(=O)\C=C(\C)/C=C=O Amb24437418 [0,2,0,0,0,0|1,0,1]=4 4145 B8R0.5 CC(C)=CC(=O)C=NO Amb24721718 [0,2,0,0,0,0|1,0,1]=4 4146 B8R0.5 CC(C)=CC(=O)NOC Amb25746848 [0,2,0,0,0,0|1,0,1]=4 4147 B8R0.5 CC(C)CC(=O)OC=C Amb25333598 [0,2,0,0,0,0|1,0,1]=4 4148 B8R0.5 CC(C)CC(=O)\C=C/O Amb24466975 [0,2,0,0,0,0|1,0,1]=4 4149 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,2,0,0,0,0|1,0,1]=4 4150 B8R0.5 CC(CC(C)=C)=CCO Amb25847843 [0,2,0,0,0,0|2,0,0]=4 4151 B8R0.5 CC(CC(C)=O)=CC#N Amb24602998 [0,2,0,0,0,0|2,0,0]=4 4152 B8R0.5 CC(CC(C)=O)=CCCl Amb24581453 [0,2,0,0,0,0|2,0,0]=4 4153 B8R0.5 CC(CC(C)=O)=NOC Amb25179533 [0,2,0,0,0,0|1,0,0]=3 4154 B8R0.5 CC(CC(C)=O)NC=O Amb24477804 [0,2,0,0,0,0|1,0,1]=4 4155 B8R0.5 CC(CC(O)=O)NC=O Amb18967805 [0,2,0,0,0,0|0,0,1]=3 4156 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,2,0,0,0,0|1,0,1]=4 4157 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,2,0,0,0,0|1,0,1]=4 4158 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,2,0,0,0,0|1,0,1]=4 4159 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,2,0,0,0,0|1,0,1]=4 4160 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,2,0,0,0,0|0,0,2]=4 4161 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,2,0,0,0,0|1,0,1]=4 4162 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,2,0,0,0,0|0,0,2]=4 4163 B8R0.5 CC(CCS)=CC(O)=O Amb25328912 [0,2,0,0,0,0|0,1,1]=4 4164 B8R0.5 CC(CNC)=CC(O)=O Amb25126794 [0,2,0,0,0,0|1,0,1]=4 4165 B8R0.5 CC(CNO)=CC(O)=O Amb25702672 [0,2,0,0,0,0|0,0,2]=4 4166 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,2,0,0,0,0|0,0,2]=4 4167 B8R0.5 CC(CSC)=CC(O)=O Amb25364860 [0,2,0,0,0,0|0,1,1]=4 4168 B8R0.5 CC(Cl)CC(=O)OC=C Amb25684807 [0,2,0,0,0,0|1,0,1]=4 4169 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,2,0,0,0,0|1,0,1]=4 4170 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,2,0,0,0,0|1,0,0]=3 4171 B8R0.5 CCCC(=O)CC(C)O Amb24676902 [0,2,0,0,0,0|1,0,1]=4 4172 B8R0.5 CCCC(=O)C[C@@H](C)O Amb24645371 [0,2,0,0,0,0|1,0,1]=4 4173 B8R0.5 CCCC(=O)C[C@H](C)O Amb25767694 [0,2,0,0,0,0|1,0,1]=4 4174 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,2,0,0,0,0|1,0,1]=4 4175 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,2,0,0,0,0|1,0,1]=4 4176 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,2,0,0,0,0|1,0,1]=4 4177 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,2,0,0,0,0|1,0,1]=4 4178 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,2,0,0,0,0|2,0,0]=4 4179 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,2,0,0,0,0|1,0,0]=3 4180 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,2,0,0,0,0|1,0,1]=4 4181 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,2,0,0,0,0|1,0,1]=4 4182 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,2,0,0,0,0|1,0,1]=4 4183 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,2,0,0,0,0|1,0,1]=4 4184 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,2,0,0,0,0|1,0,1]=4 4185 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,2,0,0,0,0|0,0,2]=4 4186 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,2,0,0,0,0|1,0,1]=4 4187 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,2,0,0,0,0|0,0,2]=4 4188 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,2,0,0,0,0|1,0,1]=4 4189 B8R0.5 CCNC(=N)CC(N)=O Amb25769007 [0,2,0,0,0,0|2,0,0]=4 4190 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,2,0,0,0,0|0,0,0]=2 4191 B8R0.5 CCNC(=O)CC(N)=N Amb22913272 [0,2,0,0,0,0|2,0,0]=4 4192 B8R0.5 CCNC(=O)C[C@H](C)O Amb24540634 [0,2,0,0,0,0|1,0,1]=4 4193 B8R0.5 CCNC(=O)NC(N)=O Amb24120354 [0,2,0,0,0,0|2,0,0]=4 4194 B8R0.5 CCNC(=S)CC([O-])=O Amb25771930 [0,2,0,0,0,0|0,1,1]=4 4195 B8R0.5 CCOC(=O)CB(O)O Amb25050326 [0,2,0,0,0,0|1,0,1]=4 4196 B8R0.5 CCOC(=O)CC(=N)Cl Amb25847101 [0,2,0,0,0,0|2,0,0]=4 4197 B8R0.5 CCOC(=O)CC(=S)N Amb1154429 [0,2,0,0,0,0|1,1,0]=4 4198 B8R0.5 CCOC(=O)CC(C)=C Amb17940814 [0,2,0,0,0,0|1,0,0]=3 4199 B8R0.5 CCOC(=O)CC(C)Br Amb17940889 [0,2,0,0,0,0|1,0,1]=4 4200 B8R0.5 CCOC(=O)CC(C)S Amb19515282 [0,2,0,0,0,0|0,1,1]=4 4201 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,2,0,0,0,0|0,0,0]=2 4202 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,2,0,0,0,0|0,0,0]=2 4203 B8R0.5 CCOC(=O)CN(=O)=O Amb17781240 [0,2,0,0,0,0|1,0,1]=4 4204 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [0,2,0,0,0,0|1,0,0]=3 4205 B8R0.5 CCOC(=O)CS(C)C Amb22351352 [0,2,0,0,0,0|2,0,0]=4 4206 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,2,0,0,0,0|0,0,0]=2 4207 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,2,0,0,0,0|0,0,0]=2 4208 B8R0.5 CCOC(=O)C[C@H](C)Cl Amb24479960 [0,2,0,0,0,0|1,0,1]=4 4209 B8R0.5 CCOC(=O)NC(N)=O Amb19884044 [0,2,0,0,0,0|2,0,0]=4 4210 B8R0.5 CCOC(=O)OC(N)=O Amb25809405 [0,2,0,0,0,0|2,0,0]=4 4211 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,2,0,0,0,0|0,0,0]=2 4212 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,2,0,0,0,0|1,0,1]=4 4213 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,2,0,0,0,0|0,0,0]=2 4214 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,2,0,0,0,0|0,0,0]=2 4215 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,2,0,0,0,0|0,0,0]=2 4216 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [0,2,0,0,0,0|0,0,2]=4 4217 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,2,0,0,0,0|0,0,2]=4 4218 B8R0.5 CCSC(=O)CC(C)O Amb25120018 [0,2,0,0,0,0|1,0,1]=4 4219 B8R0.5 CCSC(=O)NC(N)=O Amb24444690 [0,2,0,0,0,0|2,0,0]=4 4220 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,2,0,0,0,0|2,0,0]=4 4221 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,2,0,0,0,0|2,0,0]=4 4222 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,2,0,0,0,0|2,0,0]=4 4223 B8R0.5 CN(C)CC(=O)NCO Amb24072681 [0,2,0,0,0,0|2,0,0]=4 4224 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,2,0,0,0,0|2,0,0]=4 4225 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,2,0,0,0,0|2,0,0]=4 4226 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,2,0,0,0,0|2,0,0]=4 4227 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,2,0,0,0,0|1,0,1]=4 4228 B8R0.5 CNNC(=N)CC(O)=O Amb25226519 [0,2,0,0,0,0|1,0,0]=3 4229 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,2,0,0,0,0|0,0,0]=2 4230 B8R0.5 COCC(=O)CC(C)C Amb19301970 [0,2,0,0,0,0|1,0,1]=4 4231 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,2,0,0,0,0|0,0,0]=2 4232 B8R0.5 COCC(=O)CN(C)C Amb25096062 [0,2,0,0,0,0|2,0,0]=4 4233 B8R0.5 COCC(=O)CS(C)=O Amb25736407 [0,2,0,0,0,0|1,0,0]=3 4234 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,2,0,0,0,0|0,0,2]=4 4235 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,2,0,0,0,0|1,0,1]=4 4236 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,2,0,0,0,0|0,0,2]=4 4237 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,2,0,0,0,0|0,0,2]=4 4238 B8R0.5 CONC(=O)CC(C)C Amb24478582 [0,2,0,0,0,0|1,0,1]=4 4239 B8R0.5 CONC(=O)CN(C)C Amb24096699 [0,2,0,0,0,0|2,0,0]=4 4240 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,2,0,0,0,0|1,0,1]=4 4241 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,2,0,0,0,0|0,0,2]=4 4242 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,2,0,0,0,0|0,1,1]=4 4243 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,2,0,0,0,0|0,0,0]=2 4244 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,2,0,0,0,0|1,0,1]=4 4245 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,2,0,0,0,0|0,0,2]=4 4246 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,2,0,0,0,0|1,0,1]=4 4247 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [0,2,0,0,0,0|1,0,1]=4 4248 B8R0.5 C\C(=C/C(O)=O)\C#CC Amb24644658 [0,2,0,0,0,0|1,0,1]=4 4249 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [0,2,0,0,0,0|1,0,1]=4 4250 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [0,2,0,0,0,0|0,0,2]=4 4251 B8R0.5 C\C(\C=NO)=C\C(C)=O Amb24679863 [0,2,0,0,0,0|1,0,1]=4 4252 B8R0.5 C\C(\C=N\O)=C/C(C)=O Amb25735799 [0,2,0,0,0,0|1,0,1]=4 4253 B8R0.5 C\C(\CC(C)=O)=C/OC Amb24334053 [0,2,0,0,0,0|1,0,0]=3 4254 B8R0.5 C\C(\CC(C)=O)=C\OC Amb24580390 [0,2,0,0,0,0|1,0,0]=3 4255 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,2,0,0,0,0|1,0,0]=3 4256 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,2,0,0,0,0|1,0,0]=3 4257 B8R0.5 C\C(\CC(O)=O)=C\CS Amb18124785 [0,2,0,0,0,0|0,1,0]=3 4258 B8R0.5 C\C(\CC=C)=C\C(O)=O Amb25810544 [0,2,0,0,0,0|1,0,1]=4 4259 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,2,0,0,0,0|1,0,1]=4 4260 B8R0.5 C\C(\CNC)=C/C(O)=O Amb24384927 [0,2,0,0,0,0|1,0,1]=4 4261 B8R0.5 C\C(\I)=C/C(=O)OCC Amb22503728 [0,2,0,0,0,0|1,0,1]=4 4262 B8R0.5 C\C(\I)=C\C(=O)OCC Amb25790655 [0,2,0,0,0,0|1,0,1]=4 4263 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22053734 [0,2,0,0,0,0|0,0,2]=4 4264 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22456709 [0,2,0,0,0,0|0,0,2]=4 4265 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22733216 [0,2,0,0,0,0|0,0,2]=4 4266 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,2,0,0,0,0|1,0,1]=4 4267 B8R0.5 C\C=C\C(O)CC(C)=O Amb24676886 [0,2,0,0,0,0|1,0,1]=4 4268 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,2,0,0,0,0|1,0,1]=4 4269 B8R0.5 C\C=C\[C@@H](O)CC(C)=O Amb25143519 [0,2,0,0,0,0|1,0,1]=4 4270 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,2,0,0,0,0|0,0,2]=4 4271 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,2,0,0,0,0|1,0,1]=4 4272 B8R0.5 N#CCS(=O)CC(O)=O Amb18984975 [0,2,0,0,0,0|1,0,0]=3 4273 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,2,0,0,0,0|0,0,2]=4 4274 B8R0.5 NC(=O)CS(=O)CC#N Amb25708974 [0,2,0,0,0,0|2,0,0]=4 4275 B8R0.5 NC(=O)CS(=O)CCCl Amb24751567 [0,2,0,0,0,0|2,0,0]=4 4276 B8R0.5 NC(=O)CS(=O)CCO Amb24502237 [0,2,0,0,0,0|2,0,0]=4 4277 B8R0.5 NC(=O)NC(=O)CCBr Amb24085887 [0,2,0,0,0,0|2,0,0]=4 4278 B8R0.5 NC(=O)NC(=O)CCN Amb20623770 [0,2,0,0,0,0|2,0,0]=4 4279 B8R0.5 NC(=O)NC(=O)CCN Amb22058738 [0,2,0,0,0,0|2,0,0]=4 4280 B8R0.5 NCCS(=O)CC(O)=O Amb25124054 [0,2,0,0,0,0|1,0,0]=3 4281 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,2,0,0,0,0|1,0,1]=4 4282 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,2,0,0,0,0|1,0,1]=4 4283 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,2,0,0,0,0|1,0,1]=4 4284 B8R0.5 OC(=O)CS(=O)CCF Amb25094766 [0,2,0,0,0,0|1,0,0]=3 4285 B8R0.5 OCCN(CC(=O)C)C Amb10608107 [0,2,0,0,0,0|2,0,0]=4 4286 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [0,2,0,0,0,0|0,0,1]=3 4287 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,2,0,0,0,0|1,0,1]=4 4288 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,2,0,0,0,0|1,0,1]=4 4289 B8R0.16 CC(=C)C\C(\C=O)=C\C Amb24640290 [0,2,0,0,0,0|2,0,0]=4 4290 B8R0.16 CC(=O)C=C(CC)C=O Amb24518412 [0,2,0,0,0,0|1,0,1]=4 4291 B8R0.16 CC(=O)C=C(CC)OC Amb24529216 [0,2,0,0,0,0|1,0,1]=4 4292 B8R0.16 CC(=O)C=C(NC)OC Amb24666747 [0,2,0,0,0,0|1,0,1]=4 4293 B8R0.16 CC(=O)CC(=CBr)OC Amb25210500 [0,2,0,0,0,0|1,0,0]=3 4294 B8R0.16 CC(=O)CC(C=O)C=O Amb25767018 [0,2,0,0,0,0|0,0,2]=4 4295 B8R0.16 CC(=O)CC(CC)=CC Amb24551554 [0,2,0,0,0,0|2,0,0]=4 4296 B8R0.16 CC(=O)CN(C=O)C=O Amb24429291 [0,2,0,0,0,0|1,0,1]=4 4297 B8R0.16 CC(=O)NC(C=O)=CN Amb24476691 [0,2,0,0,0,0|2,0,0]=4 4298 B8R0.16 CC(=O)NC(C=O)=CO Amb24598757 [0,2,0,0,0,0|1,0,0]=3 4299 B8R0.16 CC(=O)N[C@@H](CO)C=O Amb24761306 [0,2,0,0,0,0|1,0,1]=4 4300 B8R0.16 CC(=O)N[C@H](CO)C=O Amb25145985 [0,2,0,0,0,0|1,0,1]=4 4301 B8R0.16 CC(=O)N\C(\C#N)=N\O Amb25742958 [0,2,0,0,0,0|2,0,0]=4 4302 B8R0.16 CC(=O)N\C(\C=C)=N\O Amb25249213 [0,2,0,0,0,0|2,0,0]=4 4303 B8R0.16 CC(=O)N\C(\C=O)=C/O Amb25124880 [0,2,0,0,0,0|1,0,0]=3 4304 B8R0.16 CC(=O)OC(C=O)=CO Amb24682735 [0,2,0,0,0,0|1,0,0]=3 4305 B8R0.16 CC(=O)O\C(\C=O)=C/C Amb25785198 [0,2,0,0,0,0|2,0,0]=4 4306 B8R0.16 CC(=O)O\C(\C=O)=C/O Amb24480316 [0,2,0,0,0,0|1,0,0]=3 4307 B8R0.16 CC(=O)O\C(\C=O)=C\C Amb25242615 [0,2,0,0,0,0|2,0,0]=4 4308 B8R0.16 CC(=O)\C=C(/CC)\OC Amb24580486 [0,2,0,0,0,0|1,0,1]=4 4309 B8R0.16 CC(=O)\C=C(/CCl)\OC Amb25285740 [0,2,0,0,0,0|1,0,1]=4 4310 B8R0.16 CC(=O)\C=C(\NC)/OC Amb24602912 [0,2,0,0,0,0|1,0,1]=4 4311 B8R0.16 CCC(CC(C)=O)C=O Amb18642641 [0,2,0,0,0,0|1,0,1]=4 4312 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,2,0,0,0,0|1,0,1]=4 