0 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,0,0,0,0,0|1,0,2]=3 1 B7R0.6 C=C(Br)COC(C)C Amb27197438 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.6 C=C(Br)\C=C\C(=O)O Amb26530913 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.6 C=C(C)C#CC(C)=O Amb28316172 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.6 C=C(C)CCB(O)O Amb28316164 [0,0,0,0,0,0|1,0,3]=4 5 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,0,0,0,0,0|0,0,2]=2 6 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,0,0,0,0,0|1,0,3]=4 8 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.6 C=C(C)CCN(C)C Amb28187650 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,0,0,0,0,0|1,0,3]=4 11 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,0,0,0,0,0|1,0,3]=4 12 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [0,0,0,0,0,0|1,0,3]=4 13 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.6 C=C(C)CNC(O)=S Amb28240718 [0,0,0,0,0,0|1,1,2]=4 15 B7R0.6 C=C(C)COC(C)=O Amb16187121 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.6 C=C(C)COC(N)=O Amb4017509 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,0,0,0,0,0|1,0,1]=2 18 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.6 C=C(C)\C=C/C(C)=O Amb28061353 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.6 C=C(C)\C=C\B(O)O Amb25348319 [0,0,0,0,0,0|1,0,3]=4 21 B7R0.6 C=C(C)\C=C\C(=C)C Amb27229870 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,0|0,0,2]=2 23 B7R0.6 C=C(C)\C=C\C(C)=O Amb33172526 [0,0,0,0,0,0|1,0,2]=3 24 B7R0.6 C=C(C)\C=C\[N+](=O)[O-] Amb33199530 [0,0,0,0,0,0|1,0,3]=4 25 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,0,0,0,0,0|1,0,2]=3 26 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.6 C=C(Cl)COC(C)=O Amb24744447 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.6 C=C(Cl)CSC(C)=O Amb21960981 [0,0,0,0,0,0|4,0,0]=4 29 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,0,0,0,0,0|1,0,2]=3 30 B7R0.6 C=C(N)\C=C\C(=C)O Amb27976241 [0,0,0,0,0,0|2,0,2]=4 31 B7R0.6 C=C(O)\C=C\C(=O)O Amb26391061 [0,0,0,0,0,0|1,0,2]=3 32 B7R0.6 C=C(O)\C=N\N(C)C Amb27209036 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [0,0,0,0,0,0|3,0,0]=3 34 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,0,0,0,0,0|1,0,0]=1 35 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,0,0,0,0,0|1,0,1]=2 37 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,0,0,0,0,0|2,1,1]=4 38 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,0,0,0,0,0|2,0,1]=3 39 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,0,0,0,0,0|2,0,1]=3 40 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,0,0,0,0,0|2,0,2]=4 41 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,0,0,0,0,0|1,0,2]=3 42 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,0,0,0,0,0|2,0,2]=4 43 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,0,0,0,0,0|2,0,1]=3 44 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,0,0,0,0,0|1,1,1]=3 45 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,0,0,0,0,0|2,0,1]=3 46 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,0,0,0,0,0|2,0,1]=3 47 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,0,0,0,0,0|2,0,2]=4 48 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,0,0,0,0,0|2,0,2]=4 49 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [0,0,0,0,0,0|3,0,0]=3 50 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,0,0,0,0,0|2,0,1]=3 51 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,0,0,0,0,0|2,0,1]=3 52 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.6 CC(=O)COC(C)=O Amb8517567 [0,0,0,0,0,0|3,0,0]=3 54 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,0,0,0,0,0|2,0,1]=3 55 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,0,0,0,0,0|2,0,1]=3 56 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,0,0,0,0,0|2,0,0]=2 57 B7R0.6 CC(=O)NC=C(Cl)Cl Amb2793550 [0,0,0,0,0,0|4,0,0]=4 58 B7R0.6 CC(=O)NCB(O)O Amb8392097 [0,0,0,0,0,0|3,0,1]=4 59 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|2,0,0]=2 60 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,0,0,0,0,0|2,0,2]=4 61 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,0,0,0,0,0|3,0,1]=4 62 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,0,0,0,0,0|3,0,0]=3 63 B7R0.6 CC(=O)NCC(N)=S Amb17231879 [0,0,0,0,0,0|3,1,0]=4 64 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,0,0,0,0,0|3,0,1]=4 65 B7R0.6 CC(=O)NN=C(C)C Amb1047247 [0,0,0,0,0,0|3,0,0]=3 66 B7R0.6 CC(=O)NNC(C)=O Amb8516143 [0,0,0,0,0,0|4,0,0]=4 67 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,0,0,0,0,0|3,0,1]=4 68 B7R0.6 CC(=O)N\N=C(/C)N Amb26548898 [0,0,0,0,0,0|4,0,0]=4 69 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|2,0,0]=2 71 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,0,0,0,0,0|3,0,1]=4 72 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,0|3,0,0]=3 73 B7R0.6 CC(=O)OCC(N)=S Amb9677330 [0,0,0,0,0,0|3,1,0]=4 74 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,0,0,0,0,0|3,0,1]=4 75 B7R0.6 CC(=O)ON=C(C)C Amb2781649 [0,0,0,0,0,0|3,0,0]=3 76 B7R0.6 CC(=O)ONC(N)=O Amb28456585 [0,0,0,0,0,0|4,0,0]=4 77 B7R0.6 CC(=O)O\N=C(/C)N Amb28145058 [0,0,0,0,0,0|4,0,0]=4 78 B7R0.6 CC(=O)SCB(O)O Amb27456620 [0,0,0,0,0,0|3,0,1]=4 79 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,0|3,0,0]=3 80 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,0,0,0,0,0|3,0,1]=4 81 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,0|3,0,0]=3 82 B7R0.6 CC(=O)SSC(C)=O Amb24099405 [0,0,0,0,0,0|4,0,0]=4 83 B7R0.6 CC(=O)\C=C/C(O)O Amb27834325 [0,0,0,0,0,0|1,0,3]=4 84 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,0,0,0,0,0|1,0,1]=2 85 B7R0.6 CC(=O)\C=C\C(C)=O Amb22346013 [0,0,0,0,0,0|2,0,1]=3 86 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [0,0,0,0,0,0|1,0,2]=3 87 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [0,0,0,0,0,0|2,0,2]=4 88 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,0,0,0,0,0|2,0,1]=3 89 B7R0.6 CC(=O)\C=C\N(C)C Amb4019563 [0,0,0,0,0,0|2,0,1]=3 90 B7R0.6 CC(=O)\C=N\N(C)C Amb28316186 [0,0,0,0,0,0|3,0,1]=4 91 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [0,0,0,0,0,0|2,0,1]=3 92 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,0,0,0,0,0|3,0,1]=4 93 B7R0.6 CC(=O)\N=C\N(C)C Amb27950201 [0,0,0,0,0,0|3,0,0]=3 94 B7R0.6 CC(=S)NC=C(C)C Amb28397267 [0,0,0,0,0,0|2,1,0]=3 95 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,0,0,0,0,0|2,0,0]=2 96 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,0,0,0,0,0|2,0,0]=2 97 B7R0.6 CC(=S)\N=C\N(C)C Amb28134087 [0,0,0,0,0,0|3,1,0]=4 98 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,0,0,0,0,0|1,0,2]=3 99 B7R0.6 CC(C)=C=CC(C)O Amb17593160 [0,0,0,0,0,0|1,0,3]=4 100 B7R0.6 CC(C)=CC=C(C)C Amb2721453 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.6 CC(C)=CC=C(Cl)Cl Amb20620965 [0,0,0,0,0,0|2,0,1]=3 102 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,0,0,0,0,0|0,0,0]=0 103 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,0,0,0,0,0|0,0,1]=1 104 B7R0.6 CC(C)=CCC(C)C Amb22731329 [0,0,0,0,0,0|2,0,1]=3 105 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [0,0,0,0,0,0|2,0,1]=3 106 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,0,0,0,0,0|2,0,1]=3 107 B7R0.6 CC(C)=CCN(C)C Amb27837555 [0,0,0,0,0,0|3,0,0]=3 108 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,0,0,0,0,0|1,0,1]=2 109 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.6 CC(C)=NN=C(C)C Amb22338208 [0,0,0,0,0,0|4,0,0]=4 111 B7R0.6 CC(C)=NN=C(N)N Amb3428945 [0,0,0,0,0,0|4,0,0]=4 112 B7R0.6 CC(C)=NNC(=N)N Amb22261438 [0,0,0,0,0,0|4,0,0]=4 113 B7R0.6 CC(C)=NNC(N)=O Amb6366342 [0,0,0,0,0,0|3,0,0]=3 114 B7R0.6 CC(C)=NNC(N)=S Amb4034613 [0,0,0,0,0,0|3,1,0]=4 115 B7R0.6 CC(C)=N\N=C(/C)N Amb27259705 [0,0,0,0,0,0|4,0,0]=4 116 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,0,0,0,0,0|0,0,3]=3 117 B7R0.6 CC(C)CCB(O)O Amb13890540 [0,0,0,0,0,0|1,0,3]=4 118 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,0,0,0,0,0|2,0,2]=4 119 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,0,0,0,0,0|2,0,2]=4 120 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,0,0,0,0,0|1,0,2]=3 121 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,0,0,0,0,0|0,0,2]=2 122 B7R0.6 CC(C)CCC(C)O Amb9748244 [0,0,0,0,0,0|1,0,3]=4 123 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,0,0,0,0,0|1,0,2]=3 124 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,0,0,0,0,0|1,1,2]=4 125 B7R0.6 CC(C)CCN(C)O Amb33361677 [0,0,0,0,0,0|2,0,2]=4 126 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,0,0,0,0,0|2,0,2]=4 127 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,0,0,0,0,0|1,0,3]=4 128 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,0,0,0,0,0|2,0,2]=4 129 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [0,0,0,0,0,0|1,0,3]=4 130 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [0,0,0,0,0,0|1,0,3]=4 131 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,0,0,0,0,0|1,0,3]=4 132 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,0,0,0,0,0|2,0,2]=4 133 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,0,0,0,0,0|2,0,2]=4 134 B7R0.6 CC(C)CNC(O)=S Amb27597328 [0,0,0,0,0,0|1,1,2]=4 135 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,0,0,0,0,0|2,0,2]=4 136 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,0,0,0,0,0|2,0,2]=4 137 B7R0.6 CC(C)CON(=O)O Amb33780821 [0,0,0,0,0,0|2,0,2]=4 138 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [0,0,0,0,0,0|2,0,2]=4 139 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,0|2,0,2]=4 140 B7R0.6 CC(C)NCC(=N)N Amb27186805 [0,0,0,0,0,0|3,0,1]=4 141 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,0,0,0,0,0|2,0,1]=3 142 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,0,0,0,0,0|1,0,1]=2 143 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,0,0,0,0,0|1,0,1]=2 144 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,0,0,0,0,0|2,0,1]=3 145 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,0,0,0,0,0|2,0,1]=3 146 B7R0.6 CC(C)NCC(N)=S Amb17231884 [0,0,0,0,0,0|2,1,1]=4 147 B7R0.6 CC(C)NC[C@@H](C)O Amb27641886 [0,0,0,0,0,0|2,0,2]=4 148 B7R0.6 CC(C)NNC(N)=O Amb27409411 [0,0,0,0,0,0|3,0,1]=4 149 B7R0.6 CC(C)OCB(O)O Amb28058696 [0,0,0,0,0,0|2,0,2]=4 150 B7R0.6 CC(C)OCC(=N)N Amb33551035 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.6 CC(C)OCC(=N)N Amb6268584 [0,0,0,0,0,0|3,0,1]=4 152 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,0,0,0,0,0|2,0,1]=3 153 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,0,0,0,0,0|1,0,1]=2 154 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,0,0,0,0,0|2,0,1]=3 155 B7R0.6 CC(C)OCC(N)=S Amb6267503 [0,0,0,0,0,0|2,1,1]=4 156 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,0,0,0,0,0|2,0,2]=4 157 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,0,0,0,0,0|2,0,2]=4 158 B7R0.6 CC(C)ONC(N)=O Amb2899784 [0,0,0,0,0,0|3,0,1]=4 159 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,0,0,0,0,0|1,0,1]=2 160 B7R0.6 CC(C)\C=C\B(O)O Amb27149192 [0,0,0,0,0,0|1,0,3]=4 161 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,0,0,0,0,0|1,0,2]=3 162 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,0,0,0,0,0|0,0,2]=2 163 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,0,0,0,0,0|1,0,3]=4 164 B7R0.6 CC(C)\C=C\[C@H](C)O Amb28189174 [0,0,0,0,0,0|1,0,3]=4 165 B7R0.6 CC(C)\C=C\[N+](=O)[O-] Amb32644472 [0,0,0,0,0,0|1,0,3]=4 166 B7R0.6 CC(C)\C=N\S(C)=O Amb35681708 [0,0,0,0,0,0|3,0,1]=4 167 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [0,0,0,0,0,0|2,0,2]=4 168 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,0,0,0,0,0|1,0,3]=4 169 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,0|2,0,2]=4 170 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,0,0,0,0,0|2,0,2]=4 171 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,0,0,0,0,0|1,0,2]=3 172 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,0,0,0,0,0|1,0,3]=4 173 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,0,0,0,0,0|1,0,2]=3 174 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,0,0,0,0,0|1,0,2]=3 175 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,0,0,0,0,0|2,0,2]=4 176 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,0,0,0,0,0|2,0,2]=4 177 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,0,0,0,0,0|2,0,1]=3 178 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,0,0,0,0,0|1,0,2]=3 179 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,0,0,0,0,0|1,0,3]=4 180 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,0,0,0,0,0|1,0,2]=3 181 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,0,0,0,0,0|1,0,3]=4 182 B7R0.6 CC(O)CCN(C)C Amb26489582 [0,0,0,0,0,0|2,0,2]=4 183 B7R0.6 CC(O)CNC(C)C Amb9247472 [0,0,0,0,0,0|2,0,2]=4 184 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,0,0,0,0,0|1,0,2]=3 185 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,0,0,0,0,0|2,0,2]=4 186 B7R0.6 CN(C)CCB(O)O Amb27787216 [0,0,0,0,0,0|2,0,2]=4 187 B7R0.6 CN(C)CCC(=N)N Amb2695941 [0,0,0,0,0,0|3,0,1]=4 188 B7R0.6 CN(C)CCC(=N)N Amb33551563 [0,0,0,0,0,0|3,0,1]=4 189 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,0,0,0,0,0|2,0,1]=3 190 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,0,0,0,0,0|2,0,1]=3 191 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,0,0,0,0,0|1,0,1]=2 192 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,0,0,0,0,0|1,0,1]=2 193 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,0,0,0,0,0|2,0,1]=3 194 B7R0.6 CN(C)CCC(N)=S Amb6268885 [0,0,0,0,0,0|2,1,1]=4 195 B7R0.6 CN(C)CCC(N)=S Amb6893069 [0,0,0,0,0,0|2,1,1]=4 196 B7R0.6 CN(C)CCS(=O)[O-] Amb32754654 [0,0,0,0,0,0|2,0,2]=4 197 B7R0.6 CN(C)CCS(C)=O Amb27811384 [0,0,0,0,0,0|3,0,1]=4 198 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,0,0,0,0,0|2,0,0]=2 199 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,0,0,0,0,0|3,0,0]=3 200 B7R0.6 CN(C)\C=C/[N+](=O)[O-] Amb27490064 [0,0,0,0,0,0|2,0,2]=4 201 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,0,0,0,0,0|1,0,1]=2 202 B7R0.6 CN(C)\C=C\C(N)=S Amb17477842 [0,0,0,0,0,0|2,1,1]=4 203 B7R0.6 CN(C)\C=C\[N+](=O)[O-] Amb33950083 [0,0,0,0,0,0|2,0,2]=4 204 B7R0.6 CN(C)\C=N\C(N)=S Amb2439499 [0,0,0,0,0,0|3,1,0]=4 205 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,0,0,0,0,0|2,0,1]=3 206 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,0,0,0,0,0|2,0,1]=3 208 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,0,0,0,0,0|2,0,1]=3 209 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,0,0,0,0,0|3,0,0]=3 210 B7R0.6 CS(=O)\C=C/C(N)=O Amb27815054 [0,0,0,0,0,0|3,0,1]=4 211 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,0,0,0,0,0|2,0,1]=3 212 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,0,0,0,0,0|1,0,2]=3 213 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,0,0,0,0,0|1,0,2]=3 214 B7R0.6 C[C@@H](O)CCN(C)C Amb33272289 [0,0,0,0,0,0|2,0,2]=4 215 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,0,0,0,0,0|1,0,3]=4 216 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,0,0,0,0,0|1,0,2]=3 217 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,0,0,0,0,0|1,0,2]=3 218 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,0,0,0,0,0|1,0,2]=3 219 B7R0.6 C[C@H](O)CCN(C)C Amb33272277 [0,0,0,0,0,0|2,0,2]=4 220 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,0,0,0,0,0|1,0,2]=3 221 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,0,0,0,0,0|1,0,1]=2 222 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,0,0,0,0,0|1,0,2]=3 223 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,0,0,0,0,0|2,0,0]=2 224 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,0,0,0,0,0|1,0,0]=1 225 B7R0.6 C\C(Cl)=N\OC(N)=O Amb27409950 [0,0,0,0,0,0|4,0,0]=4 226 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [0,0,0,0,0,0|3,0,1]=4 227 B7R0.6 C\C(O)=N\NC(N)=O Amb17777869 [0,0,0,0,0,0|4,0,0]=4 228 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,0,0,0,0,0|3,0,1]=4 229 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [0,0,0,0,0,0|3,0,0]=3 230 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [0,0,0,0,0,0|3,0,0]=3 231 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [0,0,0,0,0,0|3,0,0]=3 232 B7R0.6 N=C(N)SCC(N)=O Amb22261500 [0,0,0,0,0,0|4,0,0]=4 233 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,0,0,0,0,0|3,0,1]=4 234 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,0,0,0,0,0|2,0,1]=3 235 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,0,0,0,0,0|3,0,1]=4 236 B7R0.6 NC(=O)CNC(N)=S Amb9212104 [0,0,0,0,0,0|4,0,0]=4 237 B7R0.6 NC(=O)CSC(N)=S Amb27642551 [0,0,0,0,0,0|4,0,0]=4 238 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [0,0,0,0,0,0|3,0,0]=3 239 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [0,0,0,0,0,0|2,0,1]=3 240 B7R0.6 NC(=O)\C=C/C(N)=O Amb4292114 [0,0,0,0,0,0|3,0,1]=4 241 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [0,0,0,0,0,0|2,0,1]=3 242 B7R0.6 NC(=O)\C=C\C(N)=O Amb6334811 [0,0,0,0,0,0|3,0,1]=4 243 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [0,0,0,0,0,0|3,0,1]=4 244 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [0,0,0,0,0,0|3,0,0]=3 246 B7R0.6 NC(=[NH2+])NCC(=O)[O-] Amb4244207 [0,0,0,0,0,0|3,0,1]=4 247 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,0,0,0,0,0|3,0,1]=4 248 B7R0.6 O=C(Cl)\C=C\C(=O)Cl Amb8513635 [0,0,0,0,0,0|3,0,1]=4 249 B7R0.6 O=C(O)C#CC(=O)O Amb6297768 [0,0,0,0,0,0|2,0,2]=4 250 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,0|2,0,0]=2 251 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,0,0,0,0,0|2,0,1]=3 253 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,0,0,0,0,0|2,0,1]=3 254 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,0|2,0,2]=4 