4313 B8R0.16 CCC(CC(N)=O)=CC Amb24610057 [0,2,0,0,0,0|2,0,0]=4 4314 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,2,0,0,0,0|1,0,1]=4 4315 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,2,0,0,0,0|0,0,1]=3 4316 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,2,0,0,0,0|0,0,2]=4 4317 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,2,0,0,0,0|1,0,1]=4 4318 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,2,0,0,0,0|0,0,2]=4 4319 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,2,0,0,0,0|0,1,1]=4 4320 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,2,0,0,0,0|1,0,1]=4 4321 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,2,0,0,0,0|1,0,1]=4 4322 B8R0.16 CCN(CC(O)=O)C=O Amb18972736 [0,2,0,0,0,0|1,0,0]=3 4323 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [0,2,0,0,0,0|2,0,0]=4 4324 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [0,2,0,0,0,0|2,0,0]=4 4325 B8R0.16 CC[C@H](CC(C)=O)C=O Amb25687293 [0,2,0,0,0,0|1,0,1]=4 4326 B8R0.16 CC\C(\C=C)=C/C(O)=O Amb25368328 [0,2,0,0,0,0|1,0,1]=4 4327 B8R0.16 CC\C(\C=O)=C/C(O)=O Amb18642578 [0,2,0,0,0,0|0,0,1]=3 4328 B8R0.16 CC\C(\C=O)=C\C(O)=O Amb25770561 [0,2,0,0,0,0|0,0,1]=3 4329 B8R0.16 CC\C(\CC(O)=O)=C/C Amb18642626 [0,2,0,0,0,0|1,0,0]=3 4330 B8R0.16 CC\[N+](\CC(O)=O)=N\[O-] Amb25365958 [0,2,0,0,0,0|1,0,1]=4 4331 B8R0.16 COC(CC(C)=O)C=O Amb25798334 [0,2,0,0,0,0|0,0,1]=3 4332 B8R0.16 COC(CC(O)=O)C=C Amb18642791 [0,2,0,0,0,0|1,0,1]=4 4333 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,2,0,0,0,0|0,0,2]=4 4334 B8R0.16 COC(CC(O)=O)OC Amb22231899 [0,2,0,0,0,0|0,0,2]=4 4335 B8R0.16 COC(CCl)=CC(O)=O Amb25690575 [0,2,0,0,0,0|0,0,2]=4 4336 B8R0.16 CO[C@H](CC(C)=C)C=O Amb25370693 [0,2,0,0,0,0|1,0,1]=4 4337 B8R0.16 CO[C@H](CC(O)=O)C#C Amb25773997 [0,2,0,0,0,0|1,0,1]=4 4338 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [0,2,0,0,0,0|0,0,2]=4 4339 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [0,2,0,0,0,0|0,1,1]=4 4340 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [0,2,0,0,0,0|0,1,1]=4 4341 B8R0.16 OC(=O)C=C(CBr)CBr Amb24481720 [0,2,0,0,0,0|1,0,1]=4 4342 B8R0.16 OC(=O)C=C(CO)CO Amb25112732 [0,2,0,0,0,0|0,0,2]=4 4343 B8R0.16 OC(=O)CC(C=O)C=O Amb24577569 [0,2,0,0,0,0|0,0,2]=4 4344 B8R0.16 OC(=O)\C=C(\CCl)/C=O Amb24656100 [0,2,0,0,0,0|0,0,1]=3 4345 B8R0.19 C=CC(=O)NC(=O)CCl Amb24378568 [0,2,0,0,0,0|2,0,0]=4 4346 B8R0.19 CC(=CC(=O)OC)NC Amb24401759 [0,2,0,0,0,0|1,0,1]=4 4347 B8R0.19 CC(=CC(=O)OC)OC Amb24534136 [0,2,0,0,0,0|0,0,2]=4 4348 B8R0.19 CC(C#N)CC(=O)OC Amb17334095 [0,2,0,0,0,0|1,0,1]=4 4349 B8R0.19 CC(CC(=C)C=O)C=O Amb24334526 [0,2,0,0,0,0|1,0,1]=4 4350 B8R0.19 CC(CC(=O)OC)=CBr Amb24635219 [0,2,0,0,0,0|1,0,0]=3 4351 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [0,2,0,0,0,0|1,0,0]=3 4352 B8R0.19 CC(CC(=O)OC)=CCl Amb24511859 [0,2,0,0,0,0|1,0,0]=3 4353 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [0,2,0,0,0,0|1,0,0]=3 4354 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,2,0,0,0,0|1,0,1]=4 4355 B8R0.19 CCC(=C)CC(=O)C#N Amb24690781 [0,2,0,0,0,0|2,0,0]=4 4356 B8R0.19 CCC(=C)CC(=O)C=C Amb24638472 [0,2,0,0,0,0|2,0,0]=4 4357 B8R0.19 CCC(=C)CC(=O)CN Amb25329097 [0,2,0,0,0,0|2,0,0]=4 4358 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [0,2,0,0,0,0|2,0,0]=4 4359 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,2,0,0,0,0|0,0,0]=2 4360 B8R0.19 CCC(=O)CC(C)C=O Amb18642639 [0,2,0,0,0,0|1,0,1]=4 4361 B8R0.19 CCC(=O)CC(C)CO Amb25050722 [0,2,0,0,0,0|1,0,1]=4 4362 B8R0.19 CCC(=O)CC(Cl)=CC Amb24617724 [0,2,0,0,0,0|2,0,0]=4 4363 B8R0.19 CCC(=O)CC(O)C#N Amb25319924 [0,2,0,0,0,0|1,0,1]=4 4364 B8R0.19 CCC(=O)CC(O)OC Amb25065360 [0,2,0,0,0,0|0,0,2]=4 4365 B8R0.19 CCC(=O)C[C@@H](O)CCl Amb24340137 [0,2,0,0,0,0|1,0,1]=4 4366 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [0,2,0,0,0,0|1,0,1]=4 4367 B8R0.19 CCC(=O)C[C@H](O)CCl Amb25359848 [0,2,0,0,0,0|1,0,1]=4 4368 B8R0.19 CCC(=O)NC(=O)CC Amb17940302 [0,2,0,0,0,0|2,0,0]=4 4369 B8R0.19 CCC(=O)NC(=O)NN Amb25363467 [0,2,0,0,0,0|2,0,0]=4 4370 B8R0.19 CCC(=O)OC(=O)CCl Amb25261522 [0,2,0,0,0,0|2,0,0]=4 4371 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,2,0,0,0,0|1,0,1]=4 4372 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,2,0,0,0,0|1,0,1]=4 4373 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,2,0,0,0,0|1,0,1]=4 4374 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,2,0,0,0,0|0,0,2]=4 4375 B8R0.19 CCN(O)CC(=O)OC Amb25259900 [0,2,0,0,0,0|1,0,1]=4 4376 B8R0.19 CCS(=O)CC(=O)CC Amb25361921 [0,2,0,0,0,0|2,0,0]=4 4377 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [0,2,0,0,0,0|1,0,0]=3 4378 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,2,0,0,0,0|1,0,1]=4 4379 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,2,0,0,0,0|0,0,2]=4 4380 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [0,2,0,0,0,0|1,0,1]=4 4381 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,2,0,0,0,0|0,0,2]=4 4382 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,2,0,0,0,0|1,0,1]=4 4383 B8R0.19 CN(CC(=O)NN)N=O Amb24501459 [0,2,0,0,0,0|2,0,0]=4 4384 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [0,2,0,0,0,0|1,0,1]=4 4385 B8R0.19 CN(N=O)CC(=O)OC Amb17618624 [0,2,0,0,0,0|1,0,0]=3 4386 B8R0.19 CNC(=N)NC(=O)OC Amb24592585 [0,2,0,0,0,0|2,0,0]=4 4387 B8R0.19 CNC(=O)CC(=O)CCl Amb25808925 [0,2,0,0,0,0|1,0,0]=3 4388 B8R0.19 CNC(=O)CC(=O)NN Amb1980865 [0,2,0,0,0,0|1,0,0]=3 4389 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,2,0,0,0,0|0,0,0]=2 4390 B8R0.19 CNC(=O)CC(=S)NC Amb25228213 [0,2,0,0,0,0|1,1,0]=4 4391 B8R0.19 CNC(=O)CC(C)OC Amb24673256 [0,2,0,0,0,0|1,0,1]=4 4392 B8R0.19 CNC(=O)CC(O)CN Amb24442697 [0,2,0,0,0,0|1,0,1]=4 4393 B8R0.19 CNC(=O)CN(C)N=O Amb25062791 [0,2,0,0,0,0|2,0,0]=4 4394 B8R0.19 CNC(=O)CN(C)OC Amb24619120 [0,2,0,0,0,0|2,0,0]=4 4395 B8R0.19 CNC(=O)NC(=O)CI Amb24611633 [0,2,0,0,0,0|2,0,0]=4 4396 B8R0.19 CNC(=O)NC(=O)NC Amb24120421 [0,2,0,0,0,0|2,0,0]=4 4397 B8R0.19 CNC(=O)NC(=O)OC Amb24540421 [0,2,0,0,0,0|1,0,0]=3 4398 B8R0.19 CNC(=O)NC(=O)SC Amb24447001 [0,2,0,0,0,0|1,1,0]=4 4399 B8R0.19 CNC(=O)NC(=S)OC Amb25146082 [0,2,0,0,0,0|1,1,0]=4 4400 B8R0.19 CNC(=S)SC(=O)OC Amb24479933 [0,2,0,0,0,0|1,1,0]=4 4401 B8R0.19 CN\C(=C/C(=O)OC)\C Amb2386651 [0,2,0,0,0,0|1,0,1]=4 4402 B8R0.19 COC(=N)CC(=N)OC Amb21857807 [0,2,0,0,0,0|2,0,0]=4 4403 B8R0.19 COC(=N)CC(=N)OC Amb24700148 [0,2,0,0,0,0|2,0,0]=4 4404 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,2,0,0,0,0|1,0,0]=3 4405 B8R0.19 COC(=N)NC(=O)OC Amb24760898 [0,2,0,0,0,0|2,0,0]=4 4406 B8R0.19 COC(=O)CC(=C)C#N Amb18642277 [0,2,0,0,0,0|1,0,1]=4 4407 B8R0.19 COC(=O)CC(=C)C=O Amb24434902 [0,2,0,0,0,0|0,0,1]=3 4408 B8R0.19 COC(=O)CC(=C)CCl Amb24053257 [0,2,0,0,0,0|1,0,0]=3 4409 B8R0.19 COC(=O)CC(=O)C=C Amb17593339 [0,2,0,0,0,0|0,0,1]=3 4410 B8R0.19 COC(=O)CC(=O)C=O Amb25827200 [0,2,0,0,0,0|0,0,1]=3 4411 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [0,2,0,0,0,0|0,0,0]=2 4412 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [0,2,0,0,0,0|0,0,0]=2 4413 B8R0.19 COC(=O)CC(=O)NN Amb22491081 [0,2,0,0,0,0|1,0,0]=3 4414 B8R0.19 COC(=O)CC(Br)C=O Amb18647814 [0,2,0,0,0,0|1,0,1]=4 4415 B8R0.19 COC(=O)CC(Br)CF Amb24627105 [0,2,0,0,0,0|1,0,1]=4 4416 B8R0.19 COC(=O)CC(C)C=C Amb24712566 [0,2,0,0,0,0|1,0,1]=4 4417 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,2,0,0,0,0|0,0,1]=3 4418 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,2,0,0,0,0|1,0,1]=4 4419 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,2,0,0,0,0|1,0,1]=4 4420 B8R0.19 COC(=O)CC(C)CO Amb24729571 [0,2,0,0,0,0|0,0,2]=4 4421 B8R0.19 COC(=O)CC(C)NO Amb25032324 [0,2,0,0,0,0|0,0,2]=4 4422 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,2,0,0,0,0|0,1,1]=4 4423 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,2,0,0,0,0|1,0,1]=4 4424 B8R0.19 COC(=O)CC(N)CN Amb25766036 [0,2,0,0,0,0|1,0,1]=4 4425 B8R0.19 COC(=O)CC(N)CO Amb24366077 [0,2,0,0,0,0|1,0,1]=4 4426 B8R0.19 COC(=O)CC(O)C=C Amb25746682 [0,2,0,0,0,0|1,0,1]=4 4427 B8R0.19 COC(=O)CC(O)CBr Amb25201054 [0,2,0,0,0,0|0,0,2]=4 4428 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,2,0,0,0,0|0,0,2]=4 4429 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,2,0,0,0,0|0,0,2]=4 4430 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,2,0,0,0,0|1,0,1]=4 4431 B8R0.19 COC(=O)CN(C)C#N Amb24481702 [0,2,0,0,0,0|2,0,0]=4 4432 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [0,2,0,0,0,0|1,0,0]=3 4433 B8R0.19 COC(=O)CN(C)C=O Amb22349764 [0,2,0,0,0,0|1,0,0]=3 4434 B8R0.19 COC(=O)CS(=O)CCl Amb24582180 [0,2,0,0,0,0|1,0,0]=3 4435 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,2,0,0,0,0|0,0,2]=4 4436 B8R0.19 COC(=O)C[C@@H](CO)O Amb13883661 [0,2,0,0,0,0|0,0,2]=4 4437 B8R0.19 COC(=O)C[C@@H](O)C=C Amb24705874 [0,2,0,0,0,0|1,0,1]=4 4438 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,2,0,0,0,0|0,0,2]=4 4439 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,2,0,0,0,0|0,0,2]=4 4440 B8R0.19 COC(=O)C[C@H](C)CBr Amb25249104 [0,2,0,0,0,0|1,0,1]=4 4441 B8R0.19 COC(=O)C[C@H](N)CN Amb24360537 [0,2,0,0,0,0|1,0,1]=4 4442 B8R0.19 COC(=O)C[C@H](N)CO Amb24561636 [0,2,0,0,0,0|1,0,1]=4 4443 B8R0.19 COC(=O)C[C@H](O)C#C Amb24748370 [0,2,0,0,0,0|1,0,1]=4 4444 B8R0.19 COC(=O)C[C@H](O)C=C Amb25788939 [0,2,0,0,0,0|1,0,1]=4 4445 B8R0.19 COC(=O)NC(=O)CF Amb24609035 [0,2,0,0,0,0|1,0,0]=3 4446 B8R0.19 COC(=O)NC(=O)CI Amb20668254 [0,2,0,0,0,0|1,0,0]=3 4447 B8R0.19 COC(=O)NC(=O)OC Amb25103686 [0,2,0,0,0,0|1,0,0]=3 4448 B8R0.19 COC(=O)NC(C)C=O Amb24359055 [0,2,0,0,0,0|1,0,1]=4 4449 B8R0.19 COC(=O)OC(=O)OC Amb20240544 [0,2,0,0,0,0|1,0,0]=3 4450 B8R0.19 COC(=O)\C=C(/Br)\C=O Amb18129838 [0,2,0,0,0,0|1,0,1]=4 4451 B8R0.19 COC(=O)\C=C(/Cl)\C=O Amb25063146 [0,2,0,0,0,0|1,0,1]=4 4452 B8R0.19 COC(=O)\C=C(\Br)/C=O Amb24513011 [0,2,0,0,0,0|1,0,1]=4 4453 B8R0.19 COC(=O)\C=C(\Cl)/C=O Amb25278210 [0,2,0,0,0,0|1,0,1]=4 4454 B8R0.19 COC(=O)\C=C(\Cl)/CBr Amb25383404 [0,2,0,0,0,0|1,0,1]=4 4455 B8R0.19 COC(=O)\C=C(\N)/CF Amb25368302 [0,2,0,0,0,0|1,0,1]=4 4456 B8R0.19 COC(C)CC(=O)NO Amb24476739 [0,2,0,0,0,0|0,0,2]=4 4457 B8R0.19 COC(N)=NC(=O)SC Amb25146036 [0,2,0,0,0,0|2,0,0]=4 4458 B8R0.19 CSC(=O)NC(=O)CCl Amb25265267 [0,2,0,0,0,0|1,1,0]=4 4459 B8R0.19 C\C(=C/C(=O)CC)\OC Amb24646507 [0,2,0,0,0,0|1,0,1]=4 4460 B8R0.19 C\C(=C/C(=O)OC)\OC Amb21927982 [0,2,0,0,0,0|0,0,2]=4 4461 B8R0.19 C\C(=C\C(=O)NC)\OC Amb24654254 [0,2,0,0,0,0|1,0,1]=4 4462 B8R0.19 C\C(=C\C(=O)OC)\C#N Amb24463763 [0,2,0,0,0,0|1,0,1]=4 4463 B8R0.19 C\C(=C\C(=O)OC)\O[Na] Amb22731349 [0,2,0,0,0,0|0,0,2]=4 4464 B8R0.19 C\C(\C=O)=C/C(=O)OC Amb25702407 [0,2,0,0,0,0|0,0,1]=3 4465 B8R0.19 C\C(\C=O)=C\C(=O)OC Amb18642569 [0,2,0,0,0,0|0,0,1]=3 4466 B8R0.19 C\C(\CC(=O)C=C)=C\C Amb25093521 [0,2,0,0,0,0|2,0,0]=4 4467 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [0,2,0,0,0,0|2,0,0]=4 4468 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [0,2,0,0,0,0|1,0,0]=3 4469 B8R0.19 C\C(\CC(=O)OC)=C\Cl Amb25210836 [0,2,0,0,0,0|1,0,0]=3 4470 B8R0.19 C\C(\CCl)=C\C(=O)OC Amb25230685 [0,2,0,0,0,0|1,0,1]=4 4471 B8R0.19 C\C(\CO)=C/C(=O)CC Amb25319713 [0,2,0,0,0,0|1,0,1]=4 4472 B8R0.19 ClCC(=O)NC(=O)NC Amb2370485 [0,2,0,0,0,0|2,0,0]=4 4473 B8R0.19 ClCC(=O)NC(=O)OC Amb1152897 [0,2,0,0,0,0|1,0,0]=3 4474 B8R0.19 N#CC(=O)CC(=O)C#N Amb25319958 [0,2,0,0,0,0|1,0,1]=4 4475 B8R0.19 NCC(=O)NC(=O)CN Amb25146149 [0,2,0,0,0,0|2,0,0]=4 4476 B8R0.19 NCC(=O)OC(=O)CN Amb22284829 [0,2,0,0,0,0|2,0,0]=4 4477 B8R0.19 NCC(=O)OC(=O)CO Amb25063748 [0,2,0,0,0,0|1,0,0]=3 4478 B8R0.19 NCC(O)CC(=O)NO Amb25203640 [0,2,0,0,0,0|0,0,2]=4 4479 B8R0.19 NNC(=O)CC(=O)O[K] Amb16224796 [0,2,0,0,0,0|1,0,0]=3 4480 B8R0.19 NNC(=O)NC(=O)CO Amb25743427 [0,2,0,0,0,0|2,0,0]=4 4481 B8R0.19 NNC(=O)NC(=O)CS Amb24589078 [0,2,0,0,0,0|2,0,0]=4 4482 B8R0.19 O=C(CBr)OC(=O)CBr Amb20076004 [0,2,0,0,0,0|2,0,0]=4 4483 B8R0.19 O=C(CC(=O)CCl)CCl Amb25738744 [0,2,0,0,0,0|1,0,0]=3 4484 B8R0.19 O=C(CC(=O)O[K])O[K] Amb20246887 [0,2,0,0,0,0|1,0,0]=3 4485 B8R0.19 O=C(CCl)NC(=O)CBr Amb24502202 [0,2,0,0,0,0|2,0,0]=4 4486 B8R0.19 O=C(CCl)SC(=O)CCl Amb24557828 [0,2,0,0,0,0|2,0,0]=4 4487 B8R0.19 O=C(CF)OC(=O)CBr