255 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,0,0,0,0,0|2,0,2]=4 256 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,0,0,0,0,0|3,0,1]=4 257 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,0,0,0,0,0|3,0,1]=4 258 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,0,0,0,0,0|3,0,1]=4 259 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,0,0,0,0,0|3,0,1]=4 260 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,0,0,0,0,0|3,0,1]=4 261 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [0,0,0,0,0,0|3,0,0]=3 262 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [0,0,0,0,0,0|4,0,0]=4 263 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [0,0,0,0,0,0|3,0,0]=3 264 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,0,0,0,0,0|3,0,1]=4 265 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,0,0,0,0,0|3,0,1]=4 266 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [0,0,0,0,0,0|2,0,1]=3 267 B7R0.6 O=C(O)\C=C\B(O)O Amb27864214 [0,0,0,0,0,0|3,0,1]=4 268 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [0,0,0,0,0,0|2,0,1]=3 269 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [0,0,0,0,0,0|2,0,1]=3 270 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [0,0,0,0,0,0|2,0,1]=3 271 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [0,0,0,0,0,0|2,0,1]=3 272 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,0,0,0,0,0|2,0,2]=4 273 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,0,0,0,0,0|2,0,2]=4 274 B7R0.6 O=C(O)\C=C\[N+](=O)[O-] Amb25736416 [0,0,0,0,0,0|3,0,1]=4 275 B7R0.6 O=C([O-])C#CC(=O)O Amb19748298 [0,0,0,0,0,0|2,0,2]=4 276 B7R0.6 O=C([O-])C#CC(=O)O Amb2721628 [0,0,0,0,0,0|2,0,2]=4 277 B7R0.6 O=C([O-])C#CC(=O)O Amb33620293 [0,0,0,0,0,0|2,0,2]=4 278 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,0,0,0,0,0|2,0,2]=4 279 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,0,0,0,0,0|2,0,2]=4 280 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [0,0,0,0,0,0|2,0,1]=3 281 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [0,0,0,0,0,0|2,0,1]=3 282 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb20246799 [0,0,0,0,0,0|2,0,2]=4 283 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22002520 [0,0,0,0,0,0|2,0,2]=4 284 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22043369 [0,0,0,0,0,0|2,0,2]=4 285 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [0,0,0,0,0,0|3,0,0]=3 286 B6R0.4 C#CCCC(=O)O Amb33532622 [1,0,0,0,0,0|0,0,3]=4 287 B6R0.4 C#CC\C=C(/C)N Amb27390641 [1,0,0,0,0,0|2,0,1]=4 288 B6R0.4 C#CC\C=C(\C)N Amb27246252 [1,0,0,0,0,0|2,0,1]=4 289 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [1,0,0,0,0,0|0,0,3]=4 290 B6R0.4 C=C(C)C#CC=O Amb28050124 [1,0,0,0,0,0|0,0,3]=4 291 B6R0.4 C=C(C)CCCO Amb22886814 [1,0,0,0,0,0|0,0,3]=4 292 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [1,0,0,0,0,0|0,0,2]=3 293 B6R0.4 C=C(C)\C=C\CO Amb33473880 [1,0,0,0,0,0|0,0,3]=4 294 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,0,0,0,0,0|0,0,2]=3 295 B6R0.4 C=CCCC(=C)C Amb22228883 [1,0,0,0,0,0|1,0,2]=4 296 B6R0.4 C=CCCC(=O)Cl Amb3939003 [1,0,0,0,0,0|1,0,2]=4 297 B6R0.4 C=CCCC(=O)O Amb3940112 [1,0,0,0,0,0|0,0,2]=3 298 B6R0.4 C=CCCC(C)=O Amb2721704 [1,0,0,0,0,0|1,0,2]=4 299 B6R0.4 C=CCCC(N)=O Amb28136349 [1,0,0,0,0,0|1,0,2]=4 300 B6R0.4 C=CCCN(C)C Amb27838193 [1,0,0,0,0,0|2,0,1]=4 301 B6R0.4 C=CCNC(C)=N Amb24618156 [1,0,0,0,0,0|3,0,0]=4 302 B6R0.4 C=CCNC(C)=O Amb5797445 [1,0,0,0,0,0|3,0,0]=4 303 B6R0.4 C=CCNC(C)C Amb10609485 [1,0,0,0,0,0|2,0,1]=4 304 B6R0.4 C=CCNC(C)C Amb6683889 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.4 C=CCNC(C)C Amb8428139 [1,0,0,0,0,0|2,0,1]=4 306 B6R0.4 C=CNCC(=O)O Amb28346027 [1,0,0,0,0,0|1,0,1]=3 307 B6R0.4 C=COCC(=O)O Amb27247261 [1,0,0,0,0,0|1,0,1]=3 308 B6R0.4 C=COCC(C)=O Amb27838258 [1,0,0,0,0,0|2,0,1]=4 309 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [1,0,0,0,0,0|1,0,2]=4 310 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [1,0,0,0,0,0|1,0,2]=4 311 B6R0.4 C=C\C=C\C(C)C Amb27185806 [1,0,0,0,0,0|1,0,2]=4 312 B6R0.4 CC#CCC(=O)O Amb17939740 [1,0,0,0,0,0|0,0,2]=3 313 B6R0.4 CC#CCC(C)=O Amb27648528 [1,0,0,0,0,0|1,0,2]=4 314 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,1]=3 315 B6R0.4 CC(=O)CCCO Amb3940340 [1,0,0,0,0,0|1,0,2]=4 316 B6R0.4 CC(=O)C\C=N\O Amb27750272 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,0]=3 318 B6R0.4 CC(=O)NCCO Amb2720909 [1,0,0,0,0,0|2,0,1]=4 319 B6R0.4 CC(=O)N\C=C/S Amb27246451 [1,0,0,0,0,0|3,0,0]=4 320 B6R0.4 CC(=O)N\C=C\Cl Amb28132682 [1,0,0,0,0,0|3,0,0]=4 321 B6R0.4 CC(=O)OCCO Amb3941004 [1,0,0,0,0,0|2,0,1]=4 322 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [1,0,0,0,0,0|3,0,0]=4 323 B6R0.4 CC(=O)SCC=O Amb27873378 [1,0,0,0,0,0|2,0,0]=3 324 B6R0.4 CC(=O)SCCO Amb27481182 [1,0,0,0,0,0|2,0,1]=4 325 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [1,0,0,0,0,0|1,0,1]=3 326 B6R0.4 CC(=S)SCCO Amb28350218 [1,0,0,0,0,0|2,0,1]=4 327 B6R0.4 CC(C)=C=CCO Amb17593073 [1,0,0,0,0,0|0,0,3]=4 328 B6R0.4 CC(C)=CCC#N Amb2778547 [1,0,0,0,0,0|1,0,1]=3 329 B6R0.4 CC(C)=CCC=O Amb18120881 [1,0,0,0,0,0|0,0,0]=1 330 B6R0.4 CC(C)=CCCBr Amb3941652 [1,0,0,0,0,0|1,0,1]=3 331 B6R0.4 CC(C)=CCCCl Amb27865707 [1,0,0,0,0,0|1,0,1]=3 332 B6R0.4 CC(C)=CCCI Amb22395000 [1,0,0,0,0,0|1,0,1]=3 333 B6R0.4 CC(C)=CCCN Amb18962494 [1,0,0,0,0,0|1,0,1]=3 334 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|0,0,1]=2 335 B6R0.4 CC(C)=CCCS Amb35588788 [1,0,0,0,0,0|0,1,1]=3 336 B6R0.4 CC(C)=CCON Amb18560217 [1,0,0,0,0,0|2,0,0]=3 337 B6R0.4 CC(C)=CCON Amb29848095 [1,0,0,0,0,0|2,0,0]=3 338 B6R0.4 CC(C)=CN=C=O Amb25288328 [1,0,0,0,0,0|1,0,1]=3 339 B6R0.4 CC(C)=CN=[N+]=[N-] Amb27425118 [1,0,0,0,0,0|3,0,0]=4 340 B6R0.4 CC(C)=CNC=O Amb27973472 [1,0,0,0,0,0|1,0,0]=2 341 B6R0.4 CC(C)=CNC=S Amb27422992 [1,0,0,0,0,0|1,1,0]=3 342 B6R0.4 CC(C)=C\C=C\Br Amb28244792 [1,0,0,0,0,0|1,0,1]=3 343 B6R0.4 CC(C)=C\C=C\Cl Amb27760419 [1,0,0,0,0,0|1,0,1]=3 344 B6R0.4 CC(C)=NCCO Amb27612560 [1,0,0,0,0,0|1,0,1]=3 345 B6R0.4 CC(C)=NNC=O Amb2419224 [1,0,0,0,0,0|2,0,0]=3 346 B6R0.4 CC(C)CCC=O Amb17673735 [1,0,0,0,0,0|0,0,2]=3 347 B6R0.4 CC(C)CCCO Amb3939329 [1,0,0,0,0,0|0,0,3]=4 348 B6R0.4 CC(C)CCNO Amb27439608 [1,0,0,0,0,0|1,0,2]=4 349 B6R0.4 CC(C)COC=O Amb8513682 [1,0,0,0,0,0|1,0,2]=4 350 B6R0.4 CC(C)NCCO Amb3939914 [1,0,0,0,0,0|1,0,2]=4 351 B6R0.4 CC(C)OCC=O Amb25820659 [1,0,0,0,0,0|1,0,1]=3 352 B6R0.4 CC(C)OCCO Amb3939032 [1,0,0,0,0,0|1,0,2]=4 353 B6R0.4 CC(C)SCC=O Amb24479811 [1,0,0,0,0,0|1,0,1]=3 354 B6R0.4 CC(C)SCCO Amb3939476 [1,0,0,0,0,0|1,0,2]=4 355 B6R0.4 CC(C)\C=C\C=O Amb8515214 [1,0,0,0,0,0|0,0,2]=3 356 B6R0.4 CC(C)\C=C\CO Amb25802048 [1,0,0,0,0,0|0,0,3]=4 357 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,0,0,0,0,0|1,0,2]=4 358 B6R0.4 CC(O)CCC=O Amb17593090 [1,0,0,0,0,0|1,0,2]=4 359 B6R0.4 CC(O)C\C=C\Br Amb27216240 [1,0,0,0,0,0|2,0,1]=4 360 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [1,0,0,0,0,0|2,0,1]=4 361 B6R0.4 CC(O)\C=C\C=O Amb18639615 [1,0,0,0,0,0|1,0,2]=4 362 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|0,0,2]=3 363 B6R0.4 CC=C=C[PH](=O)O Amb27430355 [1,0,0,0,0,0|1,0,2]=4 364 B6R0.4 CCC#CC(=O)O Amb6336503 [1,0,0,0,0,0|0,0,3]=4 365 B6R0.4 CCCC=C(C)C Amb4035860 [1,0,0,0,0,0|1,0,1]=3 366 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,0,0,0,0,0|1,0,2]=4 367 B6R0.4 CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|0,0,2]=3 368 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,0,0,0,0,0|0,0,3]=4 369 B6R0.4 CCCCC(C)=O Amb6608652 [1,0,0,0,0,0|1,0,2]=4 370 B6R0.4 CCCCC(N)=O Amb6891958 [1,0,0,0,0,0|1,0,2]=4 371 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,0,0,0,0,0|1,0,2]=4 372 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,0,0,0,0,0|2,0,1]=4 373 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|1,0,1]=3 374 B6R0.4 CCNCC(=O)O Amb7764661 [1,0,0,0,0,0|1,0,1]=3 375 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|2,0,1]=4 376 B6R0.4 CCNCC(C)=O Amb32661185 [1,0,0,0,0,0|2,0,1]=4 377 B6R0.4 CCNCC(N)=O Amb1128676 [1,0,0,0,0,0|2,0,1]=4 378 B6R0.4 CCNCC(N)=O Amb4035424 [1,0,0,0,0,0|2,0,1]=4 379 B6R0.4 CCOC=C(C)C Amb27667358 [1,0,0,0,0,0|2,0,1]=4 380 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,0,0,0,0,0|2,0,1]=4 381 B6R0.4 CCOCC(=O)O Amb3939880 [1,0,0,0,0,0|1,0,1]=3 382 B6R0.4 CCOCC(=O)S Amb27813482 [1,0,0,0,0,0|1,1,1]=4 383 B6R0.4 CCOCC(C)=O Amb9666086 [1,0,0,0,0,0|2,0,1]=4 384 B6R0.4 CCPCC(=O)O Amb28321137 [1,0,0,0,0,0|1,0,1]=3 385 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,1]=3 386 B6R0.4 CCSCC(C)=O Amb4018179 [1,0,0,0,0,0|2,0,1]=4 387 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,0,0,0,0,0|0,0,2]=3 388 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,0,0,0,0,0|1,0,2]=4 389 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [1,0,0,0,0,0|1,0,2]=4 390 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,0,0,0,0,0|0,0,2]=3 391 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,0,0,0,0,0|1,0,2]=4 392 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 393 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,0,0,0,0,0|1,0,2]=4 394 B6R0.4 CN(C)C#CC=O Amb27424954 [1,0,0,0,0,0|1,0,2]=4 395 B6R0.4 CN(C)CCC=O Amb22001057 [1,0,0,0,0,0|1,0,1]=3 396 B6R0.4 CN(C)CCCO Amb3939321 [1,0,0,0,0,0|1,0,2]=4 397 B6R0.4 CN(C)CNC=O Amb27216675 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.4 CN(C)\C=C\C=O Amb3940430 [1,0,0,0,0,0|1,0,1]=3 399 B6R0.4 CNCCC(=O)Cl Amb27422890 [1,0,0,0,0,0|2,0,1]=4 400 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|1,0,1]=3 401 B6R0.4 CNCCC(=O)O Amb7766400 [1,0,0,0,0,0|1,0,1]=3 402 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|2,0,1]=4 403 B6R0.4 CNCCC(C)=O Amb28827637 [1,0,0,0,0,0|2,0,1]=4 404 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,1]=4 405 B6R0.4 CNCCC(N)=O Amb33538309 [1,0,0,0,0,0|2,0,1]=4 406 B6R0.4 CN\C=C\C(C)=O Amb17593076 [1,0,0,0,0,0|2,0,1]=4 407 B6R0.4 COCCC(=O)Cl Amb2689274 [1,0,0,0,0,0|2,0,1]=4 408 B6R0.4 COCCC(=O)O Amb3938990 [1,0,0,0,0,0|1,0,1]=3 409 B6R0.4 COCCC(C)=O Amb7764907 [1,0,0,0,0,0|2,0,1]=4 410 B6R0.4 COCCC(N)=O Amb33538943 [1,0,0,0,0,0|2,0,1]=4 411 B6R0.4 CONCC(N)=O Amb28455463 [1,0,0,0,0,0|3,0,0]=4 412 B6R0.4 CO\C=C/C(C)=O Amb27264758 [1,0,0,0,0,0|2,0,1]=4 413 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [1,0,0,0,0,0|2,0,1]=4 414 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,0,0,0,0,0|1,0,1]=3 415 B6R0.4 CO\C=C\C(C)=O Amb8385700 [1,0,0,0,0,0|2,0,1]=4 416 B6R0.4 CO\C=C\C(N)=O Amb27153308 [1,0,0,0,0,0|2,0,1]=4 417 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.4 CSC#CC(=O)O Amb33309663 [1,0,0,0,0,0|1,0,2]=4 419 B6R0.4 CSCC=C(C)C Amb27594692 [1,0,0,0,0,0|2,0,0]=3 420 B6R0.4 CSCCC(=O)O Amb3939879 [1,0,0,0,0,0|1,0,1]=3 421 B6R0.4 CSCCC(C)=O Amb8392858 [1,0,0,0,0,0|2,0,1]=4 422 B6R0.4 CSSCC(=O)O Amb25378801 [1,0,0,0,0,0|2,0,0]=3 423 B6R0.4 CS\C=C/C(C)=O Amb27471812 [1,0,0,0,0,0|2,0,1]=4 424 B6R0.4 CS\C=C\C(=O)O Amb30584688 [1,0,0,0,0,0|1,0,1]=3 425 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [1,0,0,0,0,0|1,0,2]=4 426 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [1,0,0,0,0,0|1,0,2]=4 427 B6R0.4 C[C@H](O)CCC=O Amb27188424 [1,0,0,0,0,0|1,0,2]=4 428 B6R0.4 C[N+](C)=C\C=C\Cl Amb28121327 [1,0,0,0,0,0|2,0,1]=4 429 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [1,0,0,0,0,0|2,0,1]=4 430 B6R0.4 C\C(Br)=C\CCN Amb28060834 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.4 C\C(Cl)=C\CC#N Amb17593196 [1,0,0,0,0,0|2,0,1]=4 432 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [1,0,0,0,0,0|2,0,1]=4 433 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.4 C\C(Cl)=C\CNN Amb27232272 [1,0,0,0,0,0|3,0,0]=4 435 B6R0.4 C\C(N)=N\CCO Amb26857579 [1,0,0,0,0,0|2,0,1]=4 436 B6R0.4 C\C(N)=N\OC=O Amb27655517 [1,0,0,0,0,0|3,0,0]=4 437 B6R0.4 C\C=C/CB(O)O Amb27620496 [1,0,0,0,0,0|1,0,1]=3 438 B6R0.4 C\C=C/CC(C)C Amb27421132 [1,0,0,0,0,0|2,0,1]=4 439 B6R0.4 C\C=C/NC(C)=S Amb28282715 [1,0,0,0,0,0|2,1,0]=4 440 B6R0.4 C\C=C\CC(=N)N Amb25176208 [1,0,0,0,0,0|2,0,0]=3 441 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,0,0,0,0,0|0,0,0]=1 442 B6R0.4 C\C=C\CC(C)N Amb27843415 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,0,0,0,0,0|1,0,0]=2 444 B6R0.4 C\C=C\CS(=O)[O-] Amb26887775 [1,0,0,0,0,0|1,0,1]=3 445 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [1,0,0,0,0,0|1,0,1]=3 446 B6R0.4 C\C=C\NC(C)=S Amb27881690 [1,0,0,0,0,0|2,1,0]=4 447 B6R0.4 C\C=N\NC(N)=O Amb24351023 [1,0,0,0,0,0|3,0,0]=4 448 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,0,0,0,0,0|2,0,0]=3 449 B6R0.4 N#CCCC(=O)O Amb2694975 [1,0,0,0,0,0|1,0,2]=4 450 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [1,0,0,0,0,0|1,0,2]=4 451 B6R0.4 N=CNCC(=O)Cl Amb27216499 [1,0,0,0,0,0|3,0,0]=4 452 B6R0.4 N=CNCC(=O)O Amb24670244 [1,0,0,0,0,0|2,0,0]=3 453 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [1,0,0,0,0,0|2,0,0]=3 454 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|1,0,2]=4 455 B6R0.4 NC\C=C/C(=O)O Amb24117018 [1,0,0,0,0,0|1,0,2]=4 456 B6R0.4 NC\C=C\C(=O)O Amb33422010 [1,0,0,0,0,0|1,0,2]=4 457 B6R0.4 NC\C=C\C(=O)O Amb33422035 [1,0,0,0,0,0|1,0,2]=4 458 B6R0.4 NNCCC(=O)O Amb33756816 [1,0,0,0,0,0|2,0,1]=4 459 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|2,0,1]=4 460 B6R0.4 NOCCC(=O)O Amb32693437 [1,0,0,0,0,0|2,0,1]=4 461 B6R0.4 O=C(O)CCCBr Amb8393276 [1,0,0,0,0,0|1,0,2]=4 462 B6R0.4 O=C(O)CCCCl Amb3940333 [1,0,0,0,0,0|1,0,2]=4 463 B6R0.4 O=C(O)CCCF Amb17593104 [1,0,0,0,0,0|1,0,2]=4 464 B6R0.4 O=C(O)CCCI Amb22295911 [1,0,0,0,0,0|1,0,2]=4 465 B6R0.4 O=C(O)CCCO Amb18640332 [1,0,0,0,0,0|1,0,2]=4 466 B6R0.4 O=C(O)CCCS Amb16185429 [1,0,0,0,0,0|1,0,2]=4 467 B6R0.4 O=C(O)CCNO Amb28067767 [1,0,0,0,0,0|2,0,1]=4 468 B6R0.4 O=C(O)CCSCl Amb28387511 [1,0,0,0,0,0|2,0,1]=4 469 B6R0.4 O=C(O)COCF Amb33378705 [1,0,0,0,0,0|2,0,1]=4 470 B6R0.4 O=C(O)CPCO Amb28340565 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.4 O=C(O)CSSCl Amb27477882 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,0,0,0,0,0|1,0,0]=2 473 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|1,0,0]=2 474 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [1,0,0,0,0,0|1,0,2]=4 475 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [1,0,0,0,0,0|1,0,2]=4 476 B6R0.4 O=C(O)\C=C\CF Amb33470171 [1,0,0,0,0,0|1,0,2]=4 477 B6R0.4 O=C(O)\C=C\CO Amb32662006 [1,0,0,0,0,0|1,0,2]=4 478 B6R0.4 O=CCCC(=O)O Amb17673897 [1,0,0,0,0,0|1,0,1]=3 479 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.4 O=COCC(=O)O Amb26624011 [1,0,0,0,0,0|2,0,0]=3 481 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [1,0,0,0,0,0|1,0,1]=3 482 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [1,0,0,0,0,0|2,0,1]=4 483 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,0,0,0,0,0|3,0,0]=4 484 B8R0.9 BO\C(O)=C/CC(=O)O Amb27797365 [0,1,0,0,0,0|2,0,0]=3 485 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,1,0,0,0,0|0,0,3]=4 486 B8R0.9 C#CC(=O)CCN(C)C Amb28198080 [0,1,0,0,0,0|2,0,1]=4 487 B8R0.9 C#CC(=O)COC(C)C Amb28253401 [0,1,0,0,0,0|2,0,1]=4 488 B8R0.9 C#CC(=O)NCC(=O)O Amb6270091 [0,1,0,0,0,0|2,0,1]=4 489 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,1,0,0,0,0|1,0,2]=4 490 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,1,0,0,0,0|1,0,2]=4 491 B8R0.9 C#C[C@@H](O)CC=C(C)C Amb28049122 [0,1,0,0,0,0|1,0,1]=3 492 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,1,0,0,0,0|1,0,2]=4 493 B8R0.9 C=C(C)CNC(=O)CO Amb27866006 [0,1,0,0,0,0|1,0,2]=4 494 B8R0.9 C=C(C)CNC(=O)OC Amb27473324 [0,1,0,0,0,0|1,0,2]=4 495 B8R0.9 C=C(C)COC(=O)CO Amb28280952 [0,1,0,0,0,0|1,0,2]=4 496 B8R0.9 C=C(C)C\C=C(\C)CO Amb28049241 [0,1,0,0,0,0|2,0,0]=3 497 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,1,0,0,0,0|0,0,3]=4 498 B8R0.9 C=C(CC)OCC(C)=O Amb27227543 [0,1,0,0,0,0|2,0,1]=4 499 B8R0.9 C=C(CO)CC=C(C)C Amb27665270 [0,1,0,0,0,0|1,0,0]=2 500 B8R0.9 C=C(CO)CCN(C)C Amb28049092 [0,1,0,0,0,0|2,0,1]=4 501 B8R0.9 C=C(CS)SCC(C)=O Amb27844241 [0,1,0,0,0,0|2,0,1]=4 502 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,1,0,0,0,0|0,0,2]=3 503 B8R0.9 C=C(\C=C\C(C)=O)CC Amb26492679 [0,1,0,0,0,0|1,0,2]=4 504 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,1,0,0,0,0|0,0,3]=4 505 B8R0.9 C=CC(=O)CC=C(C)C Amb27838740 [0,1,0,0,0,0|1,0,0]=2 506 B8R0.9 C=CC(=O)CCC(C)C Amb25341966 [0,1,0,0,0,0|1,0,2]=4 507 B8R0.9 C=CC(=O)CCN(C)C Amb27838465 [0,1,0,0,0,0|2,0,1]=4 508 B8R0.9 C=CC(=O)COC(C)=O Amb17607380 [0,1,0,0,0,0|3,0,0]=4 509 B8R0.9 C=CC(=O)COC(C)C Amb24614526 [0,1,0,0,0,0|2,0,1]=4 510 B8R0.9 C=CC(=O)CSC(C)C Amb28313053 [0,1,0,0,0,0|2,0,1]=4 511 B8R0.9 C=CC(=O)NCC(=O)O Amb33532656 [0,1,0,0,0,0|2,0,1]=4 512 B8R0.9 C=CC(=O)OCC(=O)O Amb27241348 [0,1,0,0,0,0|2,0,1]=4 513 B8R0.9 C=CC(=O)SCC(=O)O Amb27755823 [0,1,0,0,0,0|2,0,1]=4 514 B8R0.9 C=CC(=O)\C=C\C(C)=O Amb24061722 [0,1,0,0,0,0|2,0,1]=4 515 B8R0.9 C=CC(=O)\C=C\C(C)C Amb26344609 [0,1,0,0,0,0|1,0,2]=4 516 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,1,0,0,0,0|1,0,2]=4 517 B8R0.9 C=C[C@H](O)CC=C(C)C Amb27805565 [0,1,0,0,0,0|1,0,1]=3 518 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,1,0,0,0,0|0,0,1]=2 519 B8R0.9 CC(=N)SCC(=O)CCl Amb24113053 [0,1,0,0,0,0|3,0,0]=4 520 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,1]=4 521 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,1,0,0,0,0|1,0,1]=3 522 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,1,0,0,0,0|1,0,2]=4 523 B8R0.9 CC(=O)CNC(=O)CCl Amb27880921 [0,1,0,0,0,0|3,0,0]=4 524 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,0|3,0,0]=4 525 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,1,0,0,0,0|2,0,1]=4 526 B8R0.9 CC(=O)COC(=O)CN