Amb24480268 [0,2,0,0,0,0|2,0,0]=4 4488 B8R0.19 O=C(CF)OC(=O)CF Amb25324724 [0,2,0,0,0,0|2,0,0]=4 4489 B8R0.19 O=C(CS)NC(=O)CS Amb25289222 [0,2,0,0,0,0|1,1,0]=4 4490 B8R0.19 OC(CCl)=CC(=O)CCl Amb24340258 [0,2,0,0,0,0|1,0,1]=4 4491 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,2,0,0,0,0|0,0,0]=2 4492 B8R0.19 OCC(=O)NC(=O)CS Amb24563913 [0,2,0,0,0,0|1,0,0]=3 4493 B8R0.19 O[C@@H](CC(=O)CO)CO Amb24387900 [0,2,0,0,0,0|0,0,2]=4 4494 B8R0.24 CC(C)(O)CC(=O)CBr Amb25088426 [0,2,0,0,0,0|1,0,1]=4 4495 B8R0.24 CC(C)(O)CC(=O)NO Amb24502214 [0,2,0,0,0,0|0,0,2]=4 4496 B8R0.24 CC(CP(O)(O)=O)C=O Amb25134096 [0,2,0,0,0,0|1,0,1]=4 4497 B8R0.24 CC(CS(O)(=O)=O)=CCl Amb25179000 [0,2,0,0,0,0|2,0,0]=4 4498 B8R0.24 CCC(=O)CS(C)(=O)=O Amb18182645 [0,2,0,0,0,0|1,0,1]=4 4499 B8R0.24 CCC(=O)CS(N)(=O)=O Amb25065479 [0,2,0,0,0,0|1,0,1]=4 4500 B8R0.24 CCC(=O)OP(O)(O)=O Amb25251397 [0,2,0,0,0,0|2,0,0]=4 4501 B8R0.24 CNC(=N)CP(O)(O)=O Amb25055801 [0,2,0,0,0,0|2,0,0]=4 4502 B8R0.24 CNC(=O)CC(C)(C)O Amb24759756 [0,2,0,0,0,0|1,0,1]=4 4503 B8R0.24 CNC(=O)CS(C)(=O)=O Amb22496966 [0,2,0,0,0,0|1,0,1]=4 4504 B8R0.24 COC(=N)CS(C)(=O)=O Amb18799382 [0,2,0,0,0,0|2,0,0]=4 4505 B8R0.24 COC(=O)CC(C)(C)Br Amb24098356 [0,2,0,0,0,0|1,0,1]=4 4506 B8R0.24 COC(=O)CC(C)(C)N Amb19335287 [0,2,0,0,0,0|1,0,1]=4 4507 B8R0.24 COC(=O)CC(C)(C)N Amb23402030 [0,2,0,0,0,0|1,0,1]=4 4508 B8R0.24 COC(=O)CP(=O)(O)[O-] Amb2242144 [0,2,0,0,0,0|1,0,0]=3 4509 B8R0.24 COC(=O)CS(=O)(=O)C Amb2422866 [0,2,0,0,0,0|1,0,0]=3 4510 B8R0.24 COC(=O)CS(=O)(=O)F Amb10610390 [0,2,0,0,0,0|1,0,1]=4 4511 B8R0.24 COC(=O)CS(N)(=O)=O Amb18177933 [0,2,0,0,0,0|1,0,1]=4 4512 B8R0.24 COC(=O)CS([O-])(=O)=O Amb22523435 [0,2,0,0,0,0|1,0,1]=4 4513 B8R0.24 COC(=O)C[N+](C)(C)C Amb25248444 [0,2,0,0,0,0|2,0,0]=4 4514 B8R0.24 CP(O)(=O)CC(=O)CN Amb24693901 [0,2,0,0,0,0|1,0,0]=3 4515 B8R0.24 CS(=O)(=O)CC(=O)C=C Amb25078708 [0,2,0,0,0,0|2,0,0]=4 4516 B8R0.24 CS(=O)(=O)CC(=O)NN Amb24086647 [0,2,0,0,0,0|2,0,0]=4 4517 B8R0.24 CS(=O)(=O)CC(=O)NO Amb24684239 [0,2,0,0,0,0|1,0,0]=3 4518 B8R0.24 CS(=O)(=O)NC(=O)CO Amb24572131 [0,2,0,0,0,0|2,0,0]=4 4519 B8R0.24 C\C(\CS(C)(=O)=O)=N\O Amb22411286 [0,2,0,0,0,0|2,0,0]=4 4520 B8R0.24 C\C(\CS(O)(=O)=O)=C\Cl Amb25374814 [0,2,0,0,0,0|2,0,0]=4 4521 B8R0.24 NNC(=O)CS(O)(=O)=O Amb24390959 [0,2,0,0,0,0|2,0,0]=4 4522 B8R0.24 NS(=O)(=O)CC(=O)CBr Amb24621617 [0,2,0,0,0,0|1,0,1]=4 4523 B8R0.24 ONC(=O)CP(O)(O)=O Amb24532814 [0,2,0,0,0,0|2,0,0]=4 4524 B8R0.24 OP(O)(=O)NC(=O)CCl Amb24626648 [0,2,0,0,0,0|2,0,0]=4 4525 B8R0.24 O\N=C(\CS(=O)(=O)C)/C Amb17625543 [0,2,0,0,0,0|2,0,0]=4 4526 B8R0.34 C=CS(=O)(=O)CC(O)=O Amb25065243 [0,2,0,0,0,0|1,0,1]=4 4527 B8R0.34 CC(=C)CS(=O)(=O)O[Na] Amb20246969 [0,2,0,0,0,0|2,0,0]=4 4528 B8R0.34 CC(=O)CC(C)(C)C=O Amb18642640 [0,2,0,0,0,0|1,0,1]=4 4529 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,2,0,0,0,0|1,0,1]=4 4530 B8R0.34 CC(=O)CC(C)(C)NO Amb24736823 [0,2,0,0,0,0|1,0,1]=4 4531 B8R0.34 CC(=O)CC(C)(C)ON Amb24707795 [0,2,0,0,0,0|1,0,1]=4 4532 B8R0.34 CC(=O)CC(C)(C)OO Amb24079585 [0,2,0,0,0,0|1,0,1]=4 4533 B8R0.34 CC(=O)CC(C)(O)C#N Amb24349635 [0,2,0,0,0,0|1,0,1]=4 4534 B8R0.34 CC(C)(CBr)CC(O)=O Amb24480039 [0,2,0,0,0,0|1,0,1]=4 4535 B8R0.34 CC(C)(CC(O)=O)C#C Amb24554543 [0,2,0,0,0,0|1,0,1]=4 4536 B8R0.34 CC(C)(CC(O)=O)CO Amb24116870 [0,2,0,0,0,0|0,0,2]=4 4537 B8R0.34 CC(C)(CC(O)=O)NN Amb24670787 [0,2,0,0,0,0|1,0,1]=4 4538 B8R0.34 CC(F)(CN)CC(O)=O Amb24481603 [0,2,0,0,0,0|1,0,1]=4 4539 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,2,0,0,0,0|1,0,1]=4 4540 B8R0.34 CC(N)(CCl)CC(O)=O Amb22641961 [0,2,0,0,0,0|1,0,1]=4 4541 B8R0.34 CC(O)(CC(O)=O)C=C Amb18642755 [0,2,0,0,0,0|0,0,2]=4 4542 B8R0.34 CC(O)(CN)CC(O)=O Amb25188898 [0,2,0,0,0,0|0,0,2]=4 4543 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,2,0,0,0,0|1,0,1]=4 4544 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,2,0,0,0,0|1,0,1]=4 4545 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,2,0,0,0,0|0,0,2]=4 4546 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,2,0,0,0,0|1,0,1]=4 4547 B8R0.34 CCP(O)(=O)CC(O)=O Amb24480209 [0,2,0,0,0,0|1,0,0]=3 4548 B8R0.34 CCS(=O)(=O)CC(C)=O Amb19515195 [0,2,0,0,0,0|1,0,1]=4 4549 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,2,0,0,0,0|1,0,1]=4 4550 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,2,0,0,0,0|0,0,2]=4 4551 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,2,0,0,0,0|0,0,2]=4 4552 B8R0.34 CC[N+](C)(C)CC(O)=O Amb24390383 [0,2,0,0,0,0|2,0,0]=4 4553 B8R0.34 CNC(C)(C)CC(O)=O Amb25710043 [0,2,0,0,0,0|1,0,1]=4 4554 B8R0.34 COP(O)(=O)CC(C)=O Amb25320077 [0,2,0,0,0,0|1,0,0]=3 4555 B8R0.34 COP(O)(=O)CC(O)=O Amb24732061 [0,2,0,0,0,0|1,0,0]=3 4556 B8R0.34 COS(=O)(=O)CC(N)=O Amb25337570 [0,2,0,0,0,0|2,0,0]=4 4557 B8R0.34 CSC(C)(C)CC(O)=O Amb25304571 [0,2,0,0,0,0|0,1,1]=4 4558 B8R0.34 C[C@@](N)(CC(O)=O)CO Amb25715205 [0,2,0,0,0,0|0,0,2]=4 4559 B8R0.34 C[C@@](O)(CN)CC(O)=O Amb24745092 [0,2,0,0,0,0|0,0,2]=4 4560 B8R0.34 C[Si](C)(CCl)CC(O)=O Amb25107199 [0,2,0,0,0,0|1,1,0]=4 4561 B8R0.34 NC(=O)CS(=O)(=O)CCl Amb24712336 [0,2,0,0,0,0|2,0,0]=4 4562 B8R0.34 NCC(F)(F)CC(O)=O Amb19148532 [0,2,0,0,0,0|1,0,1]=4 4563 B8R0.34 NNS(=O)(=O)CC(O)=O Amb24559074 [0,2,0,0,0,0|2,0,0]=4 4564 B8R0.34 O=NC(CC(=O)C)(C)C Amb17593358 [0,2,0,0,0,0|1,0,1]=4 4565 B8R0.34 OC(=O)CS(=O)(=O)CF Amb24707946 [0,2,0,0,0,0|1,0,0]=3 4566 B8R0.34 OOP(O)(=O)CC(O)=O Amb22230756 [0,2,0,0,0,0|2,0,0]=4 4567 B8R0.27 BrC(C(Br)(C)C)C(=O)O Amb16192461 [0,2,0,0,0,0|1,0,1]=4 4568 B8R0.27 BrC(C(F)(C)C)C(=O)O Amb10605635 [0,2,0,0,0,0|1,0,1]=4 4569 B8R0.27 CC(=C)C(O)P(O)(O)=O Amb25098555 [0,2,0,0,0,0|2,0,0]=4 4570 B8R0.27 CC(=O)C(Br)S(C)(=O)=O Amb23569716 [0,2,0,0,0,0|1,0,1]=4 4571 B8R0.27 CC(=O)C(C(O)(C)C)O Amb17593385 [0,2,0,0,0,0|1,0,1]=4 4572 B8R0.27 CC(=O)C(Cl)S(C)(=O)=O Amb23569674 [0,2,0,0,0,0|1,0,1]=4 4573 B8R0.27 CC(=O)C(F)S(C)(=O)=O Amb25086576 [0,2,0,0,0,0|1,0,1]=4 4574 B8R0.27 CC(=O)C(F)S(O)(=O)=O Amb25282863 [0,2,0,0,0,0|1,0,0]=3 4575 B8R0.27 CC(=O)C(I)S(C)(=O)=O Amb23569656 [0,2,0,0,0,0|1,0,1]=4 4576 B8R0.27 CC(=O)C(O)S(O)(=O)=O Amb25769834 [0,2,0,0,0,0|1,0,0]=3 4577 B8R0.27 CC(=O)C(S)C(C)(C)O Amb24747561 [0,2,0,0,0,0|1,0,1]=4 4578 B8R0.27 CC(C(C)=O)S(C)(=O)=O Amb18181047 [0,2,0,0,0,0|1,0,1]=4 4579 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,2,0,0,0,0|1,0,1]=4 4580 B8R0.27 CC(C(N)=O)S(C)(=O)=O Amb24643116 [0,2,0,0,0,0|2,0,0]=4 4581 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|1,0,1]=4 4582 B8R0.27 CC(C(O)=O)S(=O)(=O)Cl Amb18957684 [0,2,0,0,0,0|2,0,0]=4 4583 B8R0.27 CC(C(O)=O)S(N)(=O)=O Amb18281052 [0,2,0,0,0,0|2,0,0]=4 4584 B8R0.27 CC(C(O)=O)S(O)(=O)=O Amb25765487 [0,2,0,0,0,0|2,0,0]=4 4585 B8R0.27 CC(C(O)=O)[N+](C)(C)C Amb24759071 [0,2,0,0,0,0|2,0,0]=4 4586 B8R0.27 CC(C(O)=O)[N+](C)(C)N Amb25306005 [0,2,0,0,0,0|2,0,0]=4 4587 B8R0.27 CC(C)(C)C(Br)C(O)=O Amb18127181 [0,2,0,0,0,0|1,0,1]=4 4588 B8R0.27 CC(C)(C)C(Cl)C(O)=O Amb18125093 [0,2,0,0,0,0|1,0,1]=4 4589 B8R0.27 CC(C)(C)C(O)C(O)=O Amb19299856 [0,2,0,0,0,0|1,0,1]=4 4590 B8R0.27 CC(C)(C)[C@@H](Br)C(O)=O Amb22746895 [0,2,0,0,0,0|1,0,1]=4 4591 B8R0.27 CC(C)(C)[C@@H](N)C(O)=O Amb22744938 [0,2,0,0,0,0|1,0,1]=4 4592 B8R0.27 CC(C)(C)[C@@H](O)C(O)=O Amb22225174 [0,2,0,0,0,0|1,0,1]=4 4593 B8R0.27 CC(C)(C)[C@H](Br)C(O)=O Amb22226488 [0,2,0,0,0,0|1,0,1]=4 4594 B8R0.27 CC(C)(Cl)C(Cl)C(O)=O Amb18126746 [0,2,0,0,0,0|1,0,1]=4 4595 B8R0.27 CC(C)(Cl)C(N)C(O)=O Amb25032131 [0,2,0,0,0,0|1,0,1]=4 4596 B8R0.27 CC(C)(F)[C@H](N)C(O)=O Amb24369670 [0,2,0,0,0,0|1,0,1]=4 4597 B8R0.27 CC(C)(N)C(N)C(O)=O Amb18642889 [0,2,0,0,0,0|1,0,1]=4 4598 B8R0.27 CC(C)(N)C(O)C(O)=O Amb25075483 [0,2,0,0,0,0|1,0,1]=4 4599 B8R0.27 CC(C)(N)C(S)C(O)=O Amb24436486 [0,2,0,0,0,0|1,0,1]=4 4600 B8R0.27 CC(C)(O)C(Cl)C(O)=O Amb25101058 [0,2,0,0,0,0|0,0,2]=4 4601 B8R0.27 CC(C)(O)C(N)C(O)=O Amb18642914 [0,2,0,0,0,0|0,0,2]=4 4602 B8R0.27 CC(C)(O)C(O)C(O)=O Amb25118477 [0,2,0,0,0,0|0,0,2]=4 4603 B8R0.27 CC(Cl)(Cl)C(Cl)C(O)=O Amb25032276 [0,2,0,0,0,0|1,0,1]=4 4604 B8R0.27 CC(F)(F)C(Cl)C(O)=O Amb24373113 [0,2,0,0,0,0|1,0,1]=4 4605 B8R0.27 CC(F)(F)[C@@H](N)C(O)=O Amb24618136 [0,2,0,0,0,0|1,0,1]=4 4606 B8R0.27 CC(F)(F)[C@H](N)C(O)=O Amb24641014 [0,2,0,0,0,0|1,0,1]=4 4607 B8R0.27 CP(C)(=O)C(O)C(N)=O Amb25351608 [0,2,0,0,0,0|2,0,0]=4 4608 B8R0.27 CP(C)(=O)C(O)C(O)=O Amb22231894 [0,2,0,0,0,0|1,0,0]=3 4609 B8R0.27 CS(=O)(=O)C(Br)C(N)=O Amb25705673 [0,2,0,0,0,0|2,0,0]=4 4610 B8R0.27 CS(=O)(=O)C(F)C(O)=O Amb25242777 [0,2,0,0,0,0|1,0,0]=3 4611 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,2,0,0,0,0|1,0,1]=4 4612 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,2,0,0,0,0|1,0,1]=4 4613 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,2,0,0,0,0|1,0,1]=4 4614 B8R0.27 C[C@H](C(O)=O)S(C)(=O)=O Amb24480187 [0,2,0,0,0,0|1,0,0]=3 4615 B8R0.27 C[Si](C)(C)C(O)C(O)=O Amb25063843 [0,2,0,0,0,0|1,1,0]=4 4616 B8R0.27 Cl[C@H](C(C)(C)C)C(=O)O Amb10069805 [0,2,0,0,0,0|1,0,1]=4 4617 B8R0.27 NC(C(C)(C)C)C(=O)O Amb2371663 [0,2,0,0,0,0|1,0,1]=4 4618 B8R0.27 NC(C(S)(C)C)C(=O)O Amb1907179 [0,2,0,0,0,0|0,1,1]=4 4619 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O Amb16232019 [0,2,0,0,0,0|1,0,1]=4 4620 B8R0.27 OC(=O)C(Br)S(O)(=O)=O Amb24375783 [0,2,0,0,0,0|2,0,0]=4 4621 B8R0.27 OC(=O)C(C(O)(C)C)Br Amb17595209 [0,2,0,0,0,0|0,0,2]=4 4622 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,2,0,0,0,0|0,0,2]=4 4623 B8R0.27 OC(=O)C(Cl)S(O)(=O)=O Amb25724885 [0,2,0,0,0,0|2,0,0]=4 4624 B8R0.27 OC(=O)C(F)P(O)(O)=O Amb24520819 [0,2,0,0,0,0|2,0,0]=4 4625 B8R0.27 OC(=O)[C@@H](Br)S(O)(=O)=O Amb25218846 [0,2,0,0,0,0|2,0,0]=4 4626 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,2,0,0,0,0|0,0,2]=4 4627 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,2,0,0,0,0|0,0,2]=4 4628 B8R0.27 OC(C(O)=O)P(O)(O)=O Amb24117287 [0,2,0,0,0,0|2,0,0]=4 4629 B8R0.27 OC(C(O)=O)S(O)(=O)=O Amb24739659 [0,2,0,0,0,0|2,0,0]=4 4630 B8R0.27 O[C@@H](C(C)(C)C)C(=O)O Amb10603129 [0,2,0,0,0,0|1,0,1]=4 4631 B8R0.18 CC(=C)C(=C=O)C(O)=O Amb24524157 [0,2,0,0,0,0|1,0,1]=4 4632 B8R0.18 CC(=C)C(CC)C(N)=O Amb24673757 [0,2,0,0,0,0|2,0,0]=4 4633 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,2,0,0,0,0|1,0,0]=3 4634 B8R0.18 CC(=C)\C(=C\C)\C(O)=O Amb25341613 [0,2,0,0,0,0|1,0,1]=4 4635 B8R0.18 CC(=O)C(=C[O-])C(C)=O Amb24524328 [0,2,0,0,0,0|1,0,1]=4 4636 B8R0.18 CC(=O)C(=NN)C(N)=O Amb25190247 [0,2,0,0,0,0|1,0,1]=4 4637 B8R0.18 CC(=O)C(=S=O)C(C)=O Amb25185299 [0,2,0,0,0,0|1,0,1]=4 4638 B8R0.18 CC(=O)C(C#N)C(N)=O Amb25265556 [0,2,0,0,0,0|1,0,0]=3 4639 B8R0.18 CC(=O)C(C=N)C(C)=O Amb25128218 [0,2,0,0,0,0|1,0,0]=3 4640 B8R0.18 CC(=O)C(CC)C(C)=C Amb25244374 [0,2,0,0,0,0|2,0,0]=4 4641 B8R0.18 CC(=O)C(CC)C(N)=O Amb25082383 [0,2,0,0,0,0|1,0,0]=3 4642 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22167697 [0,2,0,0,0,0|0,0,1]=3 4643 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22730810 [0,2,0,0,0,0|0,0,1]=3 4644 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22734577 [0,2,0,0,0,0|0,0,1]=3 4645 B8R0.18 CC(=O)C(CO)C(C)=O Amb25288499 [0,2,0,0,0,0|1,0,0]=3 4646 B8R0.18 CC(=O)N(N=O)C(C)=O Amb25131294 [0,2,0,0,0,0|2,0,0]=4 4647 B8R0.18 CC(=O)\C(=N/O)\C(O)=O Amb24100395 [0,2,0,0,0,0|0,0,1]=3 4648 B8R0.18 CC(=O)\C(\C#N)=C(\C)/O Amb24621648 [0,2,0,0,0,0|1,0,1]=4 4649 B8R0.18 CC(=O)\C(\N=O)=C(/C)\O Amb24339368 [0,2,0,0,0,0|1,0,1]=4 4650 B8R0.18 CC(=O)\C(\OC)=C(\C)/O Amb24577822 [0,2,0,0,0,0|1,0,1]=4 4651 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,2,0,0,0,0|1,0,1]=4 4652 B8R0.18 CC(C(C(=O)O)C#N)C Amb10066977 [0,2,0,0,0,0|1,0,1]=4 4653 B8R0.18 CC(C)=C(C=O)C(O)=O Amb25328515 [0,2,0,0,0,0|1,0,1]=4 4654 B8R0.18 CC(C)=C(CC)C(O)=O Amb18642607 [0,2,0,0,0,0|1,0,1]=4 4655 B8R0.18 CC(C)=C(OC)C(O)=O Amb18642778 [0,2,0,0,0,0|1,0,1]=4 4656 B8R0.18 CC(C)=C(ON)C(O)=O Amb24432339 [0,2,0,0,0,0|1,0,1]=4 4657 B8R0.18 CC(C)=C(SC)C(O)=O Amb24656294 [0,2,0,0,0,0|1,0,1]=4 4658 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,2,0,0,0,0|1,0,1]=4 4659 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,2,0,0,0,0|1,0,1]=4 4660 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,2,0,0,0,0|1,0,1]=4 