Amb27168864 [0,1,0,0,0,0|3,0,0]=4 527 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,1,0,0,0,0|2,0,1]=4 528 B8R0.9 CC(=O)NCC(=O)CN Amb35789045 [0,1,0,0,0,0|3,0,0]=4 529 B8R0.9 CC(=O)NCC(=O)CN Amb35789904 [0,1,0,0,0,0|3,0,0]=4 530 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,1,0,0,0,0|2,0,0]=3 531 B8R0.9 CC(=O)NCC(=O)NN Amb24524168 [0,1,0,0,0,0|3,0,0]=4 532 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,0|2,0,0]=3 533 B8R0.9 CC(=O)NC\C(N)=N/O Amb19650814 [0,1,0,0,0,0|3,0,0]=4 534 B8R0.9 CC(=O)NC\C(N)=N\O Amb21912454 [0,1,0,0,0,0|3,0,0]=4 535 B8R0.9 CC(=O)N\C=C(\C)C=O Amb18642508 [0,1,0,0,0,0|2,0,1]=4 536 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,1,0,0,0,0|3,0,0]=4 537 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,1,0,0,0,0|3,0,0]=4 538 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,1,0,0,0,0|2,0,0]=3 539 B8R0.9 CC(=O)OCC(=O)NN Amb27480937 [0,1,0,0,0,0|3,0,0]=4 540 B8R0.9 CC(=O)O\C=C(/C)CBr Amb27433901 [0,1,0,0,0,0|2,0,0]=3 541 B8R0.9 CC(=O)O\C=C(\C)C=O Amb27966540 [0,1,0,0,0,0|2,0,1]=4 542 B8R0.9 CC(=O)\C=C\C(O)C=O Amb27798118 [0,1,0,0,0,0|1,0,2]=4 543 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,1,0,0,0,0|0,0,3]=4 544 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,1,0,0,0,0|1,0,2]=4 545 B8R0.9 CC(C)=CCC(C)C=O Amb18642441 [0,1,0,0,0,0|1,0,1]=3 546 B8R0.9 CC(C)=CCC(O)C#N Amb27650295 [0,1,0,0,0,0|1,0,1]=3 547 B8R0.9 CC(C)=CC[C@@H](C)CO Amb27619671 [0,1,0,0,0,0|1,0,1]=3 548 B8R0.9 CC(C)=CC\C(C)=C\Br Amb28255177 [0,1,0,0,0,0|2,0,0]=3 549 B8R0.9 CC(C)=CNC(=O)CCl Amb27880254 [0,1,0,0,0,0|2,0,0]=3 550 B8R0.9 CC(C)=C\C=C(/C)C=O Amb28240306 [0,1,0,0,0,0|1,0,1]=3 551 B8R0.9 CC(C)=NNC(=O)CCl Amb28119239 [0,1,0,0,0,0|3,0,0]=4 552 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,1,0,0,0,0|1,0,2]=4 553 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,1,0,0,0,0|1,0,2]=4 554 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,0|0,0,2]=3 555 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,1,0,0,0,0|1,0,2]=4 556 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,1,0,0,0,0|0,0,2]=3 557 B8R0.9 CC(C)CC\C(Cl)=N\O Amb28366200 [0,1,0,0,0,0|1,0,2]=4 558 B8R0.9 CC(C)CC\C(N)=N\O Amb10205331 [0,1,0,0,0,0|1,0,2]=4 559 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,1,0,0,0,0|1,0,2]=4 560 B8R0.9 CC(C)COC(=O)CO Amb27218940 [0,1,0,0,0,0|1,0,2]=4 561 B8R0.9 CC(C)NCC(=O)NN Amb27630359 [0,1,0,0,0,0|2,0,1]=4 562 B8R0.9 CC(C)NC\C(N)=N\O Amb27264292 [0,1,0,0,0,0|2,0,1]=4 563 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,1,0,0,0,0|2,0,1]=4 564 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,1,0,0,0,0|2,0,1]=4 565 B8R0.9 CC(C)OCC(=O)NN Amb2089067 [0,1,0,0,0,0|2,0,1]=4 566 B8R0.9 CC(C)OCC(=O)NN Amb2189164 [0,1,0,0,0,0|2,0,1]=4 567 B8R0.9 CC(C)OCC(O)C=O Amb27239297 [0,1,0,0,0,0|1,0,2]=4 568 B8R0.9 CC(C)OC\C(N)=N\O Amb9177999 [0,1,0,0,0,0|2,0,1]=4 569 B8R0.9 CC(C)SC\C(N)=N\O Amb25771404 [0,1,0,0,0,0|2,0,1]=4 570 B8R0.9 CC(C)\C=C\C(=O)CBr Amb26425645 [0,1,0,0,0,0|1,0,2]=4 571 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,1,0,0,0,0|1,0,2]=4 572 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,1,0,0,0,0|1,0,2]=4 573 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,1,0,0,0,0|0,0,2]=3 574 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,1,0,0,0,0|0,0,2]=3 575 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,1,0,0,0,0|0,0,2]=3 576 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,1,0,0,0,0|1,0,1]=3 577 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,1,0,0,0,0|1,0,1]=3 578 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,1,0,0,0,0|2,0,1]=4 579 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,1,0,0,0,0|1,0,2]=4 580 B8R0.9 CC(\C=C\C(=O)O)=C/Br Amb27650571 [0,1,0,0,0,0|0,0,2]=3 581 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,1,0,0,0,0|0,0,2]=3 582 B8R0.9 CCC(=N)NCC(N)=O Amb28049684 [0,1,0,0,0,0|3,0,0]=4 583 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,1,0,0,0,0|2,0,0]=3 584 B8R0.9 CCC(=O)C=C=C(C)C Amb27838691 [0,1,0,0,0,0|1,0,2]=4 585 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,1]=3 586 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,1,0,0,0,0|2,0,1]=4 587 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,1,0,0,0,0|1,0,2]=4 588 B8R0.9 CCC(=O)CNC(C)C Amb28341444 [0,1,0,0,0,0|2,0,1]=4 589 B8R0.9 CCC(=O)COC(C)=O Amb3940673 [0,1,0,0,0,0|3,0,0]=4 590 B8R0.9 CCC(=O)COC(C)C Amb27960841 [0,1,0,0,0,0|2,0,1]=4 591 B8R0.9 CCC(=O)CSC(C)=O Amb27180933 [0,1,0,0,0,0|3,0,0]=4 592 B8R0.9 CCC(=O)CSC(C)C Amb27450301 [0,1,0,0,0,0|2,0,1]=4 593 B8R0.9 CCC(=O)C\C=C(/C)Cl Amb27838754 [0,1,0,0,0,0|2,0,0]=3 594 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|2,0,0]=3 595 B8R0.9 CCC(=O)NCC(N)=O Amb17231864 [0,1,0,0,0,0|3,0,0]=4 596 B8R0.9 CCC(=O)NN=C(C)C Amb27837620 [0,1,0,0,0,0|3,0,0]=4 597 B8R0.9 CCC(=O)OCC(C)=O Amb27662511 [0,1,0,0,0,0|3,0,0]=4 598 B8R0.9 CCC(=O)OCC(N)=O Amb26505774 [0,1,0,0,0,0|3,0,0]=4 599 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,1,0,0,0,0|1,0,1]=3 600 B8R0.9 CCC(=O)\C=C/N(C)C Amb27226663 [0,1,0,0,0,0|2,0,1]=4 601 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,1,0,0,0,0|1,0,1]=3 602 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,1,0,0,0,0|1,0,2]=4 603 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,1,0,0,0,0|0,0,3]=4 604 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,1,0,0,0,0|0,0,2]=3 605 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|1,0,2]=4 606 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,1,0,0,0,0|1,0,1]=3 607 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,1,0,0,0,0|1,0,1]=3 608 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,1,0,0,0,0|2,0,1]=4 609 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,1,0,0,0,0|1,0,1]=3 610 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,1,0,0,0,0|2,0,1]=4 611 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,1,0,0,0,0|2,0,1]=4 612 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,1,0,0,0,0|1,0,1]=3 613 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,1,0,0,0,0|2,0,1]=4 614 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,1,0,0,0,0|0,0,2]=3 615 B8R0.9 CCC(C)\C=C\C(C)=O Amb24062970 [0,1,0,0,0,0|1,0,2]=4 616 B8R0.9 CCC(C)\C=C\C(N)=O Amb27439352 [0,1,0,0,0,0|1,0,2]=4 617 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,1,0,0,0,0|1,0,2]=4 618 B8R0.9 CCC(N)CC=C(C)C Amb27251594 [0,1,0,0,0,0|2,0,1]=4 619 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,1,0,0,0,0|1,0,2]=4 620 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,1,0,0,0,0|1,0,2]=4 621 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,1,0,0,0,0|1,0,2]=4 622 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,1,0,0,0,0|1,0,2]=4 623 B8R0.9 CCC(O)C\C=C(\C)Br Amb27405191 [0,1,0,0,0,0|2,0,1]=4 624 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,1,0,0,0,0|1,0,2]=4 625 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,1,0,0,0,0|1,0,1]=3 626 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,1,0,0,0,0|1,0,1]=3 627 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,1,0,0,0,0|2,0,1]=4 628 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,1,0,0,0,0|3,0,0]=4 629 B8R0.9 CCS(=O)\C=C\C(=O)O Amb28347741 [0,1,0,0,0,0|2,0,1]=4 630 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,1,0,0,0,0|0,0,3]=4 631 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,1,0,0,0,0|0,0,2]=3 632 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,1,0,0,0,0|0,0,2]=3 633 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,1,0,0,0,0|0,0,3]=4 634 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,1,0,0,0,0|1,0,2]=4 635 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,1,0,0,0,0|1,0,2]=4 636 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,1,0,0,0,0|1,0,2]=4 637 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,1,0,0,0,0|1,0,2]=4 638 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,1,0,0,0,0|0,0,0]=1 639 B8R0.9 CC\C(C)=N/NC(N)=O Amb2612373 [0,1,0,0,0,0|3,0,0]=4 640 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,1,0,0,0,0|1,0,2]=4 641 B8R0.9 CN(C)CCC(=O)CCl Amb33057681 [0,1,0,0,0,0|2,0,1]=4 642 B8R0.9 CN(C)CCC(=O)CN Amb18203194 [0,1,0,0,0,0|2,0,1]=4 643 B8R0.9 CN(C)CCC(=O)NN Amb396230 [0,1,0,0,0,0|2,0,1]=4 644 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,1,0,0,0,0|1,0,1]=3 645 B8R0.9 CN(C)CC\C(N)=N/O Amb2695942 [0,1,0,0,0,0|2,0,1]=4 646 B8R0.9 CN(C)CC\C(N)=N\O Amb1118599 [0,1,0,0,0,0|2,0,1]=4 647 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,1,0,0,0,0|2,0,1]=4 648 B8R0.9 CNC(=N)NCC(N)=O Amb27865962 [0,1,0,0,0,0|3,0,0]=4 649 B8R0.9 CNC(=N)SCC(C)=O Amb27461473 [0,1,0,0,0,0|3,0,0]=4 650 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,1,0,0,0,0|1,0,1]=3 651 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,1,0,0,0,0|2,0,1]=4 652 B8R0.9 CNC(=O)CCC(C)C Amb27165938 [0,1,0,0,0,0|1,0,2]=4 653 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,1,0,0,0,0|2,0,1]=4 654 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,1,0,0,0,0|2,0,1]=4 655 B8R0.9 CNC(=O)CNC(C)=N Amb28043406 [0,1,0,0,0,0|3,0,0]=4 656 B8R0.9 CNC(=O)CNC(C)=O Amb4034777 [0,1,0,0,0,0|3,0,0]=4 657 B8R0.9 CNC(=O)COC(C)=O Amb26872495 [0,1,0,0,0,0|3,0,0]=4 658 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,0|2,0,0]=3 659 B8R0.9 CNC(=O)NN=C(C)C Amb27145810 [0,1,0,0,0,0|3,0,0]=4 660 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,1,0,0,0,0|2,0,0]=3 661 B8R0.9 CNC(=O)\C=C/C(=O)O Amb2720469 [0,1,0,0,0,0|1,0,1]=3 662 B8R0.9 CNC(=O)\C=C\C(=O)O Amb9277097 [0,1,0,0,0,0|1,0,1]=3 663 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,1,0,0,0,0|2,0,0]=3 664 B8R0.9 COC(=O)C#CC(C)C Amb28250141 [0,1,0,0,0,0|0,0,3]=4 665 B8R0.9 COC(=O)C=C=C(C)C Amb32423562 [0,1,0,0,0,0|0,0,2]=3 666 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,1,0,0,0,0|2,0,1]=4 667 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,1,0,0,0,0|1,0,1]=3 668 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,1,0,0,0,0|1,0,1]=3 669 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,0|1,0,2]=4 670 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,1,0,0,0,0|0,0,2]=3 671 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,0|1,0,2]=4 672 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,1,0,0,0,0|1,0,2]=4 673 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,0|1,0,2]=4 674 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,1,0,0,0,0|1,0,2]=4 675 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,1,0,0,0,0|1,0,2]=4 676 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,1,0,0,0,0|1,0,2]=4 677 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,1,0,0,0,0|1,0,2]=4 678 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,1]=4 679 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,1,0,0,0,0|2,0,1]=4 680 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,1,0,0,0,0|1,0,1]=3 681 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,1,0,0,0,0|2,0,1]=4 682 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,0|1,0,2]=4 683 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,1,0,0,0,0|1,0,2]=4 684 B8R0.9 COC(=O)CNC(=N)N Amb27259956 [0,1,0,0,0,0|3,0,0]=4 685 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,1,0,0,0,0|2,0,0]=3 686 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,1,0,0,0,0|1,0,1]=3 687 B8R0.9 COC(=O)CNC(N)=O Amb1126846 [0,1,0,0,0,0|3,0,0]=4 688 B8R0.9 COC(=O)CNC(N)=S Amb9212124 [0,1,0,0,0,0|3,0,0]=4 689 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,1,0,0,0,0|2,0,0]=3 690 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,1,0,0,0,0|1,0,1]=3 691 B8R0.9 COC(=O)CSC(=N)N Amb20676059 [0,1,0,0,0,0|3,0,0]=4 692 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,1,0,0,0,0|1,0,1]=3 693 B8R0.9 COC(=O)NCC(=O)Cl Amb28388481 [0,1,0,0,0,0|3,0,0]=4 694 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,1,0,0,0,0|2,0,0]=3 695 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,1,0,0,0,0|2,0,1]=4 696 B8R0.9 COC(=O)NCC(N)=O Amb27640170 [0,1,0,0,0,0|3,0,0]=4 697 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,0|2,0,1]=4 698 B8R0.9 COC(=O)OCC(=O)Cl Amb8393900 [0,1,0,0,0,0|3,0,0]=4 699 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,1,0,0,0,0|2,0,0]=3 700 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [0,1,0,0,0,0|1,0,1]=3 701 B8R0.9 COC(=O)\C=C\C(=O)Cl Amb32664984 [0,1,0,0,0,0|2,0,1]=4 702 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [0,1,0,0,0,0|1,0,1]=3 703 B8R0.9 COC(=O)\C=C\C(C)=O Amb22336182 [0,1,0,0,0,0|1,0,1]=3 704 B8R0.9 COC(=O)\C=C\C(C)C Amb2689521 [0,1,0,0,0,0|0,0,2]=3 705 B8R0.9 COC(=O)\C=C\C(C)N Amb33069659 [0,1,0,0,0,0|1,0,2]=4 706 B8R0.9 COC(=O)\C=C\C(C)N Amb33069671 [0,1,0,0,0,0|1,0,2]=4 707 B8R0.9 COC(=O)\C=C\C(C)O Amb27484758 [0,1,0,0,0,0|1,0,2]=4 708 B8R0.9 COC(=O)\C=C\N(C)C Amb33986628 [0,1,0,0,0,0|1,0,1]=3 709 B8R0.9 COC(=O)\C=C\N(C)O Amb27202378 [0,1,0,0,0,0|2,0,1]=4 710 B8R0.9 COC(=O)\C=C\S(C)=O Amb28049230 [0,1,0,0,0,0|2,0,1]=4 711 B8R0.9 COC(=O)\C=C\[C@@H](C)N Amb27252211 [0,1,0,0,0,0|1,0,2]=4 712 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,1,0,0,0,0|2,0,0]=3 713 B8R0.9 COC(=S)SCC(N)=O Amb28325528 [0,1,0,0,0,0|3,0,0]=4 714 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,1,0,0,0,0|0,0,2]=3 715 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,1,0,0,0,0|1,0,2]=4 716 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,1]=4 717 B8R0.9 COC(C)\C=C\C(=O)O Amb27203687 [0,1,0,0,0,0|0,0,2]=3 718 B8R0.9 COC(C)\C=C\C(C)=O Amb27841431 [0,1,0,0,0,0|1,0,2]=4 719 B8R0.9 CON(C)CC=C(C)C Amb27487172 [0,1,0,0,0,0|2,0,0]=3 720 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,1,0,0,0,0|1,0,1]=3 721 B8R0.9 CON(C)\C=C\C(=O)O Amb35734889 [0,1,0,0,0,0|1,0,1]=3 722 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,1,0,0,0,0|0,0,2]=3 723 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,1,0,0,0,0|0,0,0]=1 724 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,1,0,0,0,0|2,0,0]=3 725 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,1,0,0,0,0|0,1,2]=4 726 B8R0.9 CSC(=O)\C=C/C(C)=O Amb27256793 [0,1,0,0,0,0|1,1,1]=4 727 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,1,0,0,0,0|0,0,2]=3 728 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,1,0,0,0,0|1,0,2]=4 729 B8R0.9 C[N+](C)=CNC(=O)CCl Amb27823245 [0,1,0,0,0,0|3,0,0]=4 730 B8R0.9 C\C(=C\C=C(Cl)Cl)CO Amb27801560 [0,1,0,0,0,0|2,0,1]=4 731 B8R0.9 C\C(Br)=C/C[C@H](O)CO Amb28049194 [0,1,0,0,0,0|1,0,2]=4 732 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,1,0,0,0,0|0,0,1]=2 733 B8R0.9 C\C(C#N)=C\NC(N)=O Amb28133456 [0,1,0,0,0,0|2,0,1]=4 734 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,1,0,0,0,0|1,0,1]=3 735 B8R0.9 C\C(CCC(C)C)=N/O Amb25235824 [0,1,0,0,0,0|1,0,2]=4 736 B8R0.9 C\C(CCC(C)C)=N\O Amb24547350 [0,1,0,0,0,0|1,0,2]=4 737 B8R0.9 C\C(CCN(C)C)=N/O Amb27813221 [0,1,0,0,0,0|2,0,1]=4 738 B8R0.9 C\C(CCl)=N/NC(N)=O Amb28134577 [0,1,0,0,0,0|3,0,0]=4 739 B8R0.9 C\C(CN)=N/NC(N)=O Amb28388320 [0,1,0,0,0,0|3,0,0]=4 740 B8R0.9 C\C(CSC(C)C)=N/O Amb27406156 [0,1,0,0,0,0|2,0,1]=4 741 B8R0.9 C\C=C(C)/C=C/C(=O)O Amb27838460 [0,1,0,0,0,0|0,0,1]=2 742 B8R0.9 C\C=C(C)/C=C/C(C)=O Amb27428251 [0,1,0,0,0,0|1,0,1]=3 743 B8R0.9 C\C=C(C)\C=C/C(C)=O Amb28199822 [0,1,0,0,0,0|1,0,1]=3 744 B8R0.9 C\C=C(C)\C=C\C(=O)O Amb18642399 [0,1,0,0,0,0|0,0,1]=2 745 B8R0.9 C\C=C(Cl)\C=C\C(=O)O Amb28137785 [0,1,0,0,0,0|1,0,1]=3 746 B8R0.9 C\C=C(F)\C=C\C(=O)O Amb27826588 [0,1,0,0,0,0|1,0,1]=3 747 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,1,0,0,0,0|1,0,1]=3 748 B8R0.9 C\C=C(\C)OCC(C)=O Amb27844138 [0,1,0,0,0,0|2,0,0]=3 749 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.9 N=C(CCl)NCC(N)=O Amb27483156 [0,1,0,0,0,0|3,0,0]=4 751 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,1,0,0,0,0|1,0,2]=4 752 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,1,0,0,0,0|1,0,2]=4 753 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,1,0,0,0,0|1,0,2]=4 754 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,1,0,0,0,0|1,0,2]=4 755 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,1,0,0,0,0|1,0,2]=4 756 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,1,0,0,0,0|1,0,2]=4 757 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,1,0,0,0,0|1,0,1]=3 758 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,1,0,0,0,0|1,0,1]=3 759 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,0|2,0,0]=3 760 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,1,0,0,0,0|2,0,0]=3 761 B8R0.9 NCC(=O)OCC(N)=O Amb27829178 [0,1,0,0,0,0|3,0,0]=4 762 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,1,0,0,0,0|1,0,2]=4 763 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,1,0,0,0,0|1,0,2]=4 764 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,1,0,0,0,0|1,0,2]=4 765 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,1,0,0,0,0|1,0,2]=4 766 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,1,0,0,0,0|1,0,2]=4 767 B8R0.9 NNC(=O)NCC(=O)O Amb27623574 [0,1,0,0,0,0|3,0,0]=4 768 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,1,0,0,0,0|1,0,2]=4 769 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,1,0,0,0,0|1,0,2]=4 770 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,1,0,0,0,0|1,0,2]=4 771 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,1,0,0,0,0|1,0,2]=4 772 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|1,0,1]=3 773 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,1,0,0,0,0|1,0,2]=4 774 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,1,0,0,0,0|1,0,2]=4 775 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,1,0,0,0,0|2,0,1]=4 776 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,0|2,0,0]=3 777 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,1,0,0,0,0|2,0,0]=3 778 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,1,0,0,0,0|2,0,0]=3 779 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,1,0,0,0,0|2,0,0]=3 780 B8R0.9 O=C(O)CS\C(Cl)=C\Cl Amb27858758 [0,1,0,0,0,0|2,0,1]=4 781 B8R0.9 O=C(O)\C=C\C(=O)NO Amb28060797 [0,1,0,0,0,0|2,0,1]=4 782 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,1,0,0,0,0|1,0,2]=4 783 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,1,0,0,0,0|1,0,2]=4 784 B8R0.9 O=CC(=O)CC=C(Cl)Cl Amb27799461 [0,1,0,0,0,0|2,0,1]=4 785 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,1,0,0,0,0|1,0,2]=4 786 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,1,0,0,0,0|2,0,1]=4 787 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,1,0,0,0,0|1,0,2]=4 788 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,1,0,0,0,0|1,0,2]=4 789 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,1,0,0,0,0|1,0,2]=4 790 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,1,0,0,0,0|1,0,2]=4 791 B8R0.23 C=C(C)C(=C)CC(C)=O Amb28324025 [0,1,0,0,0,0|1,0,1]=3 792 B8R0.23 C=C(C)C(=O)NC(N)=O Amb27232527 [0,1,0,0,0,0|2,0,1]=4 793 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,1,0,0,0,0|0,0,2]=3 794 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,1,0,0,0,0|1,0,2]=4 795 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,1,0,0,0,0|0,0,2]=3 796 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,0|1,0,2]=4 797 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,1,0,0,0,0|0,0,2]=3 798 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [0,1,0,0,0,0|1,0,2]=4 799 B8R0.23 C=C(C)CC(=C)C(C)=O Amb27215898 [0,1,0,0,0,0|3,0,0]=4 800 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,1,0,0,0,0|0,0,3]=4 801 B8R0.23 C=C(C)CC(=O)N(C)C Amb28184722 [0,1,0,0,0,0|3,0,0]=4 802 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,1,0,0,0,0|0,0,2]=3 803 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [0,1,0,0,0,0|1,0,2]=4 804 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [0,1,0,0,0,0|1,0,2]=4 805 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,1,0,0,0,0|0,0,2]=3 806 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,1,0,0,0,0|1,0,2]=4 807 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,1,0,0,0,0|0,0,2]=3 808 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,1,0,0,0,0|0,0,2]=3 809 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,1,0,0,0,0|0,0,2]=3 810 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,1,0,0,0,0|0,0,2]=3 811 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,1,0,0,0,0|0,0,2]=3 812 B8R0.23 C=C(C)OC(C)C(C)=O Amb27838756 [0,1,0,0,0,0|2,0,1]=4 813 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,1,0,0,0,0|0,0,2]=3 814 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [0,1,0,0,0,0|1,0,2]=4 815 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,1,0,0,0,0|0,0,2]=3 816 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,1,0,0,0,0|0,0,2]=3 817 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [0,1,0,0,0,0|1,0,2]=4 818 B8R0.23 C=C(C)\C(C)=C\C(=O)O Amb17593311 [0,1,0,0,0,0|0,0,2]=3 819 B8R0.23 C=C(C)\C(C)=C\C(C)=O Amb28130583 [0,1,0,0,0,0|1,0,2]=4 820 B8R0.23 C=C(C)\C(Cl)=C/C(C)=O Amb27826885 [0,1,0,0,0,0|1,0,2]=4 821 B8R0.23 C=C(C)\C(Cl)=C\C(C)=O Amb28052286 [0,1,0,0,0,0|1,0,2]=4 822 B8R0.23 C=C(C)\C(O)=C\C(C)=O Amb27844297 [0,1,0,0,0,0|1,0,2]=4 823 B8R0.23 C=C(CC(=O)Cl)C(=O)Cl Amb17938995 [0,1,0,0,0,0|3,0,0]=4 824 B8R0.23 C=C(CC(=O)O)C(=O)O Amb6608656 [0,1,0,0,0,0|2,0,0]=3 825 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,1,0,0,0,0|1,0,0]=2 826 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [0,1,0,0,0,0|2,0,0]=3 827 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,1,0,0,0,0|0,0,3]=4 828 B8R0.23 C=C(CN(C)C)C(=O)O Amb33544507 [0,1,0,0,0,0|1,0,2]=4 829 B8R0.23 C=C(Cl)CC(=O)C(C)C Amb28144043 [0,1,0,0,0,0|2,0,1]=4 830 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,1,0,0,0,0|1,0,2]=4 831 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,1,0,0,0,0|1,0,2]=4 832 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,1,0,0,0,0|1,0,2]=4 833 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,1,0,0,0,0|1,0,2]=4 834 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,1,0,0,0,0|1,0,2]=4 835 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,1,0,0,0,0|1,0,2]=4 836 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,1,0,0,0,0|1,0,2]=4 837 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,1,0,0,0,0|1,0,2]=4 838 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,1,0,0,0,0|1,0,2]=4 839 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [0,1,0,0,0,0|2,0,1]=4 840 B8R0.23 C=C(O)CC(=C)N(C)C Amb27767982 [0,1,0,0,0,0|2,0,0]=3 841 B8R0.23 C=C(OC(C)=O)C(C)=O Amb27838658 [0,1,0,0,0,0|3,0,0]=4 842 B8R0.23 CC(=N)NC(C)C(N)=O Amb27412520 [0,1,0,0,0,0|3,0,0]=4 843 B8R0.23 CC(=O)C(=O)C=C(C)C Amb27843950 [0,1,0,0,0,0|1,0,1]=3 844 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,1,0,0,0,0|1,0,0]=2 845 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,1,0,0,0,0|1,0,1]=3 846 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,1,0,0,0,0|1,0,1]=3 847 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,1,0,0,0,0|1,0,2]=4 848 B8R0.23 CC(=O)C(C)CN(C)C Amb4019104 [0,1,0,0,0,0|2,0,1]=4 849 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,1,0,0,0,0|1,0,1]=3 850 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|2,0,1]=4 851 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,1,0,0,0,0|1,0,1]=3 852 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,1,0,0,0,0|1,0,2]=4 853 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,1,0,0,0,0|1,0,2]=4 854 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [0,1,0,0,0,0|2,0,0]=3 855 B8R0.23 CC(=O)CC(=O)C(C)C Amb17778966 [0,1,0,0,0,0|1,0,1]=3 856 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,1,0,0,0,0|2,0,0]=3 857 B8R0.23 CC(=O)CC(=S)N(C)C Amb27836775 [0,1,0,0,0,0|2,0,0]=3 858 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,1,0,0,0,0|1,0,2]=4 859 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,1,0,0,0,0|1,0,1]=3 860 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,1,0,0,0,0|2,0,1]=4 861 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,1,0,0,0,0|1,0,0]=2 862 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,1,0,0,0,0|1,0,1]=3 863 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,1,0,0,0,0|1,0,1]=3 864 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,1,0,0,0,0|1,0,2]=4 865 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,1,0,0,0,0|2,0,1]=4 866 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,1,0,0,0,0|1,0,1]=3 867 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [0,1,0,0,0,0|3,0,0]=4 868 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,1,0,0,0,0|2,0,1]=4 869 B8R0.23 CC(=O)CS(=O)C(C)C Amb27804515 [0,1,0,0,0,0|2,0,1]=4 870 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,1,0,0,0,0|1,0,1]=3 871 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,1,0,0,0,0|1,0,1]=3 872 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,1,0,0,0,0|1,0,2]=4 873 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,1,0,0,0,0|1,0,1]=3 874 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,1,0,0,0,0|2,0,1]=4 875 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,1,0,0,0,0|1,0,2]=4 876 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,1,0,0,0,0|1,0,1]=3 877 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,1,0,0,0,0|1,0,1]=3 878 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,1,0,0,0,0|2,0,0]=3 879 B8R0.23 CC(=O)N(C)CC(N)=O Amb8999134 [0,1,0,0,0,0|3,0,0]=4 880 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,1,0,0,0,0|2,0,0]=3 881 B8R0.23 CC(=O)NC(=O)C(C)=O Amb28245557 [0,1,0,0,0,0|3,0,0]=4 882 B8R0.23 CC(=O)NC(=O)C(C)C Amb28428628 [0,1,0,0,0,0|2,0,1]=4 883 B8R0.23 CC(=O)NC(=S)N(C)C Amb24741222 [0,1,0,0,0,0|3,0,0]=4 884 B8R0.23 CC(=O)NC(Br)C(C)=O Amb28285135 [0,1,0,0,0,0|3,0,0]=4 885 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,1,0,0,0,0|2,0,0]=3 886 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [0,1,0,0,0,0|3,0,0]=4 887 B8R0.23 CC(=O)NC(C)C(N)=O Amb4018750 [0,1,0,0,0,0|3,0,0]=4 888 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,1,0,0,0,0|2,0,0]=3 889 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,1,0,0,0,0|3,0,0]=4 890 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,1,0,0,0,0|2,0,0]=3 891 B8R0.23 CC(=O)N\C(C)=C(\C)[S-] Amb28285580 [0,1,0,0,0,0|3,0,0]=4 892 B8R0.23 CC(=O)OC(=O)C(C)=O Amb26528827 [0,1,0,0,0,0|3,0,0]=4 893 B8R0.23 CC(=O)OC(C)C(=O)Cl Amb25920188 [0,1,0,0,0,0|3,0,0]=4 894 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,1,0,0,0,0|2,0,0]=3 895 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [0,1,0,0,0,0|3,0,0]=4 896 B8R0.23 CC(=O)OC(C)C(N)=O Amb27179906 [0,1,0,0,0,0|3,0,0]=4 897 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl Amb3939242 [0,1,0,0,0,0|3,0,0]=4 898 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,1,0,0,0,0|2,0,0]=3 899 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [0,1,0,0,0,0|3,0,0]=4 900 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl Amb27411067 [0,1,0,0,0,0|3,0,0]=4 901 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,1,0,0,0,0|2,0,0]=3 902 B8R0.23 CC(=O)O[C@H](C)C(N)=O Amb27227531 [0,1,0,0,0,0|3,0,0]=4 903 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,1,0,0,0,0|2,0,0]=3 904 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,1,0,0,0,0|2,0,0]=3 905 B8R0.23 CC(=O)[C@@H](C)CN(C)C Amb27162005 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,1,0,0,0,0|1,0,2]=4 907 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,1,0,0,0,0|2,0,1]=4 908 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,1,0,0,0,0|1,0,1]=3 909 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,1,0,0,0,0|1,0,2]=4 910 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,1,0,0,0,0|1,0,1]=3 911 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,1,0,0,0,0|1,0,2]=4 912 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,1,0,0,0,0|1,0,1]=3 913 B8R0.23 CC(=O)\C(C)=C/N(C)C Amb27191797 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,1,0,0,0,0|1,0,1]=3 915 B8R0.23 CC(=O)\C(C)=C\N(C)C Amb28199737 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,1,0,0,0,0|1,0,1]=3 917 B8R0.23 CC(=O)\C=C(/C)C(C)C Amb27649040 [0,1,0,0,0,0|1,0,2]=4 918 B8R0.23 CC(=O)\C=C(/C)N(C)C Amb28429281 [0,1,0,0,0,0|2,0,1]=4 919 B8R0.23 CC(=O)\C=C(/C)[PH](=O)O Amb27838812 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.23 CC(=O)\C=C(/Cl)N(C)C Amb27844137 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,1,0,0,0,0|1,0,1]=3 922 B8R0.23 CC(=O)\C=C(/N)C(C)C Amb27477023 [0,1,0,0,0,0|1,0,2]=4 923 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [0,1,0,0,0,0|1,0,1]=3 924 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [0,1,0,0,0,0|1,0,1]=3 925 B8R0.23 CC(=O)\C=C(\C)[PH](=O)O Amb28248338 [0,1,0,0,0,0|2,0,1]=4 926 B8R0.23 CC(=O)\C=C(\Cl)N(C)C Amb27424743 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [0,1,0,0,0,0|1,0,1]=3 928 B8R0.23 CC(=O)\N=C(/C)C(C)=O Amb26476592 [0,1,0,0,0,0|3,0,0]=4 929 B8R0.23 CC(=S)CC(=O)C(C)C Amb27838816 [0,1,0,0,0,0|1,1,1]=4 930 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,1,0,0,0,0|2,0,0]=3 931 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,1,0,0,0,0|1,0,2]=4 932 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,1,0,0,0,0|0,0,0]=1 933 B8R0.23 CC(C)=C(C)NC(=S)[S-] Amb28046298 [0,1,0,0,0,0|1,2,0]=4 934 B8R0.23 CC(C)=CC(C)=C(C)C Amb22365199 [0,1,0,0,0,0|2,0,1]=4 935 B8R0.23 CC(C)=CC(C)C(C)O Amb27956545 [0,1,0,0,0,0|1,0,1]=3 936 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,1,0,0,0,0|0,0,0]=1 937 B8R0.23 CC(C)=CC(O)C(C)C Amb28187123 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.23 CC(C)=CC(O)C(C)N Amb35588691 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.23 CC(C)=CC(O)[C@@H](C)N Amb35624311 [0,1,0,0,0,0|2,0,1]=4 940 B8R0.23 CC(C)=CC(O)[C@H](C)N Amb35618423 [0,1,0,0,0,0|2,0,1]=4 941 B8R0.23 CC(C)=C[C@@H](C)[C@H](C)O Amb28049133 [0,1,0,0,0,0|1,0,1]=3 942 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,1,0,0,0,0|0,0,0]=1 943 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,1,0,0,0,0|0,0,0]=1 944 B8R0.23 CC(C)=C[C@H](O)C(C)C Amb28049217 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.23 CC(C)=NN(C)C(N)=O Amb28292102 [0,1,0,0,0,0|3,0,0]=4 946 B8R0.23 CC(C)C(=O)CS(C)=O Amb28041249 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.23 CC(C)C(=O)C[C@H](C)O Amb28285164 [0,1,0,0,0,0|1,0,2]=4 948 B8R0.23 CC(C)C(=O)C[N+](=O)[O-] Amb27802158 [0,1,0,0,0,0|1,0,2]=4 949 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,1,0,0,0,0|2,0,1]=4 950 B8R0.23 CC(C)C(=S)NC(N)=O Amb27168629 [0,1,0,0,0,0|2,0,1]=4 951 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,0|0,0,2]=3 952 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,0|1,0,2]=4 953 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,1,0,0,0,0|0,0,2]=3 954 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,1,0,0,0,0|0,0,2]=3 955 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,1,0,0,0,0|0,0,2]=3 956 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,0|1,0,2]=4 957 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,1,0,0,0,0|0,0,2]=3 958 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,1,0,0,0,0|0,0,3]=4 959 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,1,0,0,0,0|0,0,3]=4 960 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,1,0,0,0,0|1,0,2]=4 961 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,1,0,0,0,0|0,0,2]=3 962 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,1,0,0,0,0|0,0,2]=3 963 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,1,0,0,0,0|1,0,2]=4 964 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,1,0,0,0,0|0,0,2]=3 965 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,1,0,0,0,0|0,0,2]=3 966 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,1,0,0,0,0|0,0,2]=3 967 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,1,0,0,0,0|1,0,2]=4 968 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,1,0,0,0,0|1,0,2]=4 969 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,1,0,0,0,0|1,0,2]=4 970 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,1,0,0,0,0|0,0,2]=3 971 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,1,0,0,0,0|0,0,3]=4 972 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,1,0,0,0,0|1,0,2]=4 973 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,1,0,0,0,0|0,0,2]=3 974 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,1,0,0,0,0|0,0,2]=3 975 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,1,0,0,0,0|0,0,2]=3 976 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,1,0,0,0,0|0,0,2]=3 977 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,1,0,0,0,0|0,0,2]=3 978 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,1,0,0,0,0|1,0,2]=4 979 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,1,0,0,0,0|1,0,2]=4 980 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,1,0,0,0,0|0,0,2]=3 981 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,1,0,0,0,0|0,0,2]=3 982 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,1,0,0,0,0|0,0,2]=3 983 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,1,0,0,0,0|1,0,2]=4 984 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,1,0,0,0,0|0,0,2]=3 985 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,1,0,0,0,0|1,0,2]=4 986 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,1,0,0,0,0|0,0,2]=3 987 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,1,0,0,0,0|0,0,2]=3 988 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,1,0,0,0,0|0,0,2]=3 989 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,1,0,0,0,0|0,1,2]=4 990 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,1,0,0,0,0|1,0,2]=4 991 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,1,0,0,0,0|1,0,2]=4 992 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,1,0,0,0,0|0,0,2]=3 993 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,1,0,0,0,0|1,0,1]=3 994 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,1,0,0,0,0|1,0,1]=3 995 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,1,0,0,0,0|1,0,2]=4 996 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,1,0,0,0,0|1,0,1]=3 997 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,1,0,0,0,0|1,0,1]=3 998 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,1,0,0,0,0|1,0,1]=3 999 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,1,0,0,0,0|1,0,1]=3 1000 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,1,0,0,0,0|1,0,2]=4 1001 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,1,0,0,0,0|1,0,2]=4 1002 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,1,0,0,0,0|1,0,1]=3 1003 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,1,0,0,0,0|1,0,2]=4 1004 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,1,0,0,0,0|1,0,1]=3 1005 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,1,0,0,0,0|2,0,1]=4 1006 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,1,0,0,0,0|1,0,1]=3 1007 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,0|0,0,2]=3 1008 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,1,0,0,0,0|0,0,2]=3 1009 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,1,0,0,0,0|0,0,2]=3 1010 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,1,0,0,0,0|1,0,2]=4 