4661 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,2,0,0,0,0|1,0,1]=4 4662 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,2,0,0,0,0|1,0,1]=4 4663 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,2,0,0,0,0|1,0,1]=4 4664 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,2,0,0,0,0|1,0,1]=4 4665 B8R0.18 CC(C)C(N=O)C(O)=O Amb25292210 [0,2,0,0,0,0|1,0,1]=4 4666 B8R0.18 CC(C)C(NBr)C(O)=O Amb24648440 [0,2,0,0,0,0|1,0,1]=4 4667 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,2,0,0,0,0|1,0,1]=4 4668 B8R0.18 CC(C)C(NCl)C(O)=O Amb24480122 [0,2,0,0,0,0|1,0,1]=4 4669 B8R0.18 CC(C)C(NN)C(O)=O Amb18642886 [0,2,0,0,0,0|1,0,1]=4 4670 B8R0.18 CC(C)C(ON)C(O)=O Amb24477865 [0,2,0,0,0,0|1,0,1]=4 4671 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,2,0,0,0,0|1,0,1]=4 4672 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,2,0,0,0,0|1,0,1]=4 4673 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,2,0,0,0,0|1,0,1]=4 4674 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,2,0,0,0,0|1,0,1]=4 4675 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,2,0,0,0,0|1,0,1]=4 4676 B8R0.18 CC(C)[C@@H](ON)C(O)=O Amb24117143 [0,2,0,0,0,0|1,0,1]=4 4677 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,2,0,0,0,0|1,0,1]=4 4678 B8R0.18 CC(C)[C@H](ON)C(O)=O Amb25785764 [0,2,0,0,0,0|1,0,1]=4 4679 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,2,0,0,0,0|1,0,1]=4 4680 B8R0.18 CC(N)=C(C#N)C(O)=O Amb25228925 [0,2,0,0,0,0|1,0,1]=4 4681 B8R0.18 CC(O)=C(N=O)C(O)=O Amb25727301 [0,2,0,0,0,0|0,0,2]=4 4682 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,2,0,0,0,0|0,0,2]=4 4683 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,2,0,0,0,0|0,0,2]=4 4684 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,2,0,0,0,0|0,0,2]=4 4685 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,2,0,0,0,0|0,0,2]=4 4686 B8R0.18 CC(O)C(NCl)C(O)=O Amb24408588 [0,2,0,0,0,0|0,0,2]=4 4687 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,2,0,0,0,0|0,0,2]=4 4688 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,2,0,0,0,0|0,0,2]=4 4689 B8R0.18 CC(O)[C@H](NCl)C(O)=O Amb25684733 [0,2,0,0,0,0|0,0,2]=4 4690 B8R0.18 CCC(C(=O)C)C(=O)C Amb2371444 [0,2,0,0,0,0|1,0,0]=3 4691 B8R0.18 CCC(C(C)=O)[N+]([O-])=O Amb24738348 [0,2,0,0,0,0|1,0,1]=4 4692 B8R0.18 CCC(C(Cl)=O)C(Cl)=O Amb17942975 [0,2,0,0,0,0|2,0,0]=4 4693 B8R0.18 CCC(C(N)=O)C(N)=O Amb25848912 [0,2,0,0,0,0|2,0,0]=4 4694 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,2,0,0,0,0|2,0,0]=4 4695 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,2,0,0,0,0|2,0,0]=4 4696 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,2,0,0,0,0|1,0,1]=4 4697 B8R0.18 CCC(C(O)=O)P(O)=O Amb25205534 [0,2,0,0,0,0|2,0,0]=4 4698 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,2,0,0,0,0|1,0,0]=3 4699 B8R0.18 CCN(C(C)=O)C(C)=O Amb25857493 [0,2,0,0,0,0|2,0,0]=4 4700 B8R0.18 CC[C@@H](C(C)=O)[N+]([O-])=O Amb25185100 [0,2,0,0,0,0|1,0,1]=4 4701 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,2,0,0,0,0|2,0,0]=4 4702 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,2,0,0,0,0|2,0,0]=4 4703 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,2,0,0,0,0|2,0,0]=4 4704 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,2,0,0,0,0|2,0,0]=4 4705 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,2,0,0,0,0|2,0,0]=4 4706 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,2,0,0,0,0|2,0,0]=4 4707 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,2,0,0,0,0|1,0,1]=4 4708 B8R0.18 CNC(C(N)=O)C(N)=O Amb18642836 [0,2,0,0,0,0|2,0,0]=4 4709 B8R0.18 CNC(C(O)=O)C(O)=O Amb24477701 [0,2,0,0,0,0|1,0,0]=3 4710 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|1,0,1]=4 4711 B8R0.18 CON(C(C)=O)C(C)=O Amb22231327 [0,2,0,0,0,0|2,0,0]=4 4712 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|1,0,1]=4 4713 B8R0.18 CSC(C(C)=O)C(C)=O Amb25834292 [0,2,0,0,0,0|1,0,0]=3 4714 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,2,0,0,0,0|1,0,1]=4 4715 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,2,0,0,0,0|0,0,2]=4 4716 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,2,0,0,0,0|0,0,2]=4 4717 B8R0.18 C[C@@H](O)[C@H](NCl)C(O)=O Amb25124152 [0,2,0,0,0,0|0,0,2]=4 4718 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,2,0,0,0,0|0,0,2]=4 4719 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,2,0,0,0,0|0,0,2]=4 4720 B8R0.18 C\C(\O)=C(\C#N)/C(O)=O Amb25793575 [0,2,0,0,0,0|0,0,2]=4 4721 B8R0.18 N#C\C(=C(/N)\C)\C(=O)O Amb13951423 [0,2,0,0,0,0|1,0,1]=4 4722 B8R0.18 N=C=C(C(O)=O)C(O)=O Amb25312535 [0,2,0,0,0,0|1,0,1]=4 4723 B8R0.18 NC(=O)C(=NO)C(O)=O Amb25118376 [0,2,0,0,0,0|1,0,1]=4 4724 B8R0.18 NC(=O)C(N=O)C(N)=O Amb24476651 [0,2,0,0,0,0|2,0,0]=4 4725 B8R0.18 NC=C(C(=O)C)C(=O)C Amb2386494 [0,2,0,0,0,0|1,0,1]=4 4726 B8R0.18 OC(=O)C(=CCl)C(O)=O Amb24634285 [0,2,0,0,0,0|1,0,1]=4 4727 B8R0.18 OC(=O)C(C=O)C(O)=O Amb25188908 [0,2,0,0,0,0|1,0,0]=3 4728 B8R0.18 ON=C(C(=O)C)C(=O)C Amb1145803 [0,2,0,0,0,0|1,0,1]=4 4729 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,2,0,0,0,0|1,0,1]=4 4730 B8R0.18 [NH-][NH+]=C(C(O)=O)C(O)=O Amb24557340 [0,2,0,0,0,0|1,0,1]=4 4731 B8R0.37 BrC(=C)C(C(=O)O)(C)C Amb17595054 [0,2,0,0,0,0|1,0,1]=4 4732 B8R0.37 CC(=C)C(C(=O)O)(C)C Amb15701602 [0,2,0,0,0,0|1,0,0]=3 4733 B8R0.37 CC(=C)C(C)(C)C(N)=O Amb25032100 [0,2,0,0,0,0|2,0,0]=4 4734 B8R0.37 CC(=C)C(C)(O)C(O)=O Amb18642760 [0,2,0,0,0,0|1,0,0]=3 4735 B8R0.37 CC(=O)C(C(=O)C)(C)C Amb17593343 [0,2,0,0,0,0|1,0,0]=3 4736 B8R0.37 CC(=O)C(C)(C)C(N)=S Amb25257011 [0,2,0,0,0,0|1,1,0]=4 4737 B8R0.37 CC(=O)C(C)(C)C(O)=O Amb18642784 [0,2,0,0,0,0|0,0,0]=2 4738 B8R0.37 CC(=O)C(C)(C)C(O)=S Amb24061048 [0,2,0,0,0,0|0,1,0]=3 4739 B8R0.37 CC(=O)C(C)(C)[N+]([O-])=O Amb25060217 [0,2,0,0,0,0|1,0,1]=4 4740 B8R0.37 CC(=O)C(C)(Cl)C(C)=C Amb24621439 [0,2,0,0,0,0|2,0,0]=4 4741 B8R0.37 CC(=O)C(C)(O)C(N)=O Amb24084329 [0,2,0,0,0,0|1,0,0]=3 4742 B8R0.37 CC(=O)C(C)(O)C(O)=O Amb18642870 [0,2,0,0,0,0|0,0,0]=2 4743 B8R0.37 CC(=O)C(C)(O)C(O)O Amb25833528 [0,2,0,0,0,0|0,0,2]=4 4744 B8R0.37 CC(=O)C(Cl)(Cl)C(=O)Cl Amb24563515 [0,2,0,0,0,0|1,0,0]=3 4745 B8R0.37 CC(=O)C(Cl)(Cl)C(C)=O Amb25857557 [0,2,0,0,0,0|1,0,0]=3 4746 B8R0.37 CC(=O)C(F)(F)[N+]([O-])=O Amb25143403 [0,2,0,0,0,0|1,0,1]=4 4747 B8R0.37 CC(=O)C(O)(O)C(C)=O Amb24513654 [0,2,0,0,0,0|1,0,0]=3 4748 B8R0.37 CC(=O)C(O)(O)C(O)=O Amb24101440 [0,2,0,0,0,0|0,0,0]=2 4749 B8R0.37 CC(=S)C(C)(C)C(C)=O Amb24677277 [0,2,0,0,0,0|1,1,0]=4 4750 B8R0.37 CC(Br)(C(N)=O)C(N)=O Amb25702506 [0,2,0,0,0,0|2,0,0]=4 4751 B8R0.37 CC(Br)(C(O)=O)C(O)=O Amb24429036 [0,2,0,0,0,0|1,0,0]=3 4752 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,2,0,0,0,0|1,0,1]=4 4753 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,2,0,0,0,0|1,0,1]=4 4754 B8R0.37 CC(C)(C(=O)Cl)C(=O)Cl Amb22347922 [0,2,0,0,0,0|2,0,0]=4 4755 B8R0.37 CC(C)(C(N)=O)C(N)=O Amb24659379 [0,2,0,0,0,0|2,0,0]=4 4756 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,2,0,0,0,0|1,0,1]=4 4757 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,2,0,0,0,0|1,0,1]=4 4758 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,2,0,0,0,0|1,0,1]=4 4759 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,2,0,0,0,0|1,0,1]=4 4760 B8R0.37 CC(C)C(Cl)(Cl)C(O)=O Amb25188935 [0,2,0,0,0,0|1,0,1]=4 4761 B8R0.37 CC(Cl)(C(N)=O)C(N)=O Amb25363306 [0,2,0,0,0,0|2,0,0]=4 4762 B8R0.37 CC(Cl)C(Cl)(Cl)C(O)=O Amb22168920 [0,2,0,0,0,0|1,0,1]=4 4763 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,2,0,0,0,0|1,0,1]=4 4764 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,2,0,0,0,0|1,0,1]=4 4765 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,2,0,0,0,0|1,0,1]=4 4766 B8R0.37 CC(N)C(F)(F)C(O)=O Amb25188946 [0,2,0,0,0,0|1,0,1]=4 4767 B8R0.37 CC(O)(C(O)=O)C(O)=O Amb18124398 [0,2,0,0,0,0|1,0,0]=3 4768 B8R0.37 CC(O)C(C)(C)C(C)=O Amb25282830 [0,2,0,0,0,0|1,0,1]=4 4769 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,2,0,0,0,0|0,0,2]=4 4770 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,2,0,0,0,0|0,0,2]=4 4771 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,2,0,0,0,0|1,0,1]=4 4772 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,2,0,0,0,0|1,0,1]=4 4773 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,2,0,0,0,0|1,0,1]=4 4774 B8R0.37 CN(C)C(C)(C)C(O)=O Amb20627821 [0,2,0,0,0,0|2,0,0]=4 4775 B8R0.37 CS(=O)C(C)(C)C(N)=O Amb25145472 [0,2,0,0,0,0|2,0,0]=4 4776 B8R0.37 CS(=O)C(C)(C)C(O)=O Amb18644428 [0,2,0,0,0,0|1,0,0]=3 4777 B8R0.37 CS(=O)C(F)(F)C(O)=O Amb23586464 [0,2,0,0,0,0|1,0,0]=3 4778 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,2,0,0,0,0|1,0,1]=4 4779 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,2,0,0,0,0|0,0,2]=4 4780 B8R0.37 C[C@@H](O)[C@@](C)(O)C(C)=O Amb25662408 [0,2,0,0,0,0|1,0,1]=4 4781 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,2,0,0,0,0|0,0,2]=4 4782 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=O Amb25767044 [0,2,0,0,0,0|1,0,1]=4 4783 B8R0.37 C[C@@](N)(C(O)=O)C(N)=O Amb25077574 [0,2,0,0,0,0|1,0,0]=3 4784 B8R0.37 C[C@H](O)C(C)(C)C(C)=O Amb24725317 [0,2,0,0,0,0|1,0,1]=4 4785 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,2,0,0,0,0|0,0,2]=4 4786 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,2,0,0,0,0|0,0,2]=4 4787 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,2,0,0,0,0|0,0,2]=4 4788 B8R0.37 ClC(=C)C(C(=O)O)(C)C Amb17613253 [0,2,0,0,0,0|1,0,1]=4 4789 B8R0.37 FC(=O)C(C(=O)F)(F)F Amb10838771 [0,2,0,0,0,0|2,0,0]=4 4790 B8R0.37 NC(=O)C(Br)(Br)C(O)=O Amb25840519 [0,2,0,0,0,0|1,0,0]=3 4791 B8R0.37 NC(=O)C(C(=O)N)(F)F Amb10839344 [0,2,0,0,0,0|2,0,0]=4 4792 B8R0.37 NC(=O)C(Cl)(Cl)C(N)=O Amb24524184 [0,2,0,0,0,0|2,0,0]=4 4793 B8R0.37 NC(=O)C(F)(Cl)C(N)=O Amb24739739 [0,2,0,0,0,0|2,0,0]=4 4794 B8R0.37 NC(=O)C(F)(F)C(O)=O Amb24385040 [0,2,0,0,0,0|1,0,0]=3 4795 B8R0.37 NC(=O)C(O)(O)C(N)=O Amb25339245 [0,2,0,0,0,0|2,0,0]=4 4796 B8R0.37 NC(N)(C(N)=O)C(N)=O Amb24548237 [0,2,0,0,0,0|2,0,0]=4 4797 B8R0.37 N[13C](=O)[13C]([13C](=O)N)(Br)Br Amb17612557 [0,2,0,0,0,0|2,0,0]=4 4798 B8R0.37 OC(=O)C(Br)(Br)C(O)=O Amb24707409 [0,2,0,0,0,0|1,0,0]=3 4799 B8R0.37 OC(=O)C(C(=O)Cl)(C)C Amb17593749 [0,2,0,0,0,0|1,0,0]=3 4800 B8R0.37 OC(=O)C(C(=O)O)(Cl)Cl Amb17594338 [0,2,0,0,0,0|1,0,0]=3 4801 B8R0.37 OC(=O)C(C(=S)N)(C)C Amb17465757 [0,2,0,0,0,0|1,1,0]=4 4802 B8R0.37 OC(=O)C(Cl)(Br)C(O)=O Amb25827170 [0,2,0,0,0,0|1,0,0]=3 4803 B8R0.37 OC(=O)C(F)(F)C(O)=O Amb24088375 [0,2,0,0,0,0|1,0,0]=3 4804 B8R0.37 OC(O)(C(O)=O)C(O)=O Amb22002022 [0,2,0,0,0,0|1,0,0]=3 4805 B8R0.37 [2H]C(N)(C(C)C)C(O)=O Amb22367355 [0,2,0,0,0,0|1,0,1]=4 4806 B8R0.37 [O-]C(=O)C(O)(O)C([O-])=O Amb24325371 [0,2,0,0,0,0|1,0,1]=4 4807 B6R1.2 C=C1COCC1 Amb24683386 [1,0,0,1,0,0|1,0,1]=4 4808 B6R1.2 Cc1coc[n]1 Amb20241591 [1,0,0,1,0,0|2,0,0]=4 4809 B6R1.2 Cc1cocc1 Amb2447077 [1,0,0,1,0,0|1,0,1]=4 4810 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,1,0,0|1,0,1]=4 4811 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,1,0,0|0,1,1]=4 4812 B6R1.2 O=C1C=CON1 Amb22055592 [1,0,0,1,0,0|1,0,1]=4 4813 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,1]=4 4814 B6R1.2 O=C1CC=CN1 Amb22235167 [1,0,0,1,0,0|1,0,1]=4 4815 B6R1.2 O=C1CCCN1 Amb20240633 [1,0,0,1,0,0|1,0,1]=4 4816 B6R1.2 O=C1CCCN1 Amb22338202 [1,0,0,1,0,0|1,0,1]=4 4817 B6R1.2 O=C1CCCN1 Amb22432663 [1,0,0,1,0,0|1,0,1]=4 4818 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|0,1,1]=4 4819 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|1,0,1]=4 4820 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,1,0,0|1,0,1]=4 4821 B6R1.2 O=C1CNC=C1 Amb22234991 [1,0,0,1,0,0|1,0,1]=4 4822 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,1,0,0|2,0,0]=4 4823 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,1,0,0|1,0,0]=3 4824 B6R1.2 O=C1COC=C1 Amb24107591 [1,0,0,1,0,0|0,0,1]=3 4825 B6R1.2 O=C1CSC=C1 Amb22736500 [1,0,0,1,0,0|0,1,1]=4 4826 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [1,0,0,1,0,0|2,0,0]=4 4827 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,1,0,0|1,0,0]=3 4828 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,1,0,0|1,0,1]=4 4829 