1011 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,1,0,0,0,0|0,0,2]=3 1012 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,1,0,0,0,0|1,0,2]=4 1013 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,1,0,0,0,0|0,0,2]=3 1014 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,1,0,0,0,0|0,0,2]=3 1015 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,0|1,0,2]=4 1016 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,1,0,0,0,0|0,0,2]=3 1017 B8R0.23 CC(C)\C(N)=C\C(N)=O Amb27413103 [0,1,0,0,0,0|1,0,2]=4 1018 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,1,0,0,0,0|0,0,2]=3 1019 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,1,0,0,0,0|0,0,2]=3 1020 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,1,0,0,0,0|0,0,2]=3 1021 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,1,0,0,0,0|2,0,1]=4 1022 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,1,0,0,0,0|1,0,1]=3 1024 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,1,0,0,0,0|1,0,1]=3 1025 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.23 CC(CC(N)=O)N(C)C Amb17231867 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,1,0,0,0,0|1,0,1]=3 1029 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,1,0,0,0,0|1,0,1]=3 1030 B8R0.23 CC(CN(C)C)C(N)=O Amb17231865 [0,1,0,0,0,0|2,0,1]=4 1031 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,1,0,0,0,0|2,0,1]=4 1032 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,1,0,0,0,0|2,0,1]=4 1033 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,1,0,0,0,0|1,0,2]=4 1034 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,1,0,0,0,0|1,0,2]=4 1035 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,1,0,0,0,0|1,0,2]=4 1036 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,1,0,0,0,0|1,0,2]=4 1037 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,1,0,0,0,0|1,0,2]=4 1038 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [0,1,0,0,0,0|3,0,0]=4 1039 B8R0.23 CC(NC(=S)S)C(=O)O Amb25336384 [0,1,0,0,0,0|3,0,0]=4 1040 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [0,1,0,0,0,0|3,0,0]=4 1041 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,1,0,0,0,0|1,0,2]=4 1042 B8R0.23 CC(O)CC(=O)N(C)C Amb27187024 [0,1,0,0,0,0|2,0,1]=4 1043 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,1,0,0,0,0|1,0,2]=4 1044 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,1,0,0,0,0|1,0,2]=4 1045 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,1,0,0,0,0|1,0,2]=4 1046 B8R0.23 CC(OC(=O)Cl)C(=O)O Amb27241520 [0,1,0,0,0,0|3,0,0]=4 1047 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [0,1,0,0,0,0|3,0,0]=4 1048 B8R0.23 CN(C)C(=N)CC(=N)N Amb27458894 [0,1,0,0,0,0|3,0,0]=4 1049 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,1,0,0,0,0|1,0,0]=2 1050 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.23 CN(C)C(=O)CC(N)=S Amb1980814 [0,1,0,0,0,0|2,1,0]=4 1052 B8R0.23 CN(C)C(=O)NC(N)=O Amb27254207 [0,1,0,0,0,0|3,0,0]=4 1053 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,1,0,0,0,0|1,0,1]=3 1054 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,1,0,0,0,0|1,0,1]=3 1055 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,1,0,0,0,0|1,0,1]=3 1056 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,1,0,0,0,0|2,0,1]=4 1057 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,1,0,0,0,0|1,0,1]=3 1058 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,1,0,0,0,0|1,0,1]=3 1059 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,1,0,0,0,0|1,0,1]=3 1060 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,1,0,0,0,0|1,0,1]=3 1061 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,1,0,0,0,0|1,0,1]=3 1062 B8R0.23 CN(C)\C(N)=N\C(N)=O Amb24481785 [0,1,0,0,0,0|3,0,0]=4 1063 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [0,1,0,0,0,0|3,0,0]=4 1064 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [0,1,0,0,0,0|3,0,0]=4 1065 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [0,1,0,0,0,0|3,0,0]=4 1066 B8R0.23 CN(CC(=O)O)C(=O)Cl Amb27484119 [0,1,0,0,0,0|3,0,0]=4 1067 B8R0.23 CN(CC(=O)O)C(=S)S Amb1042470 [0,1,0,0,0,0|3,0,0]=4 1068 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [0,1,0,0,0,0|3,0,0]=4 1069 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,1,0,0,0,0|3,0,0]=4 1070 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,1,0,0,0,0|2,0,1]=4 1075 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,1,0,0,0,0|2,0,1]=4 1076 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,1,0,0,0,0|1,0,2]=4 1077 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,1,0,0,0,0|2,0,1]=4 1078 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [0,1,0,0,0,0|3,0,0]=4 1079 B8R0.23 C[C@@H](O)CC(=O)N(C)C Amb27406239 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.23 C[C@@H](O)CC(=S)N(C)C Amb28049088 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,1,0,0,0,0|1,0,2]=4 1082 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,1,0,0,0,0|1,0,2]=4 1083 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [0,1,0,0,0,0|3,0,0]=4 1084 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,1,0,0,0,0|2,0,1]=4 1085 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,1,0,0,0,0|2,0,1]=4 1086 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,1,0,0,0,0|2,0,1]=4 1087 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,1,0,0,0,0|1,0,2]=4 1088 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,1,0,0,0,0|1,0,2]=4 1089 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,1,0,0,0,0|1,0,2]=4 1090 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,1,0,0,0,0|1,0,2]=4 1091 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,1,0,0,0,0|1,0,2]=4 1092 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [0,1,0,0,0,0|3,0,0]=4 1093 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [0,1,0,0,0,0|3,0,0]=4 1094 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,1,0,0,0,0|3,0,0]=4 1095 B8R0.23 C[C@H](O)CC(=O)N(C)C Amb28045652 [0,1,0,0,0,0|2,0,1]=4 1096 B8R0.23 C[C@H](O)CC(=S)N(C)C Amb28049089 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,1,0,0,0,0|1,0,2]=4 1098 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,1,0,0,0,0|2,0,1]=4 1099 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,1,0,0,0,0|2,0,1]=4 1100 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,1,0,0,0,0|2,0,1]=4 1101 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [0,1,0,0,0,0|2,0,1]=4 1102 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,1,0,0,0,0|0,0,2]=3 1103 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [0,1,0,0,0,0|2,0,1]=4 1104 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,1,0,0,0,0|0,0,2]=3 1105 B8R0.23 C\C(=C/C(C)C)C(N)=O Amb27807446 [0,1,0,0,0,0|1,0,2]=4 1106 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [0,1,0,0,0,0|2,0,1]=4 1107 B8R0.23 C\C(=C/C(N)=O)C(C)C Amb27468615 [0,1,0,0,0,0|1,0,2]=4 1108 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [0,1,0,0,0,0|2,0,1]=4 1109 B8R0.23 C\C(=C\C(C)C)C(N)=O Amb28350432 [0,1,0,0,0,0|1,0,2]=4 1110 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,1,0,0,0,0|1,0,2]=4 1111 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,1,0,0,0,0|1,0,0]=2 1112 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,1,0,0,0,0|1,0,0]=2 1113 B8R0.23 C\C(N)=N/[C@H](C)C(N)=O Amb28049817 [0,1,0,0,0,0|3,0,0]=4 1114 B8R0.23 C\C(N)=[N+](\C)CC(=O)[O-] Amb25339595 [0,1,0,0,0,0|2,0,1]=4 1115 B8R0.23 NC(=O)C(=S)CC(O)=S Amb28323012 [0,1,0,0,0,0|2,1,0]=4 1116 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,1,0,0,0,0|2,0,1]=4 1118 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,1,0,0,0,0|2,0,1]=4 1119 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,1,0,0,0,0|2,0,1]=4 1120 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,1,0,0,0,0|2,0,1]=4 1121 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,1,0,0,0,0|2,0,1]=4 1122 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,1,0,0,0,0|2,0,1]=4 1123 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,1,0,0,0,0|2,0,1]=4 1124 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,1,0,0,0,0|2,0,1]=4 1125 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,1,0,0,0,0|2,0,1]=4 1126 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,1,0,0,0,0|2,0,1]=4 1127 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,1,0,0,0,0|2,0,1]=4 1128 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,1,0,0,0,0|2,0,1]=4 1129 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,1,0,0,0,0|2,0,1]=4 1130 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,1,0,0,0,0|2,0,1]=4 1131 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,1,0,0,0,0|2,0,1]=4 1132 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.23 NC(=O)N(N)CC(=O)O Amb6296397 [0,1,0,0,0,0|3,0,0]=4 1134 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [0,1,0,0,0,0|3,0,0]=4 1135 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [0,1,0,0,0,0|3,0,0]=4 1136 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,1,0,0,0,0|2,0,1]=4 1137 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,1,0,0,0,0|2,0,1]=4 1138 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.23 NC(=O)\C=C(/Cl)C(=O)O Amb27815058 [0,1,0,0,0,0|2,0,1]=4 1142 B8R0.23 NC(=O)\C=C(\F)C(=O)O Amb27447226 [0,1,0,0,0,0|2,0,1]=4 1143 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,1,0,0,0,0|2,0,1]=4 1144 B8R0.23 NC(C=C(Cl)Cl)C(=O)O Amb22350718 [0,1,0,0,0,0|2,0,0]=3 1145 B8R0.23 NC(C=S(=O)=O)C(=O)O Amb27231764 [0,1,0,0,0,0|3,0,0]=4 1146 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,1,0,0,0,0|2,0,1]=4 1147 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,1,0,0,0,0|2,0,1]=4 1148 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,1,0,0,0,0|2,0,1]=4 1149 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,1,0,0,0,0|2,0,1]=4 1150 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,1,0,0,0,0|2,0,1]=4 1151 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,1,0,0,0,0|2,0,1]=4 1152 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,1,0,0,0,0|2,0,1]=4 1153 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,1,0,0,0,0|2,0,1]=4 1154 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,1,0,0,0,0|2,0,1]=4 1155 B8R0.23 O=C(O)C(=O)C[PH](=O)O Amb27218009 [0,1,0,0,0,0|3,0,0]=4 1156 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [0,1,0,0,0,0|2,0,0]=3 1157 B8R0.23 O=C(O)CC(=S)C(=O)O Amb25304511 [0,1,0,0,0,0|2,0,0]=3 1158 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,1,0,0,0,0|2,0,1]=4 1159 B8R0.23 O=C(O)CC(Cl)=C(Cl)Cl Amb2227973 [0,1,0,0,0,0|2,0,0]=3 1160 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,1,0,0,0,0|2,0,1]=4 1163 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,1,0,0,0,0|2,0,1]=4 1164 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,1,0,0,0,0|2,0,1]=4 1165 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,1,0,0,0,0|2,0,1]=4 1169 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,1,0,0,0,0|2,0,1]=4 1170 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.23 O=C(O)\C=C(/Br)C(=O)O Amb31275762 [0,1,0,0,0,0|2,0,1]=4 1172 B8R0.23 O=C(O)\C=C(/Cl)C(=O)O Amb4007497 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.23 O=C(O)\C=C(/F)C(=O)O Amb26860064 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.23 O=C(O)\C=C(/I)C(=O)O Amb10755055 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.23 O=C(O)\C=C(\Br)C(=O)O Amb25746120 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.23 O=C(O)\C=C(\F)C(=O)O Amb18124397 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [0,1,0,0,0,0|1,0,2]=4 1178 B8R0.29 CC(=N)NCS(=O)(=O)O Amb27238670 [0,1,0,0,0,0|3,0,0]=4 1179 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [0,1,0,0,0,0|1,0,2]=4 1180 B8R0.29 CC(=O)CCC(C)(C)Cl Amb27260509 [0,1,0,0,0,0|1,0,2]=4 1181 B8R0.29 CC(=O)CCC(C)(C)F Amb26512496 [0,1,0,0,0,0|1,0,2]=4 1182 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,1,0,0,0,0|1,0,2]=4 1183 B8R0.29 CC(=O)CC[N+](C)(C)C Amb4015632 [0,1,0,0,0,0|2,0,1]=4 1184 B8R0.29 CC(=O)CC[Si](C)(C)C Amb28324359 [0,1,0,0,0,0|1,1,1]=4 1185 B8R0.29 CC(=O)CC[Si](C)(C)Cl Amb27828965 [0,1,0,0,0,0|1,1,1]=4 1186 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,0|2,0,1]=4 1187 B8R0.29 CC(=O)COC(C)(C)C Amb9666858 [0,1,0,0,0,0|2,0,1]=4 1188 B8R0.29 CC(=O)COP(C)(C)=O Amb27749793 [0,1,0,0,0,0|3,0,0]=4 1189 B8R0.29 CC(=O)CO[Si](C)(C)C Amb28202264 [0,1,0,0,0,0|2,1,0]=4 1190 B8R0.29 CC(=O)CSC(C)(C)C Amb4165959 [0,1,0,0,0,0|2,0,1]=4 1191 B8R0.29 CC(=O)NCP(=O)(O)O Amb26515978 [0,1,0,0,0,0|3,0,0]=4 1192 B8R0.29 CC(=O)\C=C/C(C)(C)C Amb28202021 [0,1,0,0,0,0|1,0,2]=4 1193 B8R0.29 CC(=O)\C=C/[Si](C)(C)C Amb27762902 [0,1,0,0,0,0|1,1,1]=4 1194 B8R0.29 CC(=O)\C=C\C(C)(C)C Amb26512040 [0,1,0,0,0,0|1,0,2]=4 1195 B8R0.29 CC(=O)\C=C\C(C)(C)F Amb33271799 [0,1,0,0,0,0|1,0,2]=4 1196 B8R0.29 CC(=O)\C=C\[Si](C)(C)F Amb26413317 [0,1,0,0,0,0|1,1,1]=4 1197 B8R0.29 CC(=O)\C=C\[Si](C)(C)O Amb26515836 [0,1,0,0,0,0|1,1,1]=4 1198 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,1,0,0,0,0|0,0,2]=3 1199 B8R0.29 CC(C)(C)C#CC(=O)O Amb33545064 [0,1,0,0,0,0|0,0,3]=4 1200 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,1,0,0,0,0|1,0,2]=4 1201 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,1,0,0,0,0|0,0,2]=3 1202 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [0,1,0,0,0,0|1,0,2]=4 1203 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,0|2,0,1]=4 1204 B8R0.29 CC(C)(C)NCC(=O)Cl Amb26459118 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,1,0,0,0,0|1,0,1]=3 1206 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,1,0,0,0,0|1,0,1]=3 1207 B8R0.29 CC(C)(C)NCC(N)=O Amb6714542 [0,1,0,0,0,0|2,0,1]=4 1208 B8R0.29 CC(C)(C)OCC(=O)Cl Amb33552858 [0,1,0,0,0,0|2,0,1]=4 1209 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,1,0,0,0,0|1,0,1]=3 1210 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,1,0,0,0,0|2,0,1]=4 1211 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,1,0,0,0,0|1,0,1]=3 1212 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,1,0,0,0,0|1,0,1]=3 1213 B8R0.29 CC(C)(C)\C=C\C(=O)O Amb30585155 [0,1,0,0,0,0|0,0,2]=3 1214 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,1,0,0,0,0|0,0,2]=3 1215 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,1,0,0,0,0|0,0,2]=3 1216 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,1,0,0,0,0|1,0,1]=3 1217 B8R0.29 CC(C)(F)\C=C\C(=O)O Amb33272218 [0,1,0,0,0,0|0,0,2]=3 1218 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,1,0,0,0,0|0,0,2]=3 1219 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,1,0,0,0,0|0,0,2]=3 1220 B8R0.29 CC(C)(N)\C=C\C(=O)O Amb26640960 [0,1,0,0,0,0|0,0,2]=3 1221 B8R0.29 CC(C)(O)C#CC(=O)O Amb6364820 [0,1,0,0,0,0|0,0,3]=4 1222 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [0,1,0,0,0,0|0,0,3]=4 1223 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [0,1,0,0,0,0|1,0,2]=4 1224 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,1,0,0,0,0|0,0,2]=3 1225 B8R0.29 CC(C)=CCC(C)(O)O Amb27768703 [0,1,0,0,0,0|0,0,2]=3 1226 B8R0.29 CC(C)=CCS(=O)(=O)Cl Amb28285308 [0,1,0,0,0,0|1,0,1]=3 1227 B8R0.29 CC(C)=CC[Si](C)(C)C Amb19893822 [0,1,0,0,0,0|2,1,0]=4 1228 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,1,0,0,0,0|1,0,2]=4 1229 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,1,0,0,0,0|2,0,1]=4 1230 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,1,0,0,0,0|1,0,2]=4 1231 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.29 CC(F)(F)\C=C\C(=O)O Amb22295928 [0,1,0,0,0,0|1,0,2]=4 1233 B8R0.29 CN(C)CCP(=O)(O)O Amb26639131 [0,1,0,0,0,0|2,0,1]=4 1234 B8R0.29 CN(C)CCS(=O)(=O)O Amb25875615 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [0,1,0,0,0,0|2,0,1]=4 1236 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [0,1,0,0,0,0|3,0,0]=4 1237 B8R0.29 CS(=N)(=O)NCC(=O)O Amb35687837 [0,1,0,0,0,0|3,0,0]=4 1238 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [0,1,0,0,0,0|2,0,1]=4 1239 B8R0.29 CS(=O)(=O)NCC(=O)O Amb1120433 [0,1,0,0,0,0|3,0,0]=4 1240 B8R0.29 CS(=O)(=O)OCC(=O)O Amb25783884 [0,1,0,0,0,0|3,0,0]=4 1241 B8R0.29 CS(=O)(=O)SCC(=O)O Amb17610576 [0,1,0,0,0,0|3,0,0]=4 1242 B8R0.29 CS(=O)(=O)\C=C\C(=O)O Amb23511152 [0,1,0,0,0,0|2,0,1]=4 1243 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [0,1,0,0,0,0|2,0,0]=3 1244 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,1,0,0,0,0|1,0,1]=3 1245 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,1,0,0,0,0|1,0,1]=3 1246 B8R0.29 C[N+](C)(C)CCC(=O)[O-] Amb26420871 [0,1,0,0,0,0|1,0,2]=4 1247 B8R0.29 C[N+](C)(C)\C=C\C(=O)[O-] Amb26944755 [0,1,0,0,0,0|1,0,2]=4 1248 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,1,0,0,0,0|1,0,1]=3 1249 B8R0.29 C[Si](C)(C)C#CC(=O)O Amb2721672 [0,1,0,0,0,0|0,1,2]=4 1250 B8R0.29 C[Si](C)(C)CCC(=O)Cl Amb27187901 [0,1,0,0,0,0|1,1,1]=4 1251 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,0,0,1,0,0|1,0,2]=4 1252 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,0|1,0,0]=2 1253 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,0,0,1,0,0|2,0,1]=4 1254 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,0,0,1,0,0|2,0,1]=4 1255 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,0,0,1,0,0|2,0,1]=4 1256 B8R1.3 CC1=CNC(=O)C=C1 Amb18039971 [0,0,0,1,0,0|1,0,2]=4 1257 B8R1.3 CC1=CNC(=O)C=N1 Amb22489545 [0,0,0,1,0,0|3,0,0]=4 1258 B8R1.3 CC1=CNC(=O)CO1 Amb27390806 [0,0,0,1,0,0|2,0,1]=4 1259 B8R1.3 CC1=CNC(=O)N=C1 Amb21964512 [0,0,0,1,0,0|2,0,1]=4 1260 B8R1.3 CC1=COC(=O)C=C1 Amb27595539 [0,0,0,1,0,0|0,0,2]=3 1261 B8R1.3 CC1=NNC(=O)C=C1 Amb18372841 [0,0,0,1,0,0|2,0,1]=4 1262 B8R1.3 CC1=NNC(=O)C=C1 Amb19373006 [0,0,0,1,0,0|2,0,1]=4 1263 B8R1.3 CC1=NNC(=O)C=C1 Amb19894726 [0,0,0,1,0,0|2,0,1]=4 1264 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,0,0,1,0,0|2,0,1]=4 1265 B8R1.3 CC1=NNC(=O)NC1 Amb3777345 [0,0,0,1,0,0|3,0,0]=4 1266 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,0,0,1,0,0|1,0,2]=4 1267 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,0,0,1,0,0|1,0,2]=4 1268 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,0,0,1,0,0|2,0,1]=4 1269 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,0,0,1,0,0|2,0,1]=4 1270 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,0|2,0,1]=4 1271 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,0,0,1,0,0|2,0,1]=4 1272 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,0|1,0,2]=4 1273 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,0,0,1,0,0|0,0,2]=3 1274 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,0|2,0,1]=4 1275 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,0,0,1,0,0|2,0,1]=4 1276 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,0|2,0,1]=4 1277 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,0,0,1,0,0|2,0,1]=4 1278 B8R1.3 CN1CCC(=O)CC1 Amb2725656 [0,0,0,1,0,0|2,0,1]=4 1279 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,0,0,1,0,0|1,0,2]=4 1280 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,0|2,0,1]=4 1281 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,0,0,1,0,0|0,0,2]=3 1282 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,0|2,0,1]=4 1283 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,0|2,0,1]=4 1284 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,0,0,1,0,0|2,0,1]=4 1285 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,0,0,1,0,0|1,0,2]=4 1286 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,0|2,0,1]=4 1287 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,0|2,0,1]=4 1288 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,0|2,0,1]=4 1289 B8R1.3 Cc1ccc(O)cc1 Amb2793057 [0,0,0,1,0,0|1,0,2]=4 1290 B8R1.3 Cc1ccc(O)cn1 Amb2609944 [0,0,0,1,0,0|2,0,1]=4 1291 B8R1.3 Cc1ccc(O)nc1 Amb2722524 [0,0,0,1,0,0|1,0,2]=4 1292 B8R1.3 Cc1ccc(O)nc1 Amb35826776 [0,0,0,1,0,0|1,0,2]=4 1293 B8R1.3 Cc1ccc(O)nn1 Amb2794468 [0,0,0,1,0,0|2,0,1]=4 1294 B8R1.3 Cc1cnc(O)nc1 Amb21961467 [0,0,0,1,0,0|2,0,1]=4 1295 B8R1.3 Cc1cnc(O)nc1 Amb8630426 [0,0,0,1,0,0|2,0,1]=4 1296 B8R1.3 O=C1C=CC(Cl)=CO1 Amb20247269 [0,0,0,1,0,0|1,0,2]=4 1297 B8R1.3 O=C1C=CC(I)=CO1 Amb20247268 [0,0,0,1,0,0|1,0,2]=4 1298 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,0,0,1,0,0|2,0,1]=4 1299 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,0,0,1,0,0|2,0,1]=4 1300 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,0,0,1,0,0|1,0,1]=3 1301 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,0,0,1,0,0|1,0,2]=4 1302 B8R1.3 O=C1CNC(=O)CN1 Amb1011605 [0,0,0,1,0,0|3,0,0]=4 1303 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [0,0,0,1,0,0|2,0,0]=3 1304 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [0,0,0,1,0,0|2,0,0]=3 1305 B8R1.3 O=c1ccc(Br)co1 Amb22231971 [0,0,0,1,0,0|1,0,2]=4 1306 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,0,0,1,0,0|0,0,2]=3 1307 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,0,0,1,0,0|1,0,2]=4 1308 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 1309 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,0,0,1,0,0|1,0,2]=4 1310 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,0,0,1,0,0|1,0,2]=4 1311 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,0|0,0,2]=3 1312 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,0,0,1,0,0|0,0,2]=3 1313 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,0|0,0,2]=3 1314 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,0|1,0,2]=4 1315 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,0|1,0,2]=4 1316 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,0|1,0,2]=4 1317 B8R1.23 C=C(C)C1CC(=O)N1 Amb27858929 [0,0,0,1,0,0|1,0,2]=4 1318 B8R1.23 C=C(C)[C@@H]1CC(=O)N1 Amb28251769 [0,0,0,1,0,0|1,0,2]=4 1319 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [0,0,0,1,0,0|1,0,2]=4 1320 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,0,0,1,0,0|0,0,2]=3 1321 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [0,0,0,1,0,0|1,0,2]=4 1322 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [0,0,0,1,0,0|1,0,2]=4 1323 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,0,0,1,0,0|1,0,2]=4 1324 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,0,0,1,0,0|1,0,0]=2 1325 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [0,0,0,1,0,0|2,0,1]=4 1326 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,0,0,1,0,0|1,0,2]=4 1327 B8R1.23 CC(=O)N1CC(=O)C1 Amb22896668 [0,0,0,1,0,0|3,0,0]=4 1328 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,0,0,1,0,0|1,0,2]=4 1329 B8R1.23 CC(C)C1=CC(=O)C1 Amb27948687 [0,0,0,1,0,0|1,0,1]=3 1330 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,0,0,1,0,0|1,0,2]=4 1331 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,0,0,1,0,0|1,0,2]=4 1332 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,0,0,1,0,0|1,0,2]=4 1333 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,0,0,1,0,0|1,0,2]=4 1334 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,0,0,1,0,0|0,0,2]=3 1335 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,0,0,1,0,0|1,0,1]=3 1336 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,0,0,1,0,0|1,0,1]=3 1337 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,0,0,1,0,0|1,0,2]=4 1338 B8R1.23 CN(C)C1CC(=O)C1 Amb34159682 [0,0,0,1,0,0|2,0,1]=4 1339 B8R1.23 CN1CC(C(=O)Cl)C1 Amb35781982 [0,0,0,1,0,0|2,0,1]=4 1340 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,0,0,1,0,0|1,0,1]=3 1341 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,0,0,1,0,0|1,0,1]=3 1342 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,0,0,1,0,0|1,0,1]=3 1343 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,0,0,1,0,0|1,0,1]=3 1344 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,0,0,1,0,0|1,0,1]=3 1345 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,0,0,1,0,0|0,0,2]=3 1346 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,0,0,1,0,0|0,0,2]=3 1347 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [0,0,0,1,0,0|3,0,0]=4 1348 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,0,0,1,0,0|1,0,2]=4 1349 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,0,0,1,0,0|1,0,2]=4 1350 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,0,0,1,0,0|1,0,2]=4 1351 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,0,0,1,0,0|1,0,2]=4 1352 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,0,0,1,0,0|1,0,2]=4 1353 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,0,0,1,0,0|1,0,2]=4 1354 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,0,0,1,0,0|1,0,2]=4 1355 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,0,0,1,0,0|1,0,2]=4 1356 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,0|1,0,2]=4 1357 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,0,0,1,0,0|1,0,2]=4 1358 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,0,0,1,0,0|2,0,1]=4 1359 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,0,0,1,0,0|1,0,2]=4 1360 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,0,0,1,0,0|1,0,2]=4 1361 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,0,0,1,0,0|1,0,2]=4 1362 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,0,0,1,0,0|1,0,2]=4 1363 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,0,0,1,0,0|1,0,2]=4 1364 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,0,0,1,0,0|1,0,2]=4 1365 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,0,0,1,0,0|1,0,2]=4 1366 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,0,0,1,0,0|1,0,2]=4 1367 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [0,0,0,1,0,0|2,0,1]=4 1368 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,0,0,1,0,0|1,0,1]=3 1369 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,0,0,1,0,0|2,0,0]=3 1370 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,0,0,1,0,0|2,0,0]=3 1371 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [0,0,0,1,0,0|3,0,0]=4 1372 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,0,0,1,0,0|2,0,0]=3 1373 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,0,0,1,0,0|2,0,0]=3 1374 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|1,0,2]=4 1375 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,0,0,1,0,0|2,0,1]=4 1376 B8R1.35 CC(=O)\C=C\C1CC1 Amb32955627 [0,0,0,1,0,0|1,0,2]=4 1377 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,0,0,1,0,0|1,0,2]=4 1378 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,1]=4 1379 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,0,0,1,0,0|2,0,1]=4 1380 B8R1.35 NC(=O)\C=C/C1CC1 Amb27422387 [0,0,0,1,0,0|1,0,2]=4 1381 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,2]=4 1382 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|0,0,3]=4 1383 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,0,0,1,0,0|0,0,2]=3 1384 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,0,0,1,0,0|0,0,2]=3 1385 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,0,0,1,0,0|1,0,2]=4 1386 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,0,0,1,0,0|1,0,1]=3 1387 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,0,0,1,0,0|1,0,1]=3 1388 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,0,0,1,0,0|1,0,1]=3 1389 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,0,0,1,0,0|1,0,1]=3 1390 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,0,0,1,0,0|0,0,2]=3 1391 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|0,0,2]=3 1392 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,0,0,1,0,0|0,0,2]=3 1393 B8R1.35 O=C(O)\C=C\C1CO1 Amb24548089 [0,0,0,1,0,0|1,0,2]=4 1394 B8R1.51 CC1(C)C=CC(=O)C1 Amb15693471 [0,0,0,1,0,0|1,0,2]=4 1395 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,0|2,0,1]=4 1396 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,0,0,1,0,0|2,0,1]=4 1397 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,0,0,1,0,0|2,0,1]=4 1398 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,0,0,1,0,0|1,0,2]=4 1399 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,0,0,1,0,0|1,0,2]=4 1400 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,0,0,1,0,0|0,0,2]=3 1401 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,0,0,1,0,0|1,0,2]=4 1402 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,0|1,0,2]=4 1403 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,0,0,1,0,0|2,0,1]=4 1404 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,0,0,1,0,0|2,0,1]=4 1405 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,0,0,1,0,0|1,0,1]=3 1406 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,0,0,1,0,0|1,0,1]=3 1407 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,0,0,1,0,0|1,0,2]=4 1408 B8R1.51 CC1(O)C=CC(=O)O1 Amb26551626 [0,0,0,1,0,0|1,0,2]=4 1409 B8R1.51 CC1=CCP(=O)(Cl)C1 Amb28143876 [0,0,0,1,0,0|2,0,0]=3 1410 B8R1.51 CC1=CCP(C)(=O)C1 Amb25127881 [0,0,0,1,0,0|2,0,0]=3 1411 B8R1.51 CC1=CCS(=O)(=O)C1 Amb1419574 [0,0,0,1,0,0|1,0,1]=3 1412 B8R1.51 CC1=CC[Si](Cl)(Cl)C1 Amb27237690 [0,0,0,1,0,0|2,1,0]=4 1413 B8R1.51 C[Si]1(C)CCC(=O)C1 Amb29837969 [0,0,0,1,0,0|1,1,1]=4 1414 B8R1.51 O=S1(=O)CC=C(Cl)C1 Amb1153289 [0,0,0,1,0,0|2,0,1]=4 1415 B8R1.51 [NH3+]C1=CCS(=O)(=O)C1 Amb2797276 [0,0,0,1,0,0|2,0,1]=4 1416 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|1,0,2]=4 1417 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,0,0,1,0,0|2,0,1]=4 1418 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|1,0,2]=4 1419 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,0,0,1,0,0|1,0,2]=4 1420 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|0,0,2]=3 1421 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,0,0,1,0,0|1,0,2]=4 1422 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|0,0,2]=3 1423 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,0,0,1,0,0|1,0,2]=4 1424 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,0,0,1,0,0|1,0,2]=4 1425 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|1,0,1]=3 1426 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,0,0,1,0,0|2,0,1]=4 1427 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|1,0,2]=4 1428 B6R0.2 C=C(Br)CC(C)C Amb22583739 [0,0,0,0,1,0|2,0,1]=4 1429 B6R0.2 C=C(C)C=C(C)C Amb8513505 [0,0,0,0,1,0|2,0,0]=3 1430 B6R0.2 C=C(C)CC(=C)C Amb25887934 [0,0,0,0,1,0|2,0,1]=4 1431 B6R0.2 C=C(C)CC(=N)N Amb33199196 [0,0,0,0,1,0|2,0,1]=4 1432 B6R0.2 C=C(C)CC(=O)O Amb6278832 [0,0,0,0,1,0|0,0,1]=2 1433 B6R0.2 C=C(C)CC(C)=O Amb17593075 [0,0,0,0,1,0|1,0,1]=3 1434 B6R0.2 C=C(C)CC(C)C Amb4019530 [0,0,0,0,1,0|2,0,1]=4 1435 B6R0.2 C=C(C)CC(C)O Amb17593083 [0,0,0,0,1,0|1,0,2]=4 1436 B6R0.2 C=C(C)CC(N)=S Amb33199195 [0,0,0,0,1,0|1,1,1]=4 1437 B6R0.2 C=C(C)CN(C)C Amb25747292 [0,0,0,0,1,0|3,0,0]=4 1438 B6R0.2 C=C(C)CN(C)O Amb33199952 [0,0,0,0,1,0|2,0,1]=4 1439 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [0,0,0,0,1,0|1,0,2]=4 1440 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [0,0,0,0,1,0|1,0,2]=4 1441 B6R0.2 C=C(C)C[N+](=O)[O-] Amb33199532 [0,0,0,0,1,0|1,0,2]=4 1442 B6R0.2 C=C(C)OC(C)=O Amb6608981 [0,0,0,0,1,0|2,0,1]=4 1443 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [0,0,0,0,1,0|1,0,1]=3 1444 B6R0.2 C=C(Cl)CN(C)C Amb27425092 [0,0,0,0,1,0|3,0,0]=4 1445 B6R0.2 C=C(I)CC(=O)O Amb27598435 [0,0,0,0,1,0|1,0,1]=3 1446 B6R0.2 CC(=O)C=C(C)C Amb2793052 [0,0,0,0,1,0|1,0,0]=2 1447 B6R0.2 CC(=O)C=C(N)N Amb27788295 [0,0,0,0,1,0|3,0,0]=4 1448 B6R0.2 CC(=O)CC(=O)F Amb28122452 [0,0,0,0,1,0|2,0,0]=3 1449 B6R0.2 CC(=O)CC(=O)O Amb377432 [0,0,0,0,1,0|1,0,0]=2 1450 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [0,0,0,0,1,0|1,0,1]=3 1451 B6R0.2 CC(=O)CC(C)=O Amb2716228 [0,0,0,0,1,0|2,0,0]=3 1452 B6R0.2 CC(=O)CC(C)=S Amb28381251 [0,0,0,0,1,0|2,0,0]=3 1453 B6R0.2 CC(=O)CC(C)C Amb4605990 [0,0,0,0,1,0|1,0,1]=3 1454 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [0,0,0,0,1,0|2,0,1]=4 1455 B6R0.2 CC(=O)CC(C)N Amb22587050 [0,0,0,0,1,0|2,0,1]=4 1456 B6R0.2 CC(=O)CC(C)N Amb2583230 [0,0,0,0,1,0|2,0,1]=4 1457 B6R0.2 CC(=O)CC(C)O Amb17593091 [0,0,0,0,1,0|2,0,1]=4 1458 B6R0.2 CC(=O)CC(C)S Amb24600676 [0,0,0,0,1,0|2,0,1]=4 1459 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,1,0|2,0,1]=4 1460 B6R0.2 CC(=O)CC(N)=O Amb6608777 [0,0,0,0,1,0|2,0,0]=3 1461 B6R0.2 CC(=O)CN(C)C Amb9217324 [0,0,0,0,1,0|2,0,0]=3 1462 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [0,0,0,0,1,0|2,0,1]=4 1463 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [0,0,0,0,1,0|2,0,1]=4 1464 B6R0.2 CC(=O)C[N+](=O)[O-] Amb18833135 [0,0,0,0,1,0|2,0,1]=4 1465 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [0,0,0,0,1,0|2,0,0]=3 1466 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [0,0,0,0,1,0|3,0,0]=4 1467 B6R0.2 CC(=O)NC(C)=O Amb4066511 [0,0,0,0,1,0|3,0,0]=4 1468 B6R0.2 CC(=O)NC(C)=S Amb28246616 [0,0,0,0,1,0|3,0,0]=4 1469 B6R0.2 CC(=O)NC(C)C Amb3366263 [0,0,0,0,1,0|2,0,1]=4 1470 B6R0.2 CC(=O)NC(N)=O Amb6891959 [0,0,0,0,1,0|3,0,0]=4 1471 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,1,0|3,0,0]=4 1472 B6R0.2 CC(=O)OC(C)=O Amb2793035 [0,0,0,0,1,0|3,0,0]=4 1473 B6R0.2 CC(=O)OC(C)C Amb3940484 [0,0,0,0,1,0|2,0,1]=4 1474 B6R0.2 CC(=O)OC(N)=O Amb28283882 [0,0,0,0,1,0|3,0,0]=4 1475 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [0,0,0,0,1,0|2,1,0]=4 1476 B6R0.2 CC(=O)SC(=O)Cl Amb32679653 [0,0,0,0,1,0|3,0,0]=4 1477 B6R0.2 CC(=O)SC(C)=O Amb4025813 [0,0,0,0,1,0|3,0,0]=4 1478 B6R0.2 CC(=O)[CH-]C(C)=O Amb34196937 [0,0,0,0,1,0|2,0,1]=4 1479 B6R0.2 CC(=O)[CH-]C(C)=O Amb9787378 [0,0,0,0,1,0|2,0,1]=4 1480 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [0,0,0,0,1,0|2,0,0]=3 1481 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [0,0,0,0,1,0|2,0,0]=3 1482 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [0,0,0,0,1,0|2,0,0]=3 1483 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [0,0,0,0,1,0|2,0,0]=3 1484 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [0,0,0,0,1,0|2,0,0]=3 1485 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [0,0,0,0,1,0|2,0,0]=3 1486 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [0,0,0,0,1,0|2,0,0]=3 1487 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [0,0,0,0,1,0|2,0,0]=3 1488 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [0,0,0,0,1,0|2,0,0]=3 1489 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [0,0,0,0,1,0|2,0,0]=3 1490 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [0,0,0,0,1,0|2,0,0]=3 1491 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [0,0,0,0,1,0|2,0,0]=3 1492 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [0,0,0,0,1,0|2,0,0]=3 1493 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [0,0,0,0,1,0|2,0,0]=3 1494 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [0,0,0,0,1,0|2,0,0]=3 1495 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [0,0,0,0,1,0|2,0,0]=3 1496 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [0,0,0,0,1,0|2,0,0]=3 1497 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [0,0,0,0,1,0|2,0,0]=3 1498 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [0,0,0,0,1,0|2,0,0]=3 1499 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [0,0,0,0,1,0|2,0,0]=3 1500 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [0,0,0,0,1,0|2,0,0]=3 1501 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [0,0,0,0,1,0|2,0,0]=3 1502 B6R0.2 CC(=O)\N=C(/C)N Amb27796085 [0,0,0,0,1,0|3,0,0]=4 1503 B6R0.2 CC(=S)CC(=O)O Amb28067768 [0,0,0,0,1,0|1,0,0]=2 1504 B6R0.2 CC(Br)CC(=O)O Amb8517108 [0,0,0,0,1,0|1,0,1]=3 1505 B6R0.2 CC(C)=CB(O)O Amb2455988 [0,0,0,0,1,0|1,0,1]=3 1506 