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,1,0,0|1,0,1]=4 4830 B6R1.2 O=[13C]1CCCC1 Amb22353487 [1,0,0,1,0,0|1,0,1]=4 4831 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,1,0,0|1,0,1]=4 4832 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,1,0,0|1,0,1]=4 4833 B6R1.2 S=C1CC=CO1 Amb25365370 [1,0,0,1,0,0|0,1,1]=4 4834 B6R1.3 O=CCC1CC1 Amb21856083 [1,0,0,1,0,0|1,0,1]=4 4835 B6R1.3 OCCC=1CC1 Amb24478088 [1,0,0,1,0,0|1,0,1]=4 4836 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|1,0,1]=4 4837 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,1]=3 4838 B6R1.5 CN1CC(=O)C1 Amb22292462 [1,0,0,1,0,0|2,0,0]=4 4839 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [1,0,0,1,0,0|0,0,1]=3 4840 B6R1.5 C[C@H]1CC(=O)N1 Amb25755939 [1,0,0,1,0,0|1,0,1]=4 4841 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,1]=3 4842 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|1,0,1]=4 4843 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|1,0,1]=4 4844 B6R1.5 O=C1CC(Br)C1 Amb22388498 [1,0,0,1,0,0|1,0,1]=4 4845 B6R1.5 O=C1CC(Cl)C1 Amb25087791 [1,0,0,1,0,0|1,0,1]=4 4846 B6R1.5 OC1CC(=O)C1 Amb22235480 [1,0,0,1,0,0|0,0,1]=3 4847 B6R1.5 OC1CS(=O)C1 Amb25025463 [1,0,0,1,0,0|1,0,1]=4 4848 B6R1.5 O[C@H]1CC(=O)O1 Amb25106737 [1,0,0,1,0,0|0,0,2]=4 4849 B6R1.8 C=C1CC1C=O Amb25288413 [1,0,0,1,0,0|1,0,0]=3 4850 B6R1.8 C=C1CC1CO Amb22224918 [1,0,0,1,0,0|1,0,1]=4 4851 B6R1.8 C=C1C[C@@H]1CO Amb25359146 [1,0,0,1,0,0|1,0,1]=4 4852 B6R1.8 C=C1C[C@H]1CO Amb24529640 [1,0,0,1,0,0|1,0,1]=4 4853 B6R1.8 CC1=CC1C=O Amb24695489 [1,0,0,1,0,0|1,0,0]=3 4854 B6R1.8 CC1=CC1CO Amb25106800 [1,0,0,1,0,0|1,0,1]=4 4855 B6R1.8 CC1CC1C=O Amb20622289 [1,0,0,1,0,0|1,0,1]=4 4856 B6R1.8 CC1OC1C=O Amb24728876 [1,0,0,1,0,0|0,0,2]=4 4857 B6R1.8 CCC1CC1=O Amb24686409 [1,0,0,1,0,0|1,0,1]=4 4858 B6R1.8 CCC1OC1=O Amb24426509 [1,0,0,1,0,0|0,0,1]=3 4859 B6R1.8 C[C@@H]1C[C@@H]1C=O Amb25662825 [1,0,0,1,0,0|1,0,1]=4 4860 B6R1.8 C[C@@H]1C[C@H]1C=O Amb24569326 [1,0,0,1,0,0|1,0,1]=4 4861 B6R1.8 C[C@H]1C[C@@H]1C=O Amb24617263 [1,0,0,1,0,0|1,0,1]=4 4862 B6R1.8 C[C@H]1O[C@@H]1C=O Amb25025768 [1,0,0,1,0,0|0,0,2]=4 4863 B6R1.8 C[C@H]1O[C@H]1C=O Amb25207058 [1,0,0,1,0,0|0,0,2]=4 4864 B6R1.8 O=C[C@@H]1C[C@H]1Cl Amb24571016 [1,0,0,1,0,0|1,0,1]=4 4865 B6R1.9 CC1(O)CC1=O Amb24478175 [1,0,0,1,0,0|0,0,2]=4 4866 B6R1.11 CC(=C)C1CO1 Amb19516025 [1,0,0,1,0,0|1,0,1]=4 4867 B6R1.11 CC(=O)C1C=C1 Amb25025234 [1,0,0,1,0,0|1,0,0]=3 4868 B6R1.11 CC(=O)C1C=N1 Amb24689548 [1,0,0,1,0,0|1,0,0]=3 4869 B6R1.11 CC(=O)C1CS1 Amb25373120 [1,0,0,1,0,0|0,1,1]=4 4870 B6R1.11 CC(=O)[C@H]1CO1 Amb24628197 [1,0,0,1,0,0|0,0,1]=3 4871 B6R1.11 FC(=O)C1CC1 Amb17673783 [1,0,0,1,0,0|1,0,1]=4 4872 B6R1.11 NC(=O)C1CC1 Amb1789460 [1,0,0,1,0,0|1,0,1]=4 4873 B6R1.11 N[13C](=O)[13CH]1[13CH2]O1 Amb17614804 [1,0,0,1,0,0|1,0,1]=4 4874 B6R1.11 OC(=O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 4875 B6R1.11 OC(=O)C1CS1 Amb24641854 [1,0,0,1,0,0|1,0,0]=3 4876 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 4877 B6R1.11 OS(=O)C1CC1 Amb24334290 [1,0,0,1,0,0|1,0,1]=4 4878 B6R1.11 [O-]C(=O)C1CO1 Amb22492453 [1,0,0,1,0,0|1,0,1]=4 4879 B6R1.11 [O-]C(=O)[C@@H]1CO1 Amb22503671 [1,0,0,1,0,0|1,0,1]=4 4880 B6R1.11 [O-]C(=O)[C@H]1CO1 Amb22503672 [1,0,0,1,0,0|1,0,1]=4 4881 B6R1.4 C=C1CCC1=O Amb25747444 [0,0,0,1,1,0|2,0,0]=4 4882 B6R1.4 C=C1CNC1=O Amb25213040 [0,0,0,1,1,0|2,0,0]=4 4883 B6R1.4 C=C1OCC1=O Amb24478475 [0,0,0,1,1,0|1,0,0]=3 4884 B6R1.4 CC1COC1=O Amb25794274 [0,0,0,1,1,0|1,0,1]=4 4885 B6R1.4 CC1OCC1=O Amb23456088 [0,0,0,1,1,0|1,0,1]=4 4886 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,0,0,1,1,0|1,0,1]=4 4887 B6R1.4 N[C@@H]1COC1=O Amb22757168 [0,0,0,1,1,0|1,0,1]=4 4888 B6R1.4 O=C1C=CC1=O Amb22731249 [0,0,0,1,1,0|1,0,1]=4 4889 B6R1.4 O=C1CCC1O Amb17593027 [0,0,0,1,1,0|1,0,1]=4 4890 B6R1.4 O=C1NNC1=O Amb25328306 [0,0,0,1,1,0|2,0,0]=4 4891 B6R1.4 [NH3+][C@H]1COC1=O Amb22349488 [0,0,0,1,1,0|1,0,1]=4 4892 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,0,0,1,0,1|2,0,0]=4 4893 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,1|2,0,0]=4 4894 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,1|1,0,1]=4 4895 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,1|1,0,1]=4 4896 B8R1.3 CC1COC(=O)OC1 Amb21856480 [0,0,0,1,0,1|1,0,1]=4 4897 B8R1.3 CC=1CCC(=O)NC1 Amb25078192 [0,0,0,1,0,1|2,0,0]=4 4898 B8R1.3 CC=1CNC(=O)NC1 Amb24507686 [0,0,0,1,0,1|2,0,0]=4 4899 B8R1.3 C[C@H]1CCC(=O)CO1 Amb25262664 [0,0,0,1,0,1|1,0,1]=4 4900 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,1|1,0,1]=4 4901 B8R1.3 O=C1CCC(=O)CN1 Amb15692796 [0,0,0,1,0,1|1,0,0]=3 4902 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,0,0,1,0,1|2,0,0]=4 4903 B8R1.3 O=C1CNC(=O)CC1 Amb22491034 [0,0,0,1,0,1|1,0,0]=3 4904 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,0,0,1,0,1|0,0,0]=2 4905 B8R1.3 O=C1CNC(=S)CN1 Amb25804364 [0,0,0,1,0,1|1,1,0]=4 4906 B8R1.3 O=C1NCC(=O)NC1 Amb1011605 [0,0,0,1,0,1|1,0,0]=3 4907 B8R1.3 OC1CCC(=O)NC1 Amb10066907 [0,0,0,1,0,1|1,0,1]=4 4908 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,1|2,0,0]=4 4909 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,1|1,0,0]=3 4910 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,1|1,0,0]=3 4911 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,1|1,0,1]=4 4912 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,1|0,0,2]=4 4913 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,1|1,0,1]=4 4914 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,1|0,0,2]=4 4915 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,1|1,0,1]=4 4916 B8R1.23 C=C1CC(C1)C(N)=O Amb22896664 [0,0,0,1,0,1|2,0,0]=4 4917 B8R1.23 CC(=C)C1CC(=O)C1 Amb25373403 [0,0,0,1,0,1|2,0,0]=4 4918 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,1,0,1|1,0,1]=4 4919 B8R1.23 CC(=O)N1CC(=O)C1 Amb22896668 [0,0,0,1,0,1|1,0,0]=3 4920 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,1,0,1|1,0,1]=4 4921 B8R1.23 CC(O)C1CC(=O)O1 Amb25317296 [0,0,0,1,0,1|0,0,2]=4 4922 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,0,0,1,0,1|1,0,1]=4 4923 B8R1.23 CC=1CC(C1)C(C)=O Amb24676939 [0,0,0,1,0,1|2,0,0]=4 4924 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,0,0,1,0,1|2,0,0]=4 4925 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,0,0,1,0,1|1,0,1]=4 4926 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,0,0,1,0,1|1,0,1]=4 4927 B8R1.23 C[C@H](O)[C@@H]1CC(=O)O1 Amb24515159 [0,0,0,1,0,1|0,0,2]=4 4928 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,0,0,1,0,1|1,0,1]=4 4929 B8R1.23 ClC(=O)C1CC(=C)C1 Amb10071441 [0,0,0,1,0,1|2,0,0]=4 4930 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,0,0,1,0,1|1,0,1]=4 4931 B8R1.23 NC(=O)C1CC(=O)C1 Amb22896730 [0,0,0,1,0,1|1,0,0]=3 4932 B8R1.23 NC(=S)N1CC(=O)C1 Amb24481424 [0,0,0,1,0,1|1,1,0]=4 4933 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,0,0,1,0,1|1,0,1]=4 4934 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,0,0,1,0,1|1,0,1]=4 4935 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,0,0,1,0,1|1,0,1]=4 4936 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,0,0,1,0,1|1,0,1]=4 4937 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,0,0,1,0,1|1,0,1]=4 4938 B8R1.23 O=C1CC(C1)C(=O)Cl Amb16230813 [0,0,0,1,0,1|1,0,0]=3 4939 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,0,0,1,0,1|0,0,0]=2 4940 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,0,0,1,0,1|0,0,0]=2 4941 B8R1.23 O=C1CC(N1)S(=O)Cl Amb25835668 [0,0,0,1,0,1|2,0,0]=4 4942 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,1|1,0,1]=4 4943 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,0,0,1,0,1|0,0,0]=2 4944 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,0,0,1,0,1|1,0,1]=4 4945 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,0,0,1,0,1|0,0,0]=2 4946 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,0,0,1,0,1|0,0,2]=4 4947 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,0,0,1,0,1|0,0,2]=4 4948 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,1|1,0,1]=4 4949 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,1|1,0,1]=4 4950 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,1|1,0,1]=4 4951 B8R1.35 OC(=O)CC=C1CC1 Amb25119812 [0,0,0,1,0,1|1,0,0]=3 4952 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,1|1,0,1]=4 4953 B8R1.51 CC1(C)CSC(=O)O1 Amb24357776 [0,0,0,1,0,1|1,0,1]=4 4954 B8R1.51 CC1(O)CC(=O)CC1 Amb25129578 [0,0,0,1,0,1|1,0,1]=4 4955 B8R1.51 CC1(O)CCC(=O)O1 Amb22338334 [0,0,0,1,0,1|0,0,2]=4 4956 B8R1.51 CP1(=O)CC(=O)CC1 Amb25231314 [0,0,0,1,0,1|2,0,0]=4 4957 B8R1.51 CP1(=O)CCC(=O)O1 Amb22228817 [0,0,0,1,0,1|1,0,0]=3 4958 B8R1.51 C[C@@]1(O)CNC(=O)C1 Amb24672065 [0,0,0,1,0,1|1,0,1]=4 4959 B8R1.51 O=C1CCS(=O)(=O)C1 Amb2373731 [0,0,0,1,0,1|1,0,1]=4 4960 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,0,0,1,0,1|2,0,0]=4 4961 B8R1.51 O=C1COC(O1)(C)C Amb10601611 [0,0,0,1,0,1|1,0,1]=4 4962 B8R1.51 O=C1NCC(O1)(C)C Amb16202554 [0,0,0,1,0,1|1,0,1]=4 4963 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,0,0,1,0,1|1,0,1]=4 4964 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,0,0,1,0,1|1,0,1]=4 4965 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,0,0,1,0,1|1,0,1]=4 4966 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,0,0,1,0,1|1,0,1]=4 4967 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,1,0,1,0,0|1,0,1]=4 4968 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,1,0,1,0,0|1,0,1]=4 4969 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,1,0,1,0,0|1,0,1]=4 4970 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,1,0,1,0,0|1,0,1]=4 4971 B8R1.1 CC=1CC(C=O)=CC1 Amb22229827 [0,1,0,1,0,0|2,0,0]=4 4972 B8R1.1 CCC1=COC(=O)N1 Amb25276478 [0,1,0,1,0,0|2,0,0]=4 4973 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,1,0,1,0,0|1,0,0]=3 4974 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,1,0,1,0,0|1,0,1]=4 4975 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,1,0,1,0,0|1,0,0]=3 4976 B8R1.1 COC1=CC(=O)CO1 Amb25831195 [0,1,0,1,0,0|0,0,2]=4 4977 B8R1.1 COC1=CC(=O)CS1 Amb25032219 [0,1,0,1,0,0|0,1,1]=4 4978 B8R1.1 COC1=CCC(=O)O1 Amb24695758 [0,1,0,1,0,0|2,0,0]=4 4979 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,1,0,1,0,0|1,0,1]=4 4980 B8R1.1 COC=1CCC(=O)C1 Amb21864758 [0,1,0,1,0,0|1,0,1]=4 4981 B8R1.1 Cc1cc(C=O)oc1 Amb18124164 [0,1,0,1,0,0|1,0,1]=4 4982 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,1,0,1,0,0|1,0,1]=4 4983 B8R1.1 NCC=1CC(=O)NN1 Amb18833077 [0,1,0,1,0,0|2,0,0]=4 4984 B8R1.1 NCC=1CC(=O)ON1 Amb18833041 [0,1,0,1,0,0|1,0,0]=3 4985 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,1,0,1,0,0|1,0,1]=4 4986 B8R1.1 NNC=1COC(=O)C1 Amb18641767 [0,1,0,1,0,0|1,0,1]=4 4987 B8R1.1 O=C1C=C(C=O)ON1 Amb22498283 [0,1,0,1,0,0|1,0,1]=4 4988 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,1,0,1,0,0|1,0,1]=4 4989 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,1,0,1,0,0|1,0,1]=4 4990 B8R1.1 O=C1C=C(CO1)C=O Amb24417175 [0,1,0,1,0,0|0,0,1]=3 4991 B8R1.1 O=C1CC(C=O)=NN1 Amb18203380 [0,1,0,1,0,0|2,0,0]=4 4992 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,1,0,1,0,0|1,0,1]=4 4993 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,1,0,1,0,0|1,0,1]=4 4994 B8R1.1 O=C1CCC(=C1)C=O Amb24483014 [0,1,0,1,0,0|1,0,1]=4 4995 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,1,0,1,0,0|1,0,1]=4 4996 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,1,0,1,0,0|1,0,1]=4 4997 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,1,0,1,0,0|1,0,1]=4 4998 B8R1.1 O=C1OC(CBr)=CO1 Amb22491256 [0,1,0,1,0,0|2,0,0]=4 4999 B8R1.1 O=C1OC(CCl)=CO1 Amb25226799 [0,1,0,1,0,0|2,0,0]=4 5000 B8R1.1 O=C1O\C(\CO1)=C/Br Amb25074539 [0,1,0,1,0,0|2,0,0]=4 5001 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,1,0,1,0,0|1,0,1]=4 5002 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,1,0,1,0,0|1,0,1]=4 5003 B8R1.1 O=CN1CC(=O)CC1 Amb25787488 [0,1,0,1,0,0|2,0,0]=4 5004 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,1,0,1,0,0|1,0,1]=4 5005 B8R1.1 O=C[C@@H]1CNC(=O)C1 Amb24377645 [0,1,0,1,0,0|1,0,1]=4 5006 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,1,0,1,0,0|1,0,1]=4 