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [0,0,0,0,1,0|1,0,0]=2 1507 B6R0.2 CC(C)=CC(=O)O Amb1485519 [0,0,0,0,1,0|0,0,0]=1 1508 B6R0.2 CC(C)=CC(C)C Amb4016282 [0,0,0,0,1,0|2,0,1]=4 1509 B6R0.2 CC(C)=CC(C)Cl Amb27841415 [0,0,0,0,1,0|2,0,1]=4 1510 B6R0.2 CC(C)=CC(C)N Amb27258040 [0,0,0,0,1,0|2,0,1]=4 1511 B6R0.2 CC(C)=CC(C)O Amb22229846 [0,0,0,0,1,0|1,0,1]=3 1512 B6R0.2 CC(C)=CC(N)=O Amb10561758 [0,0,0,0,1,0|1,0,0]=2 1513 B6R0.2 CC(C)=CC(N)=S Amb18108367 [0,0,0,0,1,0|1,1,0]=3 1514 B6R0.2 CC(C)=CN(C)C Amb4017579 [0,0,0,0,1,0|3,0,0]=4 1515 B6R0.2 CC(C)=CP(Cl)Cl Amb4297320 [0,0,0,0,1,0|3,0,0]=4 1516 B6R0.2 CC(C)=C[C@@H](C)N Amb27405038 [0,0,0,0,1,0|2,0,1]=4 1517 B6R0.2 CC(C)=C[N+](=O)[O-] Amb22167019 [0,0,0,0,1,0|1,0,1]=3 1518 B6R0.2 CC(C)=NS(C)=O Amb35685212 [0,0,0,0,1,0|3,0,0]=4 1519 B6R0.2 CC(C)CB(O)O Amb2447316 [0,0,0,0,1,0|1,0,2]=4 1520 B6R0.2 CC(C)CC(=N)N Amb10066934 [0,0,0,0,1,0|2,0,1]=4 1521 B6R0.2 CC(C)CC(=N)N Amb2696279 [0,0,0,0,1,0|2,0,1]=4 1522 B6R0.2 CC(C)CC(=O)Br Amb26486664 [0,0,0,0,1,0|1,0,1]=3 1523 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [0,0,0,0,1,0|1,0,1]=3 1524 B6R0.2 CC(C)CC(=O)F Amb32667643 [0,0,0,0,1,0|1,0,1]=3 1525 B6R0.2 CC(C)CC(=O)O Amb3939848 [0,0,0,0,1,0|0,0,1]=2 1526 B6R0.2 CC(C)CC(C)O Amb6608920 [0,0,0,0,1,0|1,0,2]=4 1527 B6R0.2 CC(C)CC(N)=O Amb2722931 [0,0,0,0,1,0|1,0,1]=3 1528 B6R0.2 CC(C)CC(N)=S Amb6246355 [0,0,0,0,1,0|1,1,1]=4 1529 B6R0.2 CC(C)CC(N)O Amb28383510 [0,0,0,0,1,0|1,0,2]=4 1530 B6R0.2 CC(C)CC(O)O Amb27207854 [0,0,0,0,1,0|0,0,3]=4 1531 B6R0.2 CC(C)CN(C)O Amb33360311 [0,0,0,0,1,0|2,0,1]=4 1532 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [0,0,0,0,1,0|2,0,1]=4 1533 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [0,0,0,0,1,0|1,0,2]=4 1534 B6R0.2 CC(C)CS(C)=O Amb27972160 [0,0,0,0,1,0|2,0,1]=4 1535 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,1,0|2,0,1]=4 1536 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [0,0,0,0,1,0|1,0,2]=4 1537 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [0,0,0,0,1,0|1,0,2]=4 1538 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [0,0,0,0,1,0|1,0,2]=4 1539 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [0,0,0,0,1,0|2,0,1]=4 1540 B6R0.2 CC(C)NC(=O)S Amb27817487 [0,0,0,0,1,0|1,1,1]=4 1541 B6R0.2 CC(C)NC(N)=O Amb1104587 [0,0,0,0,1,0|2,0,1]=4 1542 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [0,0,0,0,1,0|2,0,1]=4 1543 B6R0.2 CC(C)OC(N)=O Amb4017684 [0,0,0,0,1,0|2,0,1]=4 1544 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,1,0|2,0,1]=4 1545 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [0,0,0,0,1,0|2,0,1]=4 1546 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [0,0,0,0,1,0|1,0,1]=3 1547 B6R0.2 CC(I)CC(=O)O Amb28398380 [0,0,0,0,1,0|1,0,1]=3 1548 B6R0.2 CC(N)CC(=O)O Amb8379759 [0,0,0,0,1,0|1,0,1]=3 1549 B6R0.2 CC(N)CC(=O)S Amb27413857 [0,0,0,0,1,0|1,1,1]=4 1550 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,1]=4 1551 B6R0.2 CC(N)CC(N)=O Amb33532770 [0,0,0,0,1,0|2,0,1]=4 1552 B6R0.2 CC(O)CC(=O)O Amb8513187 [0,0,0,0,1,0|1,0,1]=3 1553 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [0,0,0,0,1,0|1,0,2]=4 1554 B6R0.2 CC(O)CC(N)=O Amb26394320 [0,0,0,0,1,0|2,0,1]=4 1555 B6R0.2 CC(O)CN(C)C Amb8513140 [0,0,0,0,1,0|2,0,1]=4 1556 B6R0.2 CC(O)C[NH+](C)C Amb33934480 [0,0,0,0,1,0|2,0,1]=4 1557 B6R0.2 CC(S)CC(=O)O Amb33538201 [0,0,0,0,1,0|1,0,1]=3 1558 B6R0.2 CN(C)CC(=N)N Amb10610521 [0,0,0,0,1,0|3,0,0]=4 1559 B6R0.2 CN(C)CC(=N)N Amb10610536 [0,0,0,0,1,0|3,0,0]=4 1560 B6R0.2 CN(C)CC(=N)N Amb4297035 [0,0,0,0,1,0|3,0,0]=4 1561 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,1,0|2,0,0]=3 1562 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [0,0,0,0,1,0|2,0,0]=3 1563 B6R0.2 CN(C)CC(=O)O Amb3319051 [0,0,0,0,1,0|1,0,0]=2 1564 B6R0.2 CN(C)CC(=O)O Amb3940366 [0,0,0,0,1,0|1,0,0]=2 1565 B6R0.2 CN(C)CC(N)=O Amb17231806 [0,0,0,0,1,0|2,0,0]=3 1566 B6R0.2 CN(C)CC(N)=O Amb33321491 [0,0,0,0,1,0|2,0,0]=3 1567 B6R0.2 CN(C)CC(N)=S Amb16232219 [0,0,0,0,1,0|2,1,0]=4 1568 B6R0.2 CN(C)CC(N)=S Amb19373088 [0,0,0,0,1,0|2,1,0]=4 1569 B6R0.2 CN(C)CC(N)=S Amb21912622 [0,0,0,0,1,0|2,1,0]=4 1570 B6R0.2 CN(C)CC(N)=S Amb534722 [0,0,0,0,1,0|2,1,0]=4 1571 B6R0.2 CN(C)NC(=O)Cl Amb35637051 [0,0,0,0,1,0|3,0,0]=4 1572 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,1,0|3,0,0]=4 1573 B6R0.2 CN(N)CC(=O)O Amb23592296 [0,0,0,0,1,0|2,0,0]=3 1574 B6R0.2 CN(O)CC(=O)O Amb29838290 [0,0,0,0,1,0|2,0,0]=3 1575 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,1,0|3,0,0]=4 1576 B6R0.2 CS(C)=NC(N)=O Amb27837994 [0,0,0,0,1,0|3,0,0]=4 1577 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [0,0,0,0,1,0|1,0,1]=3 1578 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [0,0,0,0,1,0|1,0,1]=3 1579 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [0,0,0,0,1,0|1,0,1]=3 1580 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [0,0,0,0,1,0|1,0,1]=3 1581 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [0,0,0,0,1,0|1,0,1]=3 1582 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [0,0,0,0,1,0|1,0,2]=4 1583 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [0,0,0,0,1,0|2,0,1]=4 1584 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [0,0,0,0,1,0|1,0,1]=3 1585 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [0,0,0,0,1,0|1,0,1]=3 1586 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [0,0,0,0,1,0|1,0,1]=3 1587 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [0,0,0,0,1,0|2,0,1]=4 1588 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [0,0,0,0,1,0|1,0,1]=3 1589 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,1,0|2,0,0]=3 1590 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [0,0,0,0,1,0|1,0,0]=2 1591 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [0,0,0,0,1,0|1,0,0]=2 1592 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [0,0,0,0,1,0|1,0,1]=3 1593 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [0,0,0,0,1,0|1,0,0]=2 1594 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [0,0,0,0,1,0|1,0,0]=2 1595 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [0,0,0,0,1,0|1,0,0]=2 1596 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [0,0,0,0,1,0|1,0,0]=2 1597 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [0,0,0,0,1,0|1,0,0]=2 1598 B6R0.2 C\C(I)=C\C(N)=O Amb28058366 [0,0,0,0,1,0|2,0,0]=3 1599 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [0,0,0,0,1,0|1,0,0]=2 1600 B6R0.2 C\C(N)=C/C(N)=O Amb26600164 [0,0,0,0,1,0|2,0,0]=3 1601 B6R0.2 C\C(N)=C/[N+](=O)[O-] Amb32416117 [0,0,0,0,1,0|2,0,1]=4 1602 B6R0.2 C\C(N)=C\C(N)=S Amb19929130 [0,0,0,0,1,0|2,1,0]=4 1603 B6R0.2 C\C(N)=C\[N+](=O)[O-] Amb28130569 [0,0,0,0,1,0|2,0,1]=4 1604 B6R0.2 C\C(S)=C\C(N)=O Amb27596108 [0,0,0,0,1,0|2,0,0]=3 1605 B6R0.2 C\C([O-])=C\[N+](=O)[O-] Amb22549288 [0,0,0,0,1,0|2,0,1]=4 1606 B6R0.2 N=C(N)CC(N)=O Amb1981332 [0,0,0,0,1,0|3,0,0]=4 1607 B6R0.2 N=C(N)CC(N)=O Amb5719691 [0,0,0,0,1,0|3,0,0]=4 1608 B6R0.2 N=C([NH3+])CC(N)=O Amb2439350 [0,0,0,0,1,0|3,0,0]=4 1609 B6R0.2 NC(=O)CC(=O)O Amb4034884 [0,0,0,0,1,0|2,0,0]=3 1610 B6R0.2 NC(=O)CC(=O)[O-] Amb22263088 [0,0,0,0,1,0|2,0,1]=4 1611 B6R0.2 NC(=O)CC(N)=O Amb1971463 [0,0,0,0,1,0|3,0,0]=4 1612 B6R0.2 NC(=O)CC(N)=S Amb1155422 [0,0,0,0,1,0|3,0,0]=4 1613 B6R0.2 NC(=S)CC(=O)O Amb17465742 [0,0,0,0,1,0|2,0,0]=3 1614 B6R0.2 NC(N)=CC(=O)O Amb27618962 [0,0,0,0,1,0|2,0,0]=3 1615 B6R0.2 NC(S)CC(=O)O Amb27391244 [0,0,0,0,1,0|2,0,1]=4 1616 B6R0.2 O=C(Cl)CC(=O)Cl Amb3940237 [0,0,0,0,1,0|3,0,0]=4 1617 B6R0.2 O=C(O)C=C(Br)Br Amb24435008 [0,0,0,0,1,0|2,0,0]=3 1618 B6R0.2 O=C(O)C=C(Cl)Cl Amb33544334 [0,0,0,0,1,0|2,0,0]=3 1619 B6R0.2 O=C(O)C=C(F)F Amb24116995 [0,0,0,0,1,0|2,0,0]=3 1620 B6R0.2 O=C(O)CB(O)O Amb24053058 [0,0,0,0,1,0|3,0,0]=4 1621 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [0,0,0,0,1,0|2,0,0]=3 1622 B6R0.2 O=C(O)CC(=O)O Amb2689065 [0,0,0,0,1,0|2,0,0]=3 1623 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [0,0,0,0,1,0|2,0,1]=4 1624 B6R0.2 O=C(O)CC(F)F Amb22001551 [0,0,0,0,1,0|2,0,1]=4 1625 B6R0.2 O=C(O)CS(=O)O Amb27788997 [0,0,0,0,1,0|3,0,0]=4 1626 B6R0.2 O=C(O)\C=C(\Cl)Br Amb27955839 [0,0,0,0,1,0|2,0,0]=3 1627 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516686 [0,0,0,0,1,0|2,0,1]=4 1628 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516816 [0,0,0,0,1,0|2,0,1]=4 1629 B8R0.28 C=C(C)CCC=C(C)C Amb27424700 [0,0,0,0,0,1|2,0,0]=3 1630 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,0,0,0,0,1|0,0,2]=3 1631 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,0,0,0,0,1|1,0,2]=4 1632 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,0,0,0,0,1|1,0,2]=4 1633 B8R0.28 C=C(C)CCNC(C)=O Amb27780923 [0,0,0,0,0,1|1,0,2]=4 1634 B8R0.28 C=C(C)CCOC(C)=O Amb4035107 [0,0,0,0,0,1|1,0,2]=4 1635 B8R0.28 C=C(C)CNN=C(C)C Amb27768685 [0,0,0,0,0,1|3,0,0]=4 1636 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,0,0,0,0,1|0,0,2]=3 1637 B8R0.28 C=C(C)CSCC(C)=O Amb27877304 [0,0,0,0,0,1|1,0,2]=4 1638 B8R0.28 C=C(C)C\C=C\C(=O)O Amb27602149 [0,0,0,0,0,1|0,0,2]=3 1639 B8R0.28 C=C(C)\C=C\CC(=C)C Amb26568302 [0,0,0,0,0,1|2,0,1]=4 1640 B8R0.28 C=C(C)\C=C\CC(=O)O Amb18642409 [0,0,0,0,0,1|0,0,1]=2 1641 B8R0.28 C=C(C)\C=C\CC(C)=O Amb24744667 [0,0,0,0,0,1|1,0,1]=3 1642 B8R0.28 C=C(C)\C=N\NC(N)=O Amb25146148 [0,0,0,0,0,1|2,0,1]=4 1643 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,0,0,0,0,1|1,0,2]=4 1644 B8R0.28 CC(=N)NCCC(N)=O Amb28049611 [0,0,0,0,0,1|2,0,1]=4 1645 B8R0.28 CC(=O)C#CC=C(C)C Amb25680869 [0,0,0,0,0,1|1,0,1]=3 1646 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,1|1,0,0]=2 1647 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,0,0,0,0,1|1,0,0]=2 1648 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,1|1,0,1]=3 1649 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,0,0,0,0,1|2,0,1]=4 1650 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,0,0,0,0,1|1,0,2]=4 1651 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,1|2,0,1]=4 1652 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [0,0,0,0,0,1|2,0,1]=4 1653 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [0,0,0,0,0,1|2,0,1]=4 1654 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,0,0,0,0,1|1,0,2]=4 1655 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,0,0,0,0,1|2,0,1]=4 1656 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [0,0,0,0,0,1|2,0,1]=4 1657 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,0,0,0,0,1|1,0,2]=4 1658 B8R0.28 CC(=O)CC\C=C(\C)Cl Amb17593664 [0,0,0,0,0,1|2,0,0]=3 1659 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,0,0,0,0,1|1,0,2]=4 1660 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,0,0,0,0,1|1,0,2]=4 1661 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,0,0,0,0,1|1,0,1]=3 1662 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [0,0,0,0,0,1|1,0,2]=4 1663 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,0,0,0,0,1|1,0,2]=4 1664 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,0,0,0,0,1|2,0,1]=4 1665 B8R0.28 CC(=O)C\C=C\C(C)C Amb26846089 [0,0,0,0,0,1|1,0,1]=3 1666 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,0,0,0,0,1|2,0,1]=4 1667 B8R0.28 CC(=O)C\C=C\N(C)C Amb27191796 [0,0,0,0,0,1|2,0,0]=3 1668 B8R0.28 CC(=O)NCC=C(C)C Amb26606550 [0,0,0,0,0,1|1,0,0]=2 1669 B8R0.28 CC(=O)NCC=C(Cl)Cl Amb30011085 [0,0,0,0,0,1|3,0,0]=4 1670 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,0,0,0,0,1|1,0,1]=3 1671 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,0,0,0,0,1|2,0,1]=4 1672 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [0,0,0,0,0,1|2,0,1]=4 1673 B8R0.28 CC(=O)NCNC(C)=O Amb8485453 [0,0,0,0,0,1|3,0,0]=4 1674 B8R0.28 CC(=O)NCOC(C)=O Amb27810126 [0,0,0,0,0,1|3,0,0]=4 1675 B8R0.28 CC(=O)NOCC(=O)O Amb25921073 [0,0,0,0,0,1|2,0,0]=3 1676 B8R0.28 CC(=O)N\C=C/C(C)=S Amb27472902 [0,0,0,0,0,1|2,0,1]=4 1677 B8R0.28 CC(=O)N\C=C/C(C)C Amb28437296 [0,0,0,0,0,1|1,0,2]=4 1678 B8R0.28 CC(=O)N\C=C\C(C)=S Amb27229569 [0,0,0,0,0,1|2,0,1]=4 1679 B8R0.28 CC(=O)OCC=C(C)C Amb22002433 [0,0,0,0,0,1|1,0,0]=2 1680 B8R0.28 CC(=O)OCC=C(F)F Amb16186005 [0,0,0,0,0,1|3,0,0]=4 1681 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,0,0,0,0,1|1,0,1]=3 1682 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,0,0,0,0,1|1,0,2]=4 1683 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,0,0,0,0,1|2,0,1]=4 1684 B8R0.28 CC(=O)OCCN(C)C Amb8516593 [0,0,0,0,0,1|2,0,1]=4 1685 B8R0.28 CC(=O)OCOC(=O)Cl Amb26908239 [0,0,0,0,0,1|3,0,0]=4 1686 B8R0.28 CC(=O)OCOC(C)=O Amb9787622 [0,0,0,0,0,1|3,0,0]=4 1687 B8R0.28 CC(=O)O\N=C/C(=O)O Amb27593741 [0,0,0,0,0,1|2,0,1]=4 1688 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,1|1,0,0]=2 1689 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [0,0,0,0,0,1|2,0,1]=4 1690 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,0,0,0,0,1|1,0,1]=3 1691 B8R0.28 CC(=O)SCCN(C)C Amb27607143 [0,0,0,0,0,1|2,0,1]=4 1692 B8R0.28 CC(=O)S\C=C\C(=O)O Amb26969288 [0,0,0,0,0,1|1,0,1]=3 1693 B8R0.28 CC(=O)\C=C/C=C(C)C Amb28198620 [0,0,0,0,0,1|1,0,1]=3 1694 B8R0.28 CC(=O)\C=C/CC(C)C Amb27190424 [0,0,0,0,0,1|1,0,2]=4 1695 B8R0.28 CC(=O)\C=C/C[N+](=O)[O-] Amb28322797 [0,0,0,0,0,1|2,0,1]=4 1696 B8R0.28 CC(=O)\C=C/NC(C)C Amb28388378 [0,0,0,0,0,1|1,0,2]=4 1697 B8R0.28 CC(=O)\C=C/OC(C)=O Amb28364680 [0,0,0,0,0,1|2,0,1]=4 1698 B8R0.28 CC(=O)\C=C\C=C(C)C Amb26890921 [0,0,0,0,0,1|1,0,1]=3 1699 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [0,0,0,0,0,1|1,0,0]=2 1700 B8R0.28 CC(=O)\C=C\CC(C)C Amb3354778 [0,0,0,0,0,1|1,0,2]=4 1701 B8R0.28 CC(=O)\C=C\C[N+](=O)[O-] Amb27444805 [0,0,0,0,0,1|2,0,1]=4 1702 B8R0.28 CC(=O)\C=N\OC(C)=O Amb27788385 [0,0,0,0,0,1|3,0,0]=4 1703 B8R0.28 CC(=O)\N=C\NC(C)=O Amb24541273 [0,0,0,0,0,1|3,0,0]=4 1704 B8R0.28 CC(C)=C=CCN(C)C Amb25253116 [0,0,0,0,0,1|3,0,0]=4 1705 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,0,0,0,0,1|0,0,0]=1 1706 B8R0.28 CC(C)=CCCC(C)C Amb30023884 [0,0,0,0,0,1|2,0,1]=4 1707 B8R0.28 CC(C)=CCCC(C)Cl Amb25032126 [0,0,0,0,0,1|2,0,1]=4 1708 B8R0.28 CC(C)=CCCC(C)N Amb3371996 [0,0,0,0,0,1|2,0,1]=4 1709 B8R0.28 CC(C)=CCCC(Cl)Cl Amb27400284 [0,0,0,0,0,1|2,0,1]=4 1710 B8R0.28 CC(C)=CCCC(F)F Amb35582946 [0,0,0,0,0,1|2,0,1]=4 1711 B8R0.28 CC(C)=CCC[C@@H](C)Br Amb27400323 [0,0,0,0,0,1|2,0,1]=4 1712 B8R0.28 CC(C)=CCC[C@@H](C)N Amb27404604 [0,0,0,0,0,1|2,0,1]=4 1713 B8R0.28 CC(C)=CCC[C@@H](C)O Amb22049561 [0,0,0,0,0,1|1,0,1]=3 1714 B8R0.28 CC(C)=CCC[C@H](C)N Amb27162485 [0,0,0,0,0,1|2,0,1]=4 1715 B8R0.28 CC(C)=CCC[C@H](C)O Amb22049564 [0,0,0,0,0,1|1,0,1]=3 1716 B8R0.28 CC(C)=CCN=C(N)N Amb33533591 [0,0,0,0,0,1|2,0,0]=3 1717 B8R0.28 CC(C)=CCNC(=N)N Amb28662181 [0,0,0,0,0,1|2,0,0]=3 1718 B8R0.28 CC(C)=CCNC(=N)N Amb32668840 [0,0,0,0,0,1|2,0,0]=3 1719 B8R0.28 CC(C)=CCNC(=N)N Amb5717545 [0,0,0,0,0,1|2,0,0]=3 1720 B8R0.28 CC(C)=CCNC(C)C Amb18642550 [0,0,0,0,0,1|2,0,1]=4 1721 B8R0.28 CC(C)=CC\N=C(/C)N Amb28316031 [0,0,0,0,0,1|2,0,0]=3 1722 B8R0.28 CC(C)=CNCC(C)C Amb28364333 [0,0,0,0,0,1|2,0,1]=4 1723 B8R0.28 CC(C)=C\C=C\C(=O)O Amb18642414 [0,0,0,0,0,1|0,0,1]=2 1724 B8R0.28 CC(C)=C\C=C\C(C)O Amb27956644 [0,0,0,0,0,1|1,0,2]=4 1725 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,0,0,0,0,1|1,0,0]=2 1726 B8R0.28 CC(C)=NOCC(=O)Cl Amb27466545 [0,0,0,0,0,1|2,0,0]=3 1727 B8R0.28 CC(C)=NOCC(N)=O Amb27613522 [0,0,0,0,0,1|2,0,0]=3 1728 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,0,0,0,0,1|0,0,2]=3 1729 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,0,0,0,0,1|0,0,3]=4 1730 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,0,0,0,0,1|0,0,2]=3 1731 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,0,0,0,0,1|1,0,2]=4 1732 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,0,0,0,0,1|1,0,2]=4 1733 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,0,0,0,0,1|1,0,2]=4 1734 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,0,0,0,0,1|0,0,2]=3 1735 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,0,0,0,0,1|0,0,2]=3 1736 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,0,0,0,0,1|1,0,2]=4 1737 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,0,0,0,0,1|1,0,2]=4 1738 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,0,0,0,0,1|0,0,2]=3 1739 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,0,0,0,0,1|0,0,2]=3 1740 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,0,0,0,0,1|0,0,2]=3 1741 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,0,0,0,0,1|0,0,2]=3 1742 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,0,0,0,0,1|0,0,2]=3 1743 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,0,0,0,0,1|1,0,2]=4 1744 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,0,0,0,0,1|1,0,2]=4 1745 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,0,0,0,0,1|1,0,2]=4 1746 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,0,0,0,0,1|0,0,2]=3 1747 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,0,0,0,0,1|0,0,2]=3 1748 B8R0.28 CC(C)S\C=C\C(=O)O Amb27838559 [0,0,0,0,0,1|0,0,2]=3 1749 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,0,0,0,0,1|0,0,1]=2 1750 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,0,0,0,0,1|1,0,2]=4 1751 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,0,0,0,0,1|1,0,2]=4 1752 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,0,0,0,0,1|1,0,2]=4 1753 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,0,0,0,0,1|1,0,2]=4 1754 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,0,0,0,0,1|1,0,2]=4 1755 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,0,0,0,0,1|1,0,2]=4 1756 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,0,0,0,0,1|1,0,2]=4 1757 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,0,0,0,0,1|1,0,2]=4 1758 