5007 B8R1.1 OCC1=COC(=O)O1 Amb25214922 [0,1,0,1,0,0|2,0,0]=4 5008 B8R1.1 OCC1=NC(=O)CS1 Amb25739997 [0,1,0,1,0,0|1,1,0]=4 5009 B8R1.1 OCC1=NNC(=O)C1 Amb17593181 [0,1,0,1,0,0|2,0,0]=4 5010 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,1,0,1,0,0|1,0,1]=4 5011 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,1,0,1,0,0|0,0,2]=4 5012 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,1,0,1,0,0|0,0,2]=4 5013 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,1,0,1,0,0|0,0,2]=4 5014 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,1,0,1,0,0|1,0,1]=4 5015 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,1,0,1,0,0|0,0,2]=4 5016 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,1,0,1,0,0|1,0,1]=4 5017 B8R1.1 O\N=C\1/NC(=O)CS1 Amb19651333 [0,1,0,1,0,0|1,1,0]=4 5018 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,1,0,1,0,0|1,0,1]=4 5019 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,1,0,0|1,0,1]=4 5020 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,1,0,1,0,0|1,0,1]=4 5021 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,1,0,1,0,0|1,0,1]=4 5022 B8R1.4 CC=1CC(=O)C=NN1 Amb25340508 [0,1,0,1,0,0|2,0,0]=4 5023 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,1,0,1,0,0|2,0,0]=4 5024 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,1,0,1,0,0|1,0,0]=3 5025 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,1,0,1,0,0|1,0,1]=4 5026 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,1,0,1,0,0|2,0,0]=4 5027 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,1,0,1,0,0|2,0,0]=4 5028 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,1,0,0|1,0,1]=4 5029 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,1,0,1,0,0|1,0,1]=4 5030 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,1,0,1,0,0|1,0,1]=4 5031 B8R1.4 NC=1COCC(=O)C1 Amb25785409 [0,1,0,1,0,0|1,0,1]=4 5032 B8R1.4 NC=1CONC(=O)N1 Amb24698901 [0,1,0,1,0,0|2,0,0]=4 5033 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,1,0,1,0,0|1,0,1]=4 5034 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,1,0,1,0,0|1,0,1]=4 5035 B8R1.4 O=C1C=NCC(=O)N1 Amb25195978 [0,1,0,1,0,0|2,0,0]=4 5036 B8R1.4 O=C1CC(=O)OC=C1 Amb25358147 [0,1,0,1,0,0|0,0,1]=3 5037 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,1,0,1,0,0|1,0,1]=4 5038 B8R1.4 O=C1CC=CC(=N1)O Amb10552473 [0,1,0,1,0,0|2,0,0]=4 5039 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,1,0,0|1,0,0]=3 5040 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,1,0,1,0,0|2,0,0]=4 5041 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,1,0,0|2,0,0]=4 5042 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,1,0,1,0,0|1,0,0]=3 5043 B8R1.4 O=C1CCSC(=O)N1 Amb1150323 [0,1,0,1,0,0|1,1,0]=4 5044 B8R1.4 O=C1CNCC(=O)C1 Amb22755578 [0,1,0,1,0,0|1,0,0]=3 5045 B8R1.4 O=C1CNCC(=O)N1 Amb18641768 [0,1,0,1,0,0|2,0,0]=4 5046 B8R1.4 O=C1CNCC(=O)N1 Amb19148314 [0,1,0,1,0,0|2,0,0]=4 5047 B8R1.4 O=C1CNCC(=O)O1 Amb25834762 [0,1,0,1,0,0|2,0,0]=4 5048 B8R1.4 O=C1COCC(=O)C1 Amb22292040 [0,1,0,1,0,0|0,0,0]=2 5049 B8R1.4 O=C1COCC(=O)C1 Amb22406411 [0,1,0,1,0,0|0,0,0]=2 5050 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,1,0,1,0,0|1,0,0]=3 5051 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,1,0,0|1,0,0]=3 5052 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,1,0,1,0,0|0,1,0]=3 5053 B8R1.4 O=C1NC(=O)CC=N1 Amb24060969 [0,1,0,1,0,0|2,0,0]=4 5054 B8R1.4 O=C1NC(=S)CON1 Amb24481585 [0,1,0,1,0,0|1,1,0]=4 5055 B8R1.4 O=C1NC=NC(=O)C1 Amb2542511 [0,1,0,1,0,0|1,0,1]=4 5056 B8R1.4 O=C1NOCC(=O)N1 Amb25270094 [0,1,0,1,0,0|1,0,0]=3 5057 B8R1.4 O=C1[CH-]C(=O)COC1 Amb20241003 [0,1,0,1,0,0|0,0,1]=3 5058 B8R1.4 O=[13C]1CCC[13C](=O)O1 Amb17614796 [0,1,0,1,0,0|2,0,0]=4 5059 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,1,0,1,0,0|1,0,0]=3 5060 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,1,0,1,0,0|1,0,0]=3 5061 B8R1.4 OC1=CC(=O)CCC1 Amb17844413 [0,1,0,1,0,0|1,0,1]=4 5062 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,1,0,1,0,0|1,0,1]=4 5063 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,1,0,1,0,0|1,0,1]=4 5064 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,1,0,1,0,0|0,0,2]=4 5065 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,1,0,1,0,0|1,0,1]=4 5066 B8R1.4 OC=1CC(=O)N=CN1 Amb19748545 [0,1,0,1,0,0|1,0,1]=4 5067 B8R1.4 OC=1CSCC(=O)C1 Amb25773337 [0,1,0,1,0,0|0,1,1]=4 5068 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,1,0,1,0,0|1,0,1]=4 5069 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,1,0,1,0,0|1,0,1]=4 5070 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,1,0,1,0,0|1,0,1]=4 5071 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,1,0,1,0,0|0,0,2]=4 5072 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,1,0,1,0,0|0,0,2]=4 5073 B8R1.18 CC1=CC(=C)CC1=O Amb24689514 [0,1,0,1,0,0|2,0,0]=4 5074 B8R1.18 CC1=CC(=O)CC1=O Amb24583077 [0,1,0,1,0,0|1,0,0]=3 5075 B8R1.18 CC1=CC(=O)CC1O Amb24633748 [0,1,0,1,0,0|1,0,1]=4 5076 B8R1.18 CC1=CC(=O)C[C@@H]1O Amb25093715 [0,1,0,1,0,0|1,0,1]=4 5077 B8R1.18 CC1=CC(=O)C[C@H]1O Amb24612700 [0,1,0,1,0,0|1,0,1]=4 5078 B8R1.18 CC1=CC(=O)N(C)O1 Amb24524296 [0,1,0,1,0,0|1,0,1]=4 5079 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,1,0,1,0,0|1,0,1]=4 5080 B8R1.18 CC1=CC(=O)OC1Cl Amb24601836 [0,1,0,1,0,0|1,0,1]=4 5081 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,1,0,1,0,0|0,0,2]=4 5082 B8R1.18 CC1=CC(O)CC1=O Amb25686945 [0,1,0,1,0,0|1,0,1]=4 5083 B8R1.18 CC1=C[C@@H](O)CC1=O Amb25706986 [0,1,0,1,0,0|1,0,1]=4 5084 B8R1.18 CC1=NN(C(=O)C1)C Amb2228109 [0,1,0,1,0,0|2,0,0]=4 5085 B8R1.18 CC1CC(=O)C(O)=C1 Amb25370657 [0,1,0,1,0,0|1,0,1]=4 5086 B8R1.18 CC1CC(O)C(=O)C1 Amb25143497 [0,1,0,1,0,0|1,0,1]=4 5087 B8R1.18 CC1CC(O)CC1=O Amb24752493 [0,1,0,1,0,0|1,0,1]=4 5088 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,1,0,1,0,0|1,0,0]=3 5089 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,1,0,1,0,0|1,0,1]=4 5090 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,1,0,1,0,0|1,0,1]=4 5091 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,1,0,1,0,0|1,0,0]=3 5092 B8R1.18 CC1OC(O)=CC1=O Amb24398067 [0,1,0,1,0,0|0,0,2]=4 5093 B8R1.18 CC1SC(=O)NC1=O Amb21857287 [0,1,0,1,0,0|1,1,0]=4 5094 B8R1.18 CC=1CC(=O)CC1C Amb25318947 [0,1,0,1,0,0|2,0,0]=4 5095 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,1,0,1,0,0|1,0,0]=3 5096 B8R1.18 CC=1OC(=O)NC1C Amb19516947 [0,1,0,1,0,0|2,0,0]=4 5097 B8R1.18 CC=1OC(=O)OC1C Amb19654027 [0,1,0,1,0,0|2,0,0]=4 5098 B8R1.18 CN1CC(=O)CC1=O Amb18833080 [0,1,0,1,0,0|1,0,0]=3 5099 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,1,0,1,0,0|1,0,0]=3 5100 B8R1.18 CN1CC(O)=CC1=O Amb17943215 [0,1,0,1,0,0|1,0,1]=4 5101 B8R1.18 CN1CC(O)CC1=O Amb22059466 [0,1,0,1,0,0|1,0,1]=4 5102 B8R1.18 CN1CS(=O)CC1=O Amb24579772 [0,1,0,1,0,0|2,0,0]=4 5103 B8R1.18 CN1C[C@H](O)CC1=O Amb25762416 [0,1,0,1,0,0|1,0,1]=4 5104 B8R1.18 CN1N=C(N)CC1=O Amb18665066 [0,1,0,1,0,0|2,0,0]=4 5105 B8R1.18 CN1NC(=N)CC1=O Amb19314983 [0,1,0,1,0,0|2,0,0]=4 5106 B8R1.18 CN1NC(=O)CC1=O Amb24741634 [0,1,0,1,0,0|1,0,0]=3 5107 B8R1.18 CN1NC(=O)NC1=O Amb25324546 [0,1,0,1,0,0|2,0,0]=4 5108 B8R1.18 CN1OC(=O)NC1=O Amb25732949 [0,1,0,1,0,0|1,0,0]=3 5109 B8R1.18 CN1OC(N)=NC1=O Amb25069191 [0,1,0,1,0,0|2,0,0]=4 5110 B8R1.18 C[C@@H]1CC(=O)NC1=O Amb25709913 [0,1,0,1,0,0|1,0,1]=4 5111 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,1,0,0|0,0,1]=3 5112 B8R1.18 C[C@@H]1C[C@H](O)CC1=O Amb25236934 [0,1,0,1,0,0|1,0,1]=4 5113 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,1,0,1,0,0|1,0,0]=3 5114 B8R1.18 C[C@@H]1NC(=O)SC1=O Amb25339419 [0,1,0,1,0,0|2,0,0]=4 5115 B8R1.18 C[C@@H]1OC(=O)C=C1O Amb25087875 [0,1,0,1,0,0|0,0,2]=4 5116 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,1,0,1,0,0|0,0,2]=4 5117 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,1,0,1,0,0|1,0,1]=4 5118 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,1,0,1,0,0|0,0,2]=4 5119 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,1,0,1,0,0|1,0,1]=4 5120 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,1,0,1,0,0|0,0,2]=4 5121 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,1,0,1,0,0|1,0,1]=4 5122 B8R1.18 C[C@H]1O[C@H](C)CC1=O Amb25744762 [0,1,0,1,0,0|1,0,1]=4 5123 B8R1.18 C[N+]1=CC(=O)NC1=O Amb25706914 [0,1,0,1,0,0|2,0,0]=4 5124 B8R1.18 NC1=CC(=O)CC1=O Amb24694478 [0,1,0,1,0,0|1,0,1]=4 5125 B8R1.18 NC1=NC(=O)CN1O Amb25745247 [0,1,0,1,0,0|2,0,0]=4 5126 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,1,0,1,0,0|1,0,1]=4 5127 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,1,0,1,0,0|1,0,1]=4 5128 B8R1.18 N[C@@H]1CC(=O)NC1=O Amb18033835 [0,1,0,1,0,0|2,0,0]=4 5129 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,1,0,0|1,0,1]=4 5130 B8R1.18 O=C1C=C(C(=O)O1)Br Amb15693391 [0,1,0,1,0,0|1,0,1]=4 5131 B8R1.18 O=C1C=C(C(=O)O1)Cl Amb10070255 [0,1,0,1,0,0|1,0,1]=4 5132 B8R1.18 O=C1CC(C(=O)N1)C Amb10609734 [0,1,0,1,0,0|1,0,1]=4 5133 B8R1.18 O=C1CC(Cl)=C(Cl)C1 Amb25767090 [0,1,0,1,0,0|2,0,0]=4 5134 B8R1.18 O=C1CN(C(=O)N1)N Amb1106079 [0,1,0,1,0,0|2,0,0]=4 5135 B8R1.18 O=C1C[C@@H](C(=O)N1)N Amb17134612 [0,1,0,1,0,0|2,0,0]=4 5136 B8R1.18 O=C1NC(=O)CC1Br Amb25226801 [0,1,0,1,0,0|2,0,0]=4 5137 B8R1.18 O=C1NC(=O)CC1S Amb25325951 [0,1,0,1,0,0|1,1,0]=4 5138 B8R1.18 O=C1NC(=O)CN1S Amb25856955 [0,1,0,1,0,0|1,1,0]=4 5139 B8R1.18 O=C1NC(C(=O)N1)C Amb1150065 [0,1,0,1,0,0|2,0,0]=4 5140 B8R1.18 O=C1NC(C(=O)N1)O Amb17615425 [0,1,0,1,0,0|2,0,0]=4 5141 B8R1.18 O=C1NC(Cl)C(=O)N1 Amb25690677 [0,1,0,1,0,0|2,0,0]=4 5142 B8R1.18 O=C1N[C@@H](C(=O)N1)C Amb17617475 [0,1,0,1,0,0|2,0,0]=4 5143 B8R1.18 O=C1N[C@H](C(=O)N1)C Amb17617476 [0,1,0,1,0,0|2,0,0]=4 5144 B8R1.18 O=C1OC(=O)CC1Cl Amb24677749 [0,1,0,1,0,0|1,0,1]=4 5145 B8R1.18 O=C1OC(=O)C[C@@H]1Br Amb24558394 [0,1,0,1,0,0|1,0,1]=4 5146 B8R1.18 O=C1OC(=O)C[C@@H]1Cl Amb25837364 [0,1,0,1,0,0|1,0,1]=4 5147 B8R1.18 O=C1SC(C(=O)N1)Br Amb2436078 [0,1,0,1,0,0|1,1,0]=4 5148 B8R1.18 O=[13C]1[13CH2]N([13C](=O)N1)N Amb17608095 [0,1,0,1,0,0|2,0,0]=4 5149 B8R1.18 OC1=CC(=O)CC1=O Amb24330381 [0,1,0,1,0,0|0,0,1]=3 5150 B8R1.18 OC1=CC(=O)CN1O Amb24369018 [0,1,0,1,0,0|0,0,2]=4 5151 B8R1.18 OC1CC(=O)CC1=O Amb24330382 [0,1,0,1,0,0|0,0,0]=2 5152 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,1,0,1,0,0|0,0,2]=4 5153 B8R1.18 OC1OC(=O)C=C1Br Amb22490504 [0,1,0,1,0,0|1,0,1]=4 5154 B8R1.18 OC=1CC(=O)C(=O)C1 Amb25721482 [0,1,0,1,0,0|1,0,1]=4 5155 B8R1.18 O[C@@H]1CC(=O)OC1=O Amb25142904 [0,1,0,1,0,0|1,0,0]=3 5156 B8R1.18 O[C@H]1CC(=O)NC1=O Amb24458089 [0,1,0,1,0,0|1,0,0]=3 5157 B8R1.31 CC(=O)C1=CNC1=O Amb25833822 [0,1,0,1,0,0|1,0,1]=4 5158 B8R1.31 CC(=O)C1CNC1=O Amb24526367 [0,1,0,1,0,0|1,0,0]=3 5159 B8R1.31 CC(=O)C1COC1=O Amb24601316 [0,1,0,1,0,0|0,0,0]=2 5160 B8R1.31 CC(C)C1OCC1=O Amb23456090 [0,1,0,1,0,0|1,0,1]=4 5161 B8R1.31 CC(O)C1CCC1=O Amb24363437 [0,1,0,1,0,0|1,0,1]=4 5162 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,1,0,1,0,0|1,0,1]=4 5163 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,1,0,1,0,0|2,0,0]=4 5164 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,1,0,1,0,0|2,0,0]=4 5165 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,1,0,1,0,0|2,0,0]=4 5166 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,1,0,1,0,0|1,0,1]=4 5167 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,1,0,1,0,0|1,0,1]=4 5168 B8R1.31 C[C@H](O)[C@@H]1CNC1=O Amb25224413 [0,1,0,1,0,0|1,0,1]=4 5169 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,1,0,1,0,0|1,0,1]=4 5170 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,1,0,1,0,0|1,0,1]=4 5171 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,1,0,1,0,0|1,0,1]=4 5172 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,1,0,1,0,0|2,0,0]=4 5173 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,1,0,1,0,0|1,0,1]=4 5174 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,1,0,1,0,0|1,0,1]=4 5175 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,1,0,1,0,0|1,0,1]=4 5176 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,1,0,1,0,0|1,0,1]=4 5177 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,1,0,1,0,0|1,0,1]=4 5178 B8R1.31 O=C1CNC1S(=O)Cl Amb25746265 [0,1,0,1,0,0|2,0,0]=4 5179 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,1,0,1,0,0|0,1,1]=4 5180 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,1,0,1,0,0|0,0,0]=2 5181 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,1,0,1,0,0|1,0,1]=4 5182 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,1,0,1,0,0|1,0,1]=4 5183 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,1,0,1,0,0|0,0,2]=4 5184 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,1,0,1,0,0|0,0,2]=4 5185 B8R1.31 [C@H]1(CNC1=O)[C@@H](C)O Amb17843592 [0,1,0,1,0,0|1,0,1]=4 5186 B8R1.34 CC(=O)C=C1COC1 Amb20671341 [0,1,0,1,0,0|1,0,1]=4 5187 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,1,0,1,0,0|1,0,1]=4 5188 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,1,0,1,0,0|1,0,1]=4 5189 B8R1.34 OC(=O)C=C1CSC1 Amb24379733 [0,1,0,1,0,0|0,1,1]=4 5190 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,1,0,1,0,0|1,0,1]=4 5191 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,1,0,1,0,0|1,0,1]=4 5192 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,1,0,1,0,0|1,0,1]=4 5193 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,1,0,1,0,0|1,0,1]=4 5194 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,1,0,1,0,0|0,0,2]=4 5195 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,1,0,1,0,0|1,0,0]=3 5196 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,1,0,1,0,0|2,0,0]=4 5197 B8R1.40 COC(=O)CC1CC1 Amb20622313 [0,1,0,1,0,0|1,0,1]=4 5198 B8R1.40 ONC(=O)CC1CC1 Amb25704077 [0,1,0,1,0,0|1,0,1]=4 5199 B8R1.42 CC(=O)CC1(C)CO1 Amb25232199 [0,1,0,1,0,0|1,0,1]=4 5200 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,1,0,1,0,0|1,0,1]=4 5201 B8R1.42 NC1(CC(O)=O)CC1 Amb18833024 [0,1,0,1,0,0|1,0,1]=4 5202 B8R1.42 NC1(CC(O)=O)CC1 Amb21964520 [0,1,0,1,0,0|1,0,1]=4 5203 B8R1.42 OC(=O)CC1(O)CC1 Amb24117238 [0,1,0,1,0,0|0,0,2]=4 5204 B8R1.43 C#C[C@@H]1C[C@H]1C(O)=O Amb25294666 [0,1,0,1,0,0|1,0,1]=4 5205 B8R1.43 C#C[C@H]1C[C@@H]1C(O)=O Amb24076488 [0,1,0,1,0,0|1,0,1]=4 5206 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,1,0,1,0,0|1,0,1]=4 5207 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,1,0,1,0,0|1,0,1]=4 5208 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,1,0,1,0,0|1,0,1]=4 5209 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,1,0,1,0,0|1,0,1]=4 5210 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,1,0,1,0,0|0,0,2]=4 5211 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,1,0,1,0,0|1,0,1]=4 5212 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,1,0,1,0,0|0,0,2]=4 5213 B8R1.43 COC1CC1C(C)=O Amb25252874 [0,1,0,1,0,0|1,0,1]=4 5214 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,1,0,1,0,0|0,0,2]=4 5215 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,1,0,1,0,0|0,0,2]=4 5216 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,1,0,1,0,0|1,0,0]=3 5217 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,1,0,1,0,0|1,0,0]=3 5218 B8R1.43 N#CC1CC1C(O)=O Amb24183452 [0,1,0,1,0,0|1,0,1]=4 5219 B8R1.43 N#C[C@@H]1C[C@@H]1C(O)=O Amb24183522 [0,1,0,1,0,0|1,0,1]=4 5220 B8R1.43 N#C[C@@H]1C[C@H]1C(O)=O Amb24183456 [0,1,0,1,0,0|1,0,1]=4 5221 B8R1.43 N#C[C@H]1C[C@H]1C(O)=O Amb25168974 [0,1,0,1,0,0|1,0,1]=4 5222 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,1,0,1,0,0|1,0,1]=4 5223 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,1,0,1,0,0|1,0,1]=4 5224 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,1,0,1,0,0|0,0,1]=3 5225 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,1,0,1,0,0|1,0,1]=4 5226 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,1,0,1,0,0|0,0,1]=3 5227 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,1,0,1,0,0|1,0,1]=4 5228 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,1,0,1,0,0|0,0,2]=4 5229 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,1,0,1,0,0|0,0,2]=4 5230 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,1,0,1,0,0|0,0,2]=4 5231 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,1,0,1,0,0|0,0,2]=4 5232 B8R1.62 CC1(CCl)CC(=O)O1 Amb25784185 [0,1,0,1,0,0|1,0,1]=4 5233 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,1,0,1,0,0|1,0,1]=4 5234 B8R1.62 COC1(C)CC(=O)C1 Amb24686485 [0,1,0,1,0,0|1,0,1]=4 5235 B8R1.67 CC(=O)[C@@H]1[C@@H](C)C1=C Amb24634605 [0,1,0,1,0,0|2,0,0]=4 5236 B8R1.67 CC(=O)[C@H]1[C@H](C)C1=C Amb25336490 [0,1,0,1,0,0|2,0,0]=4 5237 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,1,0,1,0,0|1,0,1]=4 5238 B8R1.67 CC1C(N)C1C(O)=O Amb25764435 [0,1,0,1,0,0|1,0,1]=4 5239 B8R1.67 CC=1C(C(O)=O)C1C Amb25737086 [0,1,0,1,0,0|1,0,0]=3 5240 B8R1.67 CC=1C(C)C1C(O)=O Amb24586301 [0,1,0,1,0,0|1,0,1]=4 5241 B8R1.67 CC=1[C@H](C)C1C(O)=O Amb24445514 [0,1,0,1,0,0|1,0,1]=4 5242 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,1,0,1,0,0|1,0,1]=4 5243 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,1,0,1,0,0|1,0,1]=4 5244 B8R1.67 C[C@H]1[C@H](N)[C@@H]1C(O)=O Amb24698691 [0,1,0,1,0,0|1,0,1]=4 5245 B8R1.83 CC1OC1C(=O)NC Amb25204387 [0,1,0,1,0,0|1,0,1]=4 5246 B8R1.83 CC1OC1C(=O)OC Amb22055865 [0,1,0,1,0,0|0,0,2]=4 5247 B8R1.83 CCC(=O)C1CC1=C Amb25712970 [0,1,0,1,0,0|2,0,0]=4 5248 B8R1.83 COC(=O)C1CC1F Amb25373911 [0,1,0,1,0,0|1,0,1]=4 5249 B8R1.83 COC(=O)C1CC1O Amb25328067 [0,1,0,1,0,0|0,0,2]=4 5250 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br Amb25242493 [0,1,0,1,0,0|1,0,1]=4 5251 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Cl Amb24519340 [0,1,0,1,0,0|1,0,1]=4 5252 B8R1.83 COC(=O)[C@@H]1C[C@H]1Cl Amb24610039 [0,1,0,1,0,0|1,0,1]=4 5253 B8R1.83 COC(=O)[C@H]1C[C@@H]1Cl Amb24519701 [0,1,0,1,0,0|1,0,1]=4 5254 B8R1.83 COC(=O)[C@H]1C[C@@H]1N Amb24629188 [0,1,0,1,0,0|1,0,1]=4 5255 B8R1.83 C[C@@H]1N[C@H]1C(=O)OC Amb24120620 [0,1,0,1,0,0|1,0,1]=4 5256 B8R1.83 C[C@H]1C[C@@H]1C(=O)NO Amb25358413 [0,1,0,1,0,0|1,0,1]=4 5257 B8R1.30 C=C1CC1(N)C(N)=O Amb25239007 [0,1,0,1,0,0|2,0,0]=4 5258 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,1,0,1,0,0|1,0,0]=3 5259 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,1,0,1,0,0|1,0,1]=4 5260 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,1,0,1,0,0|0,0,2]=4 5261 B8R1.30 CC1=NC1(C)C(N)=O Amb25230606 [0,1,0,1,0,0|2,0,0]=4 5262 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,1,0,1,0,0|1,0,1]=4 5263 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,1,0,1,0,0|1,0,1]=4 5264 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,1,0,1,0,0|1,0,1]=4 5265 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,1,0,1,0,0|0,0,2]=4 5266 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,1,0,1,0,0|1,0,1]=4 5267 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,1,0,1,0,0|1,0,1]=4 5268 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,1,0,1,0,0|1,0,1]=4 5269 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,1,0,1,0,0|1,0,1]=4 5270 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,1,0,1,0,0|0,0,2]=4 5271 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,1,0,1,0,0|1,0,1]=4 5272 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,1,0,1,0,0|1,0,1]=4 5273 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,1,0,1,0,0|1,0,1]=4 5274 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,1,0,1,0,0|1,0,1]=4 5275 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,1,0,1,0,0|1,0,1]=4 5276 B8R1.30 N[C@@]1(C[C@H]1Cl)C(O)=O Amb22748908 [0,1,0,1,0,0|1,0,1]=4 5277 B8R1.30 N[C@]1(C[C@@H]1Cl)C(O)=O Amb25245700 [0,1,0,1,0,0|1,0,1]=4 5278 B8R1.30 N[C@]1(C[C@H]1Br)C(O)=O Amb24567904 [0,1,0,1,0,0|1,0,1]=4 5279 B8R1.50 BrC1=C(Br)C(=O)OC1 Amb10067289 [0,1,0,1,0,0|1,0,1]=4 5280 B8R1.50 BrC1C(=O)CCC1=O Amb10975590 [0,1,0,1,0,0|1,0,0]=3 5281 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,1,0,1,0,0|0,0,0]=2 5282 B8R1.50 C=C1C(=O)CCC1=O Amb25128928 [0,1,0,1,0,0|1,0,1]=4 5283 B8R1.50 CC1=CNC(=O)C1C Amb25367339 [0,1,0,1,0,0|2,0,0]=4 5284 B8R1.50 CC1=NNC(=O)C1Br Amb22330367 [0,1,0,1,0,0|2,0,0]=4 5285 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,1,0,1,0,0|1,0,0]=3 5286 B8R1.50 CC1=NOC(=O)N1C Amb25031408 [0,1,0,1,0,0|2,0,0]=4 5287 B8R1.50 CC1C(=O)C=CC1=O Amb25675832 [0,1,0,1,0,0|1,0,1]=4 5288 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,1,0,1,0,0|1,0,1]=4 5289 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,1,0,1,0,0|0,0,2]=4 5290 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,1,0,1,0,0|1,0,1]=4 5291 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,1,0,1,0,0|1,0,1]=4 5292 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,1,0,1,0,0|1,0,1]=4 5293 B8R1.50 CC1SOC(=O)C1N Amb24665733 [0,1,0,1,0,0|0,1,1]=4 5294 B8R1.50 CC=1C(=O)OCC1C Amb25859061 [0,1,0,1,0,0|1,0,1]=4 5295 B8R1.50 CC=1C(=O)ONC1C Amb22490660 [0,1,0,1,0,0|1,0,1]=4 5296 B8R1.50 CC=1COC(=O)C1N Amb25025754 [0,1,0,1,0,0|1,0,1]=4 5297 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,1,0,1,0,0|1,0,1]=4 5298 B8R1.50 CN1C(=O)CNC1=O Amb22002559 [0,1,0,1,0,0|2,0,0]=4 5299 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,1,0,1,0,0|1,0,0]=3 5300 B8R1.50 CN1C(=O)CSC1=O Amb1883006 [0,1,0,1,0,0|1,1,0]=4 5301 B8R1.50 C[C-]1C(=O)CCC1=O Amb24458437 [0,1,0,1,0,0|1,0,1]=4 5302 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,1,0,1,0,0|1,0,1]=4 5303 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,1,0,1,0,0|0,0,2]=4 5304 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,1,0,1,0,0|1,0,1]=4 5305 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,1,0,1,0,0|1,0,1]=4 5306 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,1,0,1,0,0|1,0,1]=4 5307 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,1,0,1,0,0|1,0,1]=4 5308 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,1,0,1,0,0|1,0,1]=4 5309 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,1,0,1,0,0|0,0,2]=4 5310 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,1,0,1,0,0|1,0,1]=4 5311 B8R1.50 NC=1C(=O)OCC1Br Amb24553799 [0,1,0,1,0,0|1,0,1]=4 5312 B8R1.50 NC=1C(=O)OCC1Cl Amb25378846 [0,1,0,1,0,0|1,0,1]=4 5313 B8R1.50 NN1C(=O)CCC1=O Amb18641764 [0,1,0,1,0,0|2,0,0]=4 5314 B8R1.50 NN1C(=O)CCC1=O Amb24323275 [0,1,0,1,0,0|2,0,0]=4 5315 B8R1.50 NN1C(=O)CSC1=O Amb22011876 [0,1,0,1,0,0|1,1,0]=4 5316 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,1,0,1,0,0|0,0,2]=4 5317 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,1,0,1,0,0|0,0,2]=4 5318 B8R1.50 O=C1C(=O)COC1=O Amb24364125 [0,1,0,1,0,0|0,0,1]=3 5319 B8R1.50 O=C1CCC(=O)C1F Amb24466994 [0,1,0,1,0,0|1,0,0]=3 5320 B8R1.50 O=C1CCC(=O)C1[Na] Amb25162789 [0,1,0,1,0,0|1,0,0]=3 5321 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,1,0,1,0,0|1,0,1]=4 5322 B8R1.50 OC1=C(O)CCC1=O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 5323 B8R1.50 OC1C(=O)C=CC1=O Amb25272521 [0,1,0,1,0,0|1,0,1]=4 5324 B8R1.50 OC1C(=O)CCC1=O Amb24443990 [0,1,0,1,0,0|1,0,0]=3 5325 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,1,0,1,0,0|0,0,0]=2 5326 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,1,0,1,0,0|1,0,1]=4 5327 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,1,0,1,0,0|0,0,2]=4 5328 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,1,0,1,0,0|1,0,1]=4 5329 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,1,0,1,0,0|0,0,2]=4 5330 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,1,0,1,0,0|0,0,2]=4 5331 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,1,0,1,0,0|0,0,2]=4 5332 B8R1.50 OC=1CCC(=O)C1Br Amb25205766 [0,1,0,1,0,0|1,0,1]=4 5333 B8R1.50 OC=1CCC(=O)C1Cl Amb24378334 [0,1,0,1,0,0|1,0,1]=4 5334 B8R1.50 OC=1COC(=O)C1Cl Amb22360617 [0,1,0,1,0,0|0,0,2]=4 5335 B8R1.50 ON1C(=O)CCC1=O Amb1152089 [0,1,0,1,0,0|2,0,0]=4 5336 B8R1.50 ON1C(=O)CNC1=O Amb24699499 [0,1,0,1,0,0|2,0,0]=4 5337 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,1,0,1,0,0|0,0,2]=4 5338 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,1,0,1,0,0|0,0,2]=4 5339 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,1,0,1,0,0|1,0,1]=4 5340 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,1,0,1,0,0|0,0,2]=4 5341 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,1,0,1,0,0|1,0,1]=4 5342 B8R1.54 CC(C(O)=O)=C1CC1 Amb24450586 [0,1,0,1,0,0|1,0,1]=4 5343 B8R1.54 NC(C1CC1)C(O)=O Amb19515010 [0,1,0,1,0,0|1,0,1]=4 5344 B8R1.54 N[C@@H](C1CC1)C(O)=O Amb19929447 [0,1,0,1,0,0|1,0,1]=4 5345 B8R1.54 OC(=O)C(Br)C1CC1 Amb24634830 [0,1,0,1,0,0|1,0,1]=4 5346 B8R1.54 OC(=O)C(Cl)=C1CC1 Amb24427356 [0,1,0,1,0,0|1,0,1]=4 5347 B8R1.54 OC(=O)C(Cl)C1CC1 Amb24333436 [0,1,0,1,0,0|1,0,1]=4 5348 B8R1.54 OC(C1CC1)C(O)=O Amb18282441 [0,1,0,1,0,0|1,0,1]=4 5349 B8R1.54 O[C@@H](C1CC1)C(O)=O Amb25312037 [0,1,0,1,0,0|1,0,1]=4 5350 B8R1.54 O[C@H](C1CC1)C(O)=O Amb25715899 [0,1,0,1,0,0|1,0,1]=4 5351 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,2,0,0|1,0,1]=4 5352 B8R2.18 O=C1C[C@@H]2O[C@@H]2C1 Amb25768575 [0,0,0,2,0,0|1,0,1]=4 5353 B8R2.38 O=C1CC[C@@H]2O[C@H]12 Amb25025235 [0,0,0,2,0,0|1,0,1]=4 5354 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|1,0,1]=4 5355 B8R2.38 O=C1OCC2OC12 Amb24061718 [0,0,0,2,0,0|0,0,2]=4 5356 B8R2.66 OC(=O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|1,0,1]=4 5357 B8R0.28 C=C(Br)CNCC(O)=O Amb18303844 [0,0,0,0,0,2|1,0,1]=4 5358 B8R0.28 C=C(Br)CSCC(O)=O Amb25369923 [0,0,0,0,0,2|1,0,1]=4 5359 B8R0.28 C=C(F)CCCC(O)=O Amb22641515 [0,0,0,0,0,2|1,0,1]=4 5360 B8R0.28 CC(=C)CCCC(C)=O Amb17739959 [0,0,0,0,0,2|2,0,0]=4 5361 B8R0.28 CC(=C)CCOC(N)=O Amb24760559 [0,0,0,0,0,2|2,0,0]=4 5362 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [0,0,0,0,0,2|1,0,0]=3 5363 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [0,0,0,0,0,2|1,0,0]=3 5364 B8R0.28 CC(=O)C=NNC(N)=O Amb24561654 [0,0,0,0,0,2|1,0,1]=4 5365 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,2|2,0,0]=4 5366 B8R0.28 CC(=O)CCC=C(F)F Amb24478042 [0,0,0,0,0,2|2,0,0]=4 5367 B8R0.28 CC(=O)CCCB(O)O Amb24068595 [0,0,0,0,0,2|1,0,1]=4 5368 B8R0.28 CC(=O)CCCC(=C)O Amb24422924 [0,0,0,0,0,2|1,0,0]=3 5369 B8R0.28 CC(=O)CCCC(=O)Cl Amb24752758 [0,0,0,0,0,2|1,0,0]=3 5370 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,2|0,0,0]=2 5371 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,0,0,0,0,2|1,0,0]=3 5372 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,2|1,0,0]=3 5373 B8R0.28 CC(=O)CCC[N+]([O-])=O Amb18203187 [0,0,0,0,0,2|1,0,1]=4 5374 B8R0.28 CC(=O)CCNC(=O)C Amb17102868 [0,0,0,0,0,2|1,0,0]=3 5375 B8R0.28 CC(=O)CC\C=C(/Cl)\C Amb17593664 [0,0,0,0,0,2|2,0,0]=4 5376 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [0,0,0,0,0,2|1,0,0]=3 5377 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,0,0,0,0,2|0,0,0]=2 5378 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [0,0,0,0,0,2|1,0,0]=3 5379 B8R0.28 CC(=O)CSCC(=C)Br Amb24421359 [0,0,0,0,0,2|2,0,0]=4 5380 B8R0.28 CC(=O)CSCC(C)=O Amb25244895 [0,0,0,0,0,2|1,0,0]=3 5381 B8R0.28 CC(=O)CSCC([O-])=O Amb20622616 [0,0,0,0,0,2|0,0,1]=3 5382 B8R0.28 CC(=O)C\C=C/C(C)=C Amb25810284 [0,0,0,0,0,2|2,0,0]=4 5383 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [0,0,0,0,0,2|0,0,0]=2 5384 B8R0.28 CC(=O)C\C=C\C(C)=C Amb24744667 [0,0,0,0,0,2|2,0,0]=4 5385 B8R0.28 CC(=O)N=C=CC(C)=O Amb24072229 [0,0,0,0,0,2|1,0,1]=4 5386 B8R0.28 CC(=O)N=CNC(C)=O Amb24541273 [0,0,0,0,0,2|1,0,1]=4 5387 B8R0.28 CC(=O)NCCC(=S)N Amb17232012 [0,0,0,0,0,2|1,1,0]=4 5388 B8R0.28 CC(=O)NOCC(N)=S Amb24451570 [0,0,0,0,0,2|1,1,0]=4 5389 B8R0.28 CC(=O)N\C=C\C(N)=O Amb24477760 [0,0,0,0,0,2|1,0,1]=4 5390 B8R0.28 CC(=O)OCC=C(F)F Amb16186005 [0,0,0,0,0,2|2,0,0]=4 5391 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [0,0,0,0,0,2|0,0,0]=2 5392 B8R0.28 CC(=O)OCCS(C)=O Amb24481662 [0,0,0,0,0,2|2,0,0]=4 5393 B8R0.28 CC(=O)O[Ba]OC(=O)C Amb10844613 [0,0,0,0,0,2|2,0,0]=4 5394 B8R0.28 CC(=O)O[Ca]OC(C)=O Amb22264860 [0,0,0,0,0,2|2,0,0]=4 5395 B8R0.28 CC(=O)O[Ca]OC(C)=O Amb22336267 [0,0,0,0,0,2|2,0,0]=4 5396 B8R0.28 CC(=O)O[Cd]OC(C)=O Amb22350451 [0,0,0,0,0,2|2,0,0]=4 5397 B8R0.28 CC(=O)O[Co]OC(C)=O Amb22338091 [0,0,0,0,0,2|2,0,0]=4 5398 B8R0.28 CC(=O)O[Co]OC(C)=O Amb22363263 [0,0,0,0,0,2|2,0,0]=4 5399 B8R0.28 CC(=O)O[Cu]OC(C)=O Amb22052496 [0,0,0,0,0,2|2,0,0]=4 5400 B8R0.28 CC(=O)O[Cu]OC(C)=O Amb22338197 [0,0,0,0,0,2|2,0,0]=4 5401 B8R0.28 CC(=O)O[Fe]OC(C)=O Amb22338217 [0,0,0,0,0,2|2,0,0]=4 5402 B8R0.28 CC(=O)O[Hg]OC(=O)C Amb16185776 [0,0,0,0,0,2|2,0,0]=4 5403 B8R0.28 CC(=O)O[Mg]OC(C)=O Amb22040076 [0,0,0,0,0,2|2,0,0]=4 5404 B8R0.28 CC(=O)O[Mg]OC(C)=O Amb22337577 [0,0,0,0,0,2|2,0,0]=4 5405 B8R0.28 CC(=O)O[Mn]OC(C)=O Amb22338042 [0,0,0,0,0,2|2,0,0]=4 5406 B8R0.28 CC(=O)O[Ni]OC(C)=O Amb22051702 [0,0,0,0,0,2|2,0,0]=4 5407 B8R0.28 CC(=O)O[Ni]OC(C)=O Amb22338559 [0,0,0,0,0,2|2,0,0]=4 5408 B8R0.28 CC(=O)O[Pb]OC(C)=O Amb22052504 [0,0,0,0,0,2|2,0,0]=4 5409 B8R0.28 CC(=O)O[Pb]OC(C)=O Amb22350672 [0,0,0,0,0,2|2,0,0]=4 5410 B8R0.28 CC(=O)O[Pb]OC(C)=O Amb22351529 [0,0,0,0,0,2|2,0,0]=4 5411 B8R0.28 CC(=O)O[Pb]OC(C)=O Amb22353099 [0,0,0,0,0,2|2,0,0]=4 5412 B8R0.28 CC(=O)O[Pd]OC(=O)C Amb13890307 [0,0,0,0,0,2|2,0,0]=4 5413 B8R0.28 CC(=O)O[Pd]OC(C)=O Amb19929253 [0,0,0,0,0,2|2,0,0]=4 5414 B8R0.28 CC(=O)O[Rh]OC(C)=O Amb19929807 [0,0,0,0,0,2|2,0,0]=4 5415 B8R0.28 CC(=O)O[Sr]OC(C)=O Amb22348499 [0,0,0,0,0,2|2,0,0]=4 5416 B8R0.28 CC(=O)O[Zn]OC(C)=O Amb22337710 [0,0,0,0,0,2|2,0,0]=4 5417 B8R0.28 CC(=O)O[Zn]OC(C)=O Amb22351898 [0,0,0,0,0,2|2,0,0]=4 5418 B8R0.28 CC(=O)O\N=C\C(C)=O Amb25043999 [0,0,0,0,0,2|1,0,1]=4 5419 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,2|2,0,0]=4 5420 B8R0.28 CC(=O)SCCB(O)O Amb25854421 [0,0,0,0,0,2|1,0,1]=4 5421 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [0,0,0,0,0,2|1,0,0]=3 5422 B8R0.28 CC(=O)SCNC(C)=O Amb24662115 [0,0,0,0,0,2|1,0,0]=3 5423 B8R0.28 CC(=O)\C=C/CC(C)=O Amb25072729 [0,0,0,0,0,2|1,0,0]=3 5424 B8R0.28 CC(=O)\C=C/NC(C)=O Amb24072874 [0,0,0,0,0,2|1,0,1]=4 5425 B8R0.28 CC(=O)\C=C\CC(C)=O Amb25238337 [0,0,0,0,0,2|1,0,0]=3 5426 B8R0.28 CC(=O)\C=C\NC(C)=O Amb24072848 [0,0,0,0,0,2|1,0,1]=4 5427 B8R0.28 CC(=O)\C=C\OC(C)=O Amb25225602 [0,0,0,0,0,2|1,0,1]=4 5428 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [0,0,0,0,0,2|0,0,0]=2 5429 B8R0.28 CC(=S)NCCC(C)=O Amb24682550 [0,0,0,0,0,2|1,1,0]=4 5430 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [0,0,0,0,0,2|0,1,0]=3 5431 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [0,0,0,0,0,2|1,0,0]=3 5432 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,0,0,0,0,2|1,0,1]=4 5433 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,0,0,0,0,2|1,0,1]=4 5434 B8R0.28 CC(C)=CC#CC(O)=O Amb24670652 [0,0,0,0,0,2|1,0,1]=4 5435 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [0,0,0,0,0,2|2,0,0]=4 5436 B8R0.28 CC(C)=CCNC(N)=O Amb25858742 [0,0,0,0,0,2|2,0,0]=4 5437 B8R0.28 CC(C)=CCOC(=O)Cl Amb24455011 [0,0,0,0,0,2|2,0,0]=4 5438 B8R0.28 CC(C)=CCOC(C)=O Amb22002433 [0,0,0,0,0,2|2,0,0]=4 5439 B8R0.28 CC(C)=CCOC(N)=O Amb25378568 [0,0,0,0,0,2|2,0,0]=4 5440 B8R0.28 CC(C)=COCC(C)=O Amb24389019 [0,0,0,0,0,2|2,0,0]=4 5441 B8R0.28 CC(C)=C\C=C\C(O)=O Amb18642414 [0,0,0,0,0,2|1,0,1]=4 5442 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,0,0,0,0,2|1,0,1]=4 5443 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,0,0,0,0,2|1,0,1]=4 5444 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,0,0,0,0,2|1,0,1]=4 5445 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,0,0,0,0,2|0,0,2]=4 5446 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,0,0,0,0,2|1,0,1]=4 5447 B8R0.28 CC(Cl)=CCCC(C)=O Amb25274421 [0,0,0,0,0,2|2,0,0]=4 5448 B8R0.28 CC(Cl)=CCNC(C)=O Amb25111784 [0,0,0,0,0,2|2,0,0]=4 5449 B8R0.28 CC(Cl)=CCNC(N)=O Amb25174965 [0,0,0,0,0,2|2,0,0]=4 5450 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,0,0,0,0,2|1,0,1]=4 5451 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,0,0,0,0,2|1,0,1]=4 5452 B8R0.28 CC(N)=NN=CC(O)=O Amb24455612 [0,0,0,0,0,2|1,0,1]=4 5453 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,0,0,0,0,2|1,0,1]=4 5454 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,0,0,0,0,2|1,0,1]=4 5455 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,0,0,0,0,2|1,0,1]=4 5456 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,0,0,0,0,2|1,0,1]=4 5457 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,0,0,0,0,2|1,0,1]=4 5458 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,0,0,0,0,2|1,0,1]=4 5459 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,0,0,0,0,2|0,0,2]=4 5460 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,0,0,0,0,2|0,0,2]=4 5461 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,0,0,0,0,2|0,1,1]=4 5462 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,0,0,0,0,2|0,1,1]=4 5463 B8R0.28 CN(C)C=NCC(O)=O Amb24740176 [0,0,0,0,0,2|2,0,0]=4 5464 B8R0.28 CN(C)CC#CC(O)=O Amb24471923 [0,0,0,0,0,2|2,0,0]=4 5465 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [0,0,0,0,0,2|2,0,0]=4 5466 B8R0.28 CN(C\C=C\C(=O)O)C Amb15695416 [0,0,0,0,0,2|2,0,0]=4 5467 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,0,0,0,0,2|1,0,0]=3 5468 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [0,0,0,0,0,2|1,0,0]=3 5469 B8R0.28 CS(=O)NOCC(O)=O Amb24588744 [0,0,0,0,0,2|1,0,0]=3 5470 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,0,0,0,0,2|1,0,1]=4 5471 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,0,0,0,0,2|1,0,1]=4 5472 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,0,0,0,0,2|1,0,1]=4 5473 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,0,0,0,0,2|0,0,2]=4 5474 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,0,0,0,0,2|1,0,1]=4 5475 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,0,0,0,0,2|0,0,2]=4 5476 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,0,0,0,0,2|0,0,2]=4 5477 B8R0.28 NC(=N)CCCC(O)=O Amb25757878 [0,0,0,0,0,2|2,0,0]=4 5478 B8R0.28 NC(=N)CNCC(O)=O Amb25062019 [0,0,0,0,0,2|2,0,0]=4 5479 B8R0.28 NC(=O)CCCC(N)=O Amb24098550 [0,0,0,0,0,2|2,0,0]=4 5480 B8R0.28 NC(=O)CCOP(O)=O Amb24668254 [0,0,0,0,0,2|2,0,0]=4 5481 B8R0.28 NC(=O)CSCC(=O)Cl Amb25288065 [0,0,0,0,0,2|2,0,0]=4 5482 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,2|1,0,0]=3 5483 B8R0.28 NC(=O)NCNC(N)=O Amb24105508 [0,0,0,0,0,2|2,0,0]=4 5484 B8R0.28 NC(=O)NN=CC(O)=O Amb24616453 [0,0,0,0,0,2|1,0,1]=4 5485 B8R0.28 NC(=O)N\N=C\C(=O)O Amb10552378 [0,0,0,0,0,2|1,0,1]=4 5486 B8R0.28 NC(=O)\C=C\CC(N)=O Amb24721870 [0,0,0,0,0,2|2,0,0]=4 5487 B8R0.28 O=C(Cl)CNCC(=O)Cl Amb25360798 [0,0,0,0,0,2|2,0,0]=4 5488 B8R0.28 O=C(Cl)COCC(=O)Cl Amb22228240 [0,0,0,0,0,2|2,0,0]=4 5489 B8R0.28 OC(=O)C#CCC(O)=O Amb25850643 [0,0,0,0,0,2|1,0,0]=3 5490 B8R0.28 OC(=O)C=C=CC(=O)O Amb17593335 [0,0,0,0,0,2|1,0,1]=4 5491 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [0,0,0,0,0,2|1,0,0]=3 5492 B8R0.28 OC(=O)CCC=C(F)F Amb25224993 [0,0,0,0,0,2|2,0,0]=4 5493 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [0,0,0,0,0,2|1,0,0]=3 5494 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [0,0,0,0,0,2|1,0,0]=3 5495 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [0,0,0,0,0,2|1,0,0]=3 5496 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [0,0,0,0,0,2|2,0,0]=4 5497 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [0,0,0,0,0,2|0,0,0]=2 5498 B8R0.28 OC(=O)CCNC(S)=S Amb25765722 [0,0,0,0,0,2|1,1,0]=4 5499 B8R0.28 OC(=O)CCSC(=N)N Amb1043190 [0,0,0,0,0,2|2,0,0]=4 5500 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [0,0,0,0,0,2|0,0,0]=2 5501 B8R0.28 OC(=O)CNC=P(O)=O Amb24558051 [0,0,0,0,0,2|2,0,0]=4 5502 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [0,0,0,0,0,2|2,0,0]=4 5503 B8R0.28 OC(=O)COCC(=O)Cl Amb25372456 [0,0,0,0,0,2|1,0,0]=3 5504 B8R0.28 OC(=O)CSC=C(Cl)Cl Amb24479937 [0,0,0,0,0,2|2,0,0]=4 5505 B8R0.28 OC(=O)C\C=C\C(=O)O Amb1154189 [0,0,0,0,0,2|1,0,0]=3 5506 B8R0.28 OC(=O)O[Sr]OC(O)=O Amb22353408 [0,0,0,0,0,2|2,0,0]=4 5507 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [0,0,0,0,0,2|1,0,1]=4 5508 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [0,0,0,0,0,2|1,0,0]=3 5509 B8R0.28 [O-]C(=O)CCCC([O-])=O Amb22729768 [0,0,0,0,0,2|1,0,1]=4 5510 B8R0.28 [O-]C(=O)CNCC([O-])=O Amb20246814 [0,0,0,0,0,2|1,0,1]=4 5511 B8R0.28 [O-]C(=O)CNCC([O-])=O Amb22351624 [0,0,0,0,0,2|1,0,1]=4 5512 B8R0.28 [O-][N+](=O)CCCC(O)=O Amb24711043 [0,0,0,0,0,2|2,0,0]=4 5513 B8R0.28 [O-][N+](=O)OCCC(O)=O Amb21953424 [0,0,0,0,0,2|2,0,0]=4