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,0,0,0,0,1|1,0,2]=4 1759 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [0,0,0,0,0,1|2,0,1]=4 1760 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [0,0,0,0,0,1|2,0,1]=4 1761 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,0,0,0,0,1|1,0,1]=3 1762 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,0,0,0,0,1|1,0,1]=3 1763 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [0,0,0,0,0,1|2,0,1]=4 1764 B8R0.28 CN(C)CCNC(N)=O Amb1129425 [0,0,0,0,0,1|2,0,1]=4 1765 B8R0.28 CN(C)CCNC(N)=O Amb33552131 [0,0,0,0,0,1|2,0,1]=4 1766 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,0,0,0,0,1|1,1,1]=4 1767 B8R0.28 CN(C)CCOC(N)=O Amb28423955 [0,0,0,0,0,1|2,0,1]=4 1768 B8R0.28 CN(C)C\C=C/C(=O)O Amb26347338 [0,0,0,0,0,1|1,0,1]=3 1769 B8R0.28 CN(C)C\C=C/C(=O)[O-] Amb32674754 [0,0,0,0,0,1|1,0,2]=4 1770 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666591 [0,0,0,0,0,1|2,0,1]=4 1771 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666795 [0,0,0,0,0,1|2,0,1]=4 1772 B8R0.28 CN(C)C\C=C\C(=O)O Amb15695416 [0,0,0,0,0,1|1,0,1]=3 1773 B8R0.28 CN(C)C\C=C\C(=O)O Amb33716600 [0,0,0,0,0,1|1,0,1]=3 1774 B8R0.28 CN(C)C\C=C\C(=O)O Amb8395946 [0,0,0,0,0,1|1,0,1]=3 1775 B8R0.28 CN(C)C\C=C\C(N)=O Amb24476695 [0,0,0,0,0,1|2,0,1]=4 1776 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,0,0,0,0,1|2,0,1]=4 1777 B8R0.28 CN(C)\C=N\NC(N)=O Amb26416482 [0,0,0,0,0,1|3,0,0]=4 1778 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,0,0,0,0,1|1,0,2]=4 1779 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,0,0,0,0,1|1,0,1]=3 1780 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,0,0,0,0,1|1,0,2]=4 1781 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,0,0,0,0,1|1,0,1]=3 1782 B8R0.28 C\C(Cl)=C/CNC(N)=O Amb27252067 [0,0,0,0,0,1|2,0,0]=3 1783 B8R0.28 C\C(Cl)=C\CCC(C)O Amb27653025 [0,0,0,0,0,1|2,0,1]=4 1784 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [0,0,0,0,0,1|2,0,1]=4 1785 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [0,0,0,0,0,1|2,0,1]=4 1786 B8R0.28 N=C(N)NNCC(=O)O Amb27394477 [0,0,0,0,0,1|3,0,0]=4 1787 B8R0.28 N=C(N)NOCC(=O)O Amb27165927 [0,0,0,0,0,1|3,0,0]=4 1788 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [0,0,0,0,0,1|2,0,1]=4 1789 B8R0.28 N=C(N)S\C=C/C(=O)O Amb28314144 [0,0,0,0,0,1|2,0,1]=4 1790 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,0,0,0,0,1|2,0,1]=4 1791 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [0,0,0,0,0,1|2,0,1]=4 1792 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,1|2,0,1]=4 1793 B8R0.28 NC(=O)NCC=C(Cl)Cl Amb35690706 [0,0,0,0,0,1|3,0,0]=4 1794 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [0,0,0,0,0,1|2,0,1]=4 1795 B8R0.28 NC(=O)NOCC(=O)O Amb28285979 [0,0,0,0,0,1|3,0,0]=4 1796 B8R0.28 NC(=O)N\C=C/C(=O)O Amb28437236 [0,0,0,0,0,1|2,0,1]=4 1797 B8R0.28 NC(=O)N\C=C\C(=O)O Amb541061 [0,0,0,0,0,1|2,0,1]=4 1798 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [0,0,0,0,0,1|2,0,1]=4 1799 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,0,0,0,0,1|2,0,1]=4 1800 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [0,0,0,0,0,1|2,0,1]=4 1801 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [0,0,0,0,0,1|2,0,1]=4 1802 B8R0.28 NC(=S)S\C=C/C(=O)O Amb28325316 [0,0,0,0,0,1|2,0,1]=4 1803 B8R0.28 NC(=S)S\C=C\C(=O)O Amb10552410 [0,0,0,0,0,1|2,0,1]=4 1804 B8R0.28 O=C(O)C=C=CC(=O)O Amb17593335 [0,0,0,0,0,1|2,0,1]=4 1805 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,0,0,0,0,1|2,0,1]=4 1806 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,0,0,0,0,1|2,0,1]=4 1807 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,0,0,0,0,1|2,0,1]=4 1808 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,0,0,0,0,1|2,0,1]=4 1809 B8R0.28 O=C(O)\C=C/CC(=O)O Amb27882014 [0,0,0,0,0,1|2,0,0]=3 1810 B8R0.28 O=C(O)\C=C\C=C(Cl)Cl Amb27478030 [0,0,0,0,0,1|2,0,1]=4 1811 B8R0.28 O=C(O)\C=C\CC(=O)O Amb1154189 [0,0,0,0,0,1|2,0,0]=3 1812 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [0,0,0,0,0,1|2,0,1]=4 1813 B5R0.1 C#CCC(=O)O Amb33532662 [2,0,0,0,0,0|0,0,2]=4 1814 B5R0.1 C=C(C)CC=O Amb28202583 [2,0,0,0,0,0|0,0,1]=3 1815 B5R0.1 C=C(C)CCO Amb34916534 [2,0,0,0,0,0|0,0,2]=4 1816 B5R0.1 C=C(C)CCO Amb8513522 [2,0,0,0,0,0|0,0,2]=4 1817 B5R0.1 C=C(C)CNO Amb33199864 [2,0,0,0,0,0|1,0,1]=4 1818 B5R0.1 C=CC=C(C)C Amb22229813 [2,0,0,0,0,0|0,0,1]=3 1819 B5R0.1 C=CCB(O)O Amb20240823 [2,0,0,0,0,0|1,0,1]=4 1820 B5R0.1 C=CCC(=C)C Amb22347764 [2,0,0,0,0,0|1,0,1]=4 1821 B5R0.1 C=CCC(=N)N Amb2695181 [2,0,0,0,0,0|2,0,0]=4 1822 B5R0.1 C=CCC(=O)Cl Amb33543701 [2,0,0,0,0,0|1,0,0]=3 1823 B5R0.1 C=CCC(=O)O Amb3940098 [2,0,0,0,0,0|0,0,0]=2 1824 B5R0.1 C=CCC(C)=O Amb8396482 [2,0,0,0,0,0|1,0,0]=3 1825 B5R0.1 C=CCC(C)C Amb8513260 [2,0,0,0,0,0|1,0,1]=4 1826 B5R0.1 C=CCC(C)O Amb33539328 [2,0,0,0,0,0|1,0,1]=4 1827 B5R0.1 C=CCC(N)=O Amb17610156 [2,0,0,0,0,0|1,0,0]=3 1828 B5R0.1 C=CCS(=O)O Amb33534190 [2,0,0,0,0,0|1,0,0]=3 1829 B5R0.1 C=CCS(=O)[O-] Amb25810896 [2,0,0,0,0,0|1,0,1]=4 1830 B5R0.1 C=CCS(=O)[O-] Amb33527151 [2,0,0,0,0,0|1,0,1]=4 1831 B5R0.1 C=CC[C@@H](C)O Amb22225370 [2,0,0,0,0,0|1,0,1]=4 1832 B5R0.1 C=CC[C@H](C)O Amb22226758 [2,0,0,0,0,0|1,0,1]=4 1833 B5R0.1 C=CC[N+](=O)[O-] Amb24625461 [2,0,0,0,0,0|1,0,1]=4 1834 B5R0.1 C=CC[PH](=O)O Amb8391287 [2,0,0,0,0,0|1,0,0]=3 1835 B5R0.1 C=CNC(C)=O Amb24323579 [2,0,0,0,0,0|2,0,0]=4 1836 B5R0.1 C=CNC(N)=O Amb25082241 [2,0,0,0,0,0|2,0,0]=4 1837 B5R0.1 C=COC(=O)Cl Amb8514993 [2,0,0,0,0,0|2,0,0]=4 1838 B5R0.1 C=COC(C)=O Amb8513382 [2,0,0,0,0,0|2,0,0]=4 1839 B5R0.1 C=NCC(N)=O Amb26548445 [2,0,0,0,0,0|2,0,0]=4 1840 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 1841 B5R0.1 CC(=O)C=C=O Amb10603952 [2,0,0,0,0,0|1,0,1]=4 1842 B5R0.1 CC(=O)CC=N Amb28285098 [2,0,0,0,0,0|2,0,0]=4 1843 B5R0.1 CC(=O)CCO Amb836357 [2,0,0,0,0,0|1,0,1]=4 1844 B5R0.1 CC(=O)CNO Amb28049954 [2,0,0,0,0,0|2,0,0]=4 1845 B5R0.1 CC(=O)NC=O Amb27850191 [2,0,0,0,0,0|2,0,0]=4 1846 B5R0.1 CC(=O)NCO Amb8516057 [2,0,0,0,0,0|2,0,0]=4 1847 B5R0.1 CC(=O)OC=O Amb25283525 [2,0,0,0,0,0|2,0,0]=4 1848 B5R0.1 CC(=O)SCO Amb27255261 [2,0,0,0,0,0|2,0,0]=4 1849 B5R0.1 CC(=O)\C=C/N Amb25147403 [2,0,0,0,0,0|2,0,0]=4 1850 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [2,0,0,0,0,0|1,0,1]=4 1851 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [2,0,0,0,0,0|2,0,0]=4 1852 B5R0.1 CC(=O)\C=C\N Amb8395283 [2,0,0,0,0,0|2,0,0]=4 1853 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [2,0,0,0,0,0|1,0,1]=4 1854 B5R0.1 CC(=O)\C=N/O Amb26474151 [2,0,0,0,0,0|2,0,0]=4 1855 B5R0.1 CC(=O)\C=N\O Amb33719017 [2,0,0,0,0,0|2,0,0]=4 1856 B5R0.1 CC(=O)\C=N\O Amb8395285 [2,0,0,0,0,0|2,0,0]=4 1857 B5R0.1 CC(C)=C=CCl Amb27464028 [2,0,0,0,0,0|1,0,1]=4 1858 B5R0.1 CC(C)=C=CI Amb27592215 [2,0,0,0,0,0|1,0,1]=4 1859 B5R0.1 CC(C)=CC#N Amb3987520 [2,0,0,0,0,0|1,0,1]=4 1860 B5R0.1 CC(C)=CC=O Amb8385061 [2,0,0,0,0,0|0,0,0]=2 1861 B5R0.1 CC(C)=CCBr Amb3940211 [2,0,0,0,0,0|1,0,0]=3 1862 B5R0.1 CC(C)=CCCl Amb2371433 [2,0,0,0,0,0|1,0,0]=3 1863 B5R0.1 CC(C)=CCN Amb10601678 [2,0,0,0,0,0|1,0,0]=3 1864 B5R0.1 CC(C)=CCN Amb10601679 [2,0,0,0,0,0|1,0,0]=3 1865 B5R0.1 CC(C)=CCO Amb4605830 [2,0,0,0,0,0|0,0,0]=2 1866 B5R0.1 CC(C)=CCS Amb17617244 [2,0,0,0,0,0|0,1,0]=3 1867 B5R0.1 CC(C)=C[Mg]Br Amb22351756 [2,0,0,0,0,0|2,0,0]=4 1868 B5R0.1 CC(C)C=C=O Amb27858445 [2,0,0,0,0,0|0,0,2]=4 1869 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|0,0,1]=3 1870 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|0,0,2]=4 1871 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|1,0,1]=4 1872 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|1,0,1]=4 1873 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|1,0,1]=4 1874 B5R0.1 CC(C)\C=N\O Amb2455920 [2,0,0,0,0,0|1,0,1]=4 1875 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,1]=4 1876 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|1,0,1]=4 1877 B5R0.1 CCC=C(C)C Amb22336412 [2,0,0,0,0,0|0,0,1]=3 1878 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,1]=4 1879 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,1]=4 1880 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,1]=3 1881 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,2]=4 1882 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,1]=4 1883 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,1]=4 1884 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,1]=4 1885 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,1]=4 1886 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,0]=3 1887 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,0]=3 1888 B5R0.1 CN(C)CCO Amb2793033 [2,0,0,0,0,0|1,0,1]=4 1889 B5R0.1 CN(C)NC=O Amb1930732 [2,0,0,0,0,0|2,0,0]=4 1890 B5R0.1 CN(C)\C=C\N Amb26443108 [2,0,0,0,0,0|2,0,0]=4 1891 B5R0.1 CNC=C(C)C Amb28313754 [2,0,0,0,0,0|1,0,1]=4 1892 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|1,0,0]=3 1893 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|1,0,0]=3 1894 B5R0.1 CNCC(=O)[O-] Amb20246714 [2,0,0,0,0,0|1,0,1]=4 1895 B5R0.1 CNCC(C)=O Amb17621974 [2,0,0,0,0,0|2,0,0]=4 1896 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 1897 B5R0.1 CNCC(N)=O Amb19134307 [2,0,0,0,0,0|2,0,0]=4 1898 B5R0.1 CNCC(N)=O Amb3940074 [2,0,0,0,0,0|2,0,0]=4 1899 B5R0.1 CNCC(N)=O Amb9151172 [2,0,0,0,0,0|2,0,0]=4 1900 B5R0.1 COC=C(C)C Amb25063853 [2,0,0,0,0,0|1,0,1]=4 1901 B5R0.1 COCC(=O)Cl Amb3939326 [2,0,0,0,0,0|2,0,0]=4 1902 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,0]=3 1903 B5R0.1 COCC(C)=O Amb8513767 [2,0,0,0,0,0|2,0,0]=4 1904 B5R0.1 COCC(N)=O Amb1153776 [2,0,0,0,0,0|2,0,0]=4 1905 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 1906 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 1907 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 1908 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 1909 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|1,0,1]=4 1910 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [2,0,0,0,0,0|2,0,0]=4 1911 B5R0.1 C\C(Br)=C/C=O Amb27202112 [2,0,0,0,0,0|1,0,0]=3 1912 B5R0.1 C\C(Br)=C/CO Amb30621790 [2,0,0,0,0,0|1,0,0]=3 1913 B5R0.1 C\C(Br)=C\C=O Amb27201671 [2,0,0,0,0,0|1,0,0]=3 1914 B5R0.1 C\C(Cl)=C/CCl Amb25917865 [2,0,0,0,0,0|2,0,0]=4 1915 B5R0.1 C\C(Cl)=C\CCl Amb24564316 [2,0,0,0,0,0|2,0,0]=4 1916 B5R0.1 C\C(Cl)=C\CI Amb27185852 [2,0,0,0,0,0|2,0,0]=4 1917 B5R0.1 C\C(Cl)=C\CN Amb2693573 [2,0,0,0,0,0|2,0,0]=4 1918 B5R0.1 C\C(Cl)=C\CO Amb25663061 [2,0,0,0,0,0|1,0,0]=3 1919 B5R0.1 C\C(I)=C/CO Amb17616110 [2,0,0,0,0,0|1,0,0]=3 1920 B5R0.1 C\C(I)=C\CCl Amb27619763 [2,0,0,0,0,0|2,0,0]=4 1921 B5R0.1 C\C(I)=C\CI Amb27843437 [2,0,0,0,0,0|2,0,0]=4 1922 B5R0.1 C\C(I)=C\CN Amb27216485 [2,0,0,0,0,0|2,0,0]=4 1923 B5R0.1 C\C(I)=C\CO Amb30621783 [2,0,0,0,0,0|1,0,0]=3 1924 B5R0.1 C\C(N)=C/C=O Amb2612039 [2,0,0,0,0,0|1,0,0]=3 1925 B5R0.1 C\C(O)=C\CN Amb33294274 [2,0,0,0,0,0|2,0,0]=4 1926 B5R0.1 C\C=C/B(O)O Amb24547752 [2,0,0,0,0,0|1,0,1]=4 1927 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,0]=2 1928 B5R0.1 C\C=C/C(C)=O Amb28351405 [2,0,0,0,0,0|1,0,0]=3 1929 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|1,0,1]=4 1930 B5R0.1 C\C=C\B(O)O Amb33964180 [2,0,0,0,0,0|1,0,1]=4 1931 B5R0.1 C\C=C\C(=O)Br Amb25026006 [2,0,0,0,0,0|1,0,0]=3 1932 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [2,0,0,0,0,0|1,0,0]=3 1933 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,0]=2 1934 B5R0.1 C\C=C\C(C)=O Amb33941980 [2,0,0,0,0,0|1,0,0]=3 1935 B5R0.1 C\C=C\C(C)C Amb4019538 [2,0,0,0,0,0|1,0,1]=4 1936 B5R0.1 C\C=C\C(C)O Amb2721243 [2,0,0,0,0,0|1,0,1]=4 1937 B5R0.1 C\C=C\C(N)=O Amb4025906 [2,0,0,0,0,0|1,0,0]=3 1938 B5R0.1 C\C=C\C(O)O Amb26001148 [2,0,0,0,0,0|0,0,2]=4 1939 B5R0.1 C\C=C\S(=O)[O-] Amb32754562 [2,0,0,0,0,0|1,0,1]=4 1940 B5R0.1 C\C=C\[N+](=O)[O-] Amb25943859 [2,0,0,0,0,0|1,0,1]=4 1941 B5R0.1 N#CCC(=O)O Amb2609022 [2,0,0,0,0,0|1,0,1]=4 1942 B5R0.1 NC(=O)CC=O Amb25777522 [2,0,0,0,0,0|2,0,0]=4 1943 B5R0.1 NC(=O)\C=C\I Amb27791850 [2,0,0,0,0,0|2,0,0]=4 1944 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,1]=4 1945 B5R0.1 NNCC(=O)O Amb32751165 [2,0,0,0,0,0|2,0,0]=4 1946 B5R0.1 NNCC(=O)O Amb6740299 [2,0,0,0,0,0|2,0,0]=4 1947 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 1948 B5R0.1 NOCC(=O)O Amb4324355 [2,0,0,0,0,0|2,0,0]=4 1949 B5R0.1 NOCC(=O)O Amb8513076 [2,0,0,0,0,0|2,0,0]=4 1950 B5R0.1 N\C=C\C(=O)O Amb27217920 [2,0,0,0,0,0|1,0,0]=3 1951 B5R0.1 N\C=C\C(N)=O Amb27237320 [2,0,0,0,0,0|2,0,0]=4 1952 B5R0.1 O=C(Cl)\C=C/Cl Amb27463694 [2,0,0,0,0,0|2,0,0]=4 1953 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,1]=4 1954 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,1]=4 1955 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,1]=4 1956 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,1]=4 1957 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|1,0,1]=4 1958 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|1,0,1]=4 1959 B5R0.1 O=C(O)CNO Amb24120360 [2,0,0,0,0,0|2,0,0]=4 1960 B5R0.1 O=C(O)\C=C/Br Amb18644453 [2,0,0,0,0,0|1,0,0]=3 1961 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [2,0,0,0,0,0|1,0,0]=3 1962 B5R0.1 O=C(O)\C=C/I Amb28315824 [2,0,0,0,0,0|1,0,0]=3 1963 B5R0.1 O=C(O)\C=C\Br Amb27423608 [2,0,0,0,0,0|1,0,0]=3 1964 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [2,0,0,0,0,0|1,0,0]=3 1965 B5R0.1 O=C(O)\C=C\I Amb30584673 [2,0,0,0,0,0|1,0,0]=3 1966 B5R0.1 O=C(O)\C=C\O Amb26055842 [2,0,0,0,0,0|1,0,0]=3 1967 B5R0.1 O=C(O)\C=C\S Amb28401590 [2,0,0,0,0,0|1,0,0]=3 1968 B5R0.1 O=C(O)\C=N\O Amb20671938 [2,0,0,0,0,0|2,0,0]=4 1969 B5R0.1 O=CC=C(Cl)Cl Amb24691205 [2,0,0,0,0,0|2,0,0]=4 1970 B5R0.1 O=CCC(=O)O Amb22169407 [2,0,0,0,0,0|1,0,0]=3 1971 B5R0.1 O=CCC(=O)[Na] Amb27949540 [2,0,0,0,0,0|2,0,0]=4 1972 B5R0.1 OCC=C(Br)Br Amb25026226 [2,0,0,0,0,0|2,0,0]=4 1973 B5R0.1 OCC=C(Cl)Cl Amb17593330 [2,0,0,0,0,0|2,0,0]=4 1974 B5R0.2 C=C=CCC=O Amb27234481 [2,0,0,0,0,0|0,0,2]=4 1975 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|0,0,2]=4 1976 B5R0.2 C=CC\C=C/C Amb26426294 [2,0,0,0,0,0|1,0,0]=3 1977 B5R0.2 C=C\C=C\C=O Amb26369847 [2,0,0,0,0,0|0,0,2]=4 1978 B5R0.2 CC#CCC=O Amb27850282 [2,0,0,0,0,0|0,0,2]=4 1979 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,2]=4 1980 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,1]=4 1981 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,2]=4 1982 B5R0.2 CN\C=C\C=O Amb24564349 [2,0,0,0,0,0|1,0,1]=4 1983 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,1]=4 1984 B5R0.2 CO\C=C/C=O Amb28049941 [2,0,0,0,0,0|1,0,1]=4 1985 B5R0.2 CO\C=C\C=O Amb26873964 [2,0,0,0,0,0|1,0,1]=4 1986 B5R0.2 CSCCC=O Amb3939952 [2,0,0,0,0,0|1,0,1]=4 1987 B5R0.2 C\C=C/C=C/C Amb26318493 [2,0,0,0,0,0|1,0,1]=4 1988 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|1,0,1]=4 1989 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|0,0,1]=3 1990 B5R0.2 C\C=C\C=C\Br Amb27791828 [2,0,0,0,0,0|1,0,1]=4 1991 B5R0.2 C\C=C\C=C\C Amb27622458 [2,0,0,0,0,0|1,0,1]=4 1992 B5R0.2 C\C=C\CC#N Amb2720721 [2,0,0,0,0,0|1,0,1]=4 1993 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,0]=2 1994 B5R0.2 C\C=C\CCBr Amb32667161 [2,0,0,0,0,0|1,0,1]=4 1995 B5R0.2 C\C=C\CCCl Amb26978891 [2,0,0,0,0,0|1,0,1]=4 1996 B5R0.2 C\C=C\CCN Amb19374038 [2,0,0,0,0,0|1,0,1]=4 1997 B5R0.2 C\C=C\CCN Amb33038294 [2,0,0,0,0,0|1,0,1]=4 1998 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|0,0,1]=3 1999 B5R0.2 C\C=C\CNC Amb28049814 [2,0,0,0,0,0|2,0,0]=4 2000 B5R0.2 C\C=C\CON Amb18560216 [2,0,0,0,0,0|2,0,0]=4 2001 B5R0.2 C\C=C\N=C=O Amb24677922 [2,0,0,0,0,0|1,0,1]=4 2002 B5R0.2 O=CCCC=O Amb8395090 [2,0,0,0,0,0|1,0,1]=4 2003 B5R0.2 O=CCNC=O Amb26370295 [2,0,0,0,0,0|2,0,0]=4 2004 B5R0.2 O=CC\C=C\Cl Amb24571938 [2,0,0,0,0,0|1,0,0]=3 2005 B5R0.2 O=C\C=C/C=O Amb28146767 [2,0,0,0,0,0|1,0,1]=4 2006 B5R0.2 O=C\C=C\C=O Amb17593019 [2,0,0,0,0,0|1,0,1]=4 2007 B5R0.2 OCC\C=C\Br Amb27425005 [2,0,0,0,0,0|1,0,1]=4 2008 B5R0.2 OCC\C=C\Cl Amb27859286 [2,0,0,0,0,0|1,0,1]=4 2009 B7R0.2 C#CC(O)C=C(C)C Amb3354802 [1,1,0,0,0,0|1,0,1]=4 2010 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [1,1,0,0,0,0|0,0,2]=4 2011 B7R0.2 C=C(C)\C=C(/C)C=O Amb27464033 [1,1,0,0,0,0|0,0,2]=4 2012 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|0,0,1]=3 2013 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [1,1,0,0,0,0|1,0,1]=4 2014 B7R0.2 C=CC(=C)CC(C)=O Amb27668846 [1,1,0,0,0,0|1,0,1]=4 2015 B7R0.2 C=CC(=O)CC(C)=O Amb27470884 [1,1,0,0,0,0|1,0,1]=4 2016 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,1,0,0,0,0|0,0,2]=4 2017 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [1,1,0,0,0,0|0,0,2]=4 2018 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [1,1,0,0,0,0|0,0,2]=4 2019 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [1,1,0,0,0,0|0,0,2]=4 2020 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,1,0,0,0,0|0,0,2]=4 2021 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [1,1,0,0,0,0|0,0,2]=4 2022 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,1,0,0,0,0|0,0,2]=4 2023 B7R0.2 C=C\C(C)=C/C(=O)O Amb18641686 [1,1,0,0,0,0|0,0,2]=4 2024 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,1,0,0,0,0|1,0,1]=4 2025 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 2026 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [1,1,0,0,0,0|2,0,0]=4 2027 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [1,1,0,0,0,0|2,0,0]=4 2028 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [1,1,0,0,0,0|2,0,0]=4 2029 B7R0.2 CC(=O)\C=C(/C)C=O Amb27607120 [1,1,0,0,0,0|1,0,1]=4 2030 B7R0.2 CC(=O)\C=C(\C)C=O Amb18641689 [1,1,0,0,0,0|1,0,1]=4 2031 B7R0.2 CC(C)=CC(=N)NO Amb27623180 [1,1,0,0,0,0|1,0,1]=4 2032 B7R0.2 CC(C)=CC(=O)CO Amb28048944 [1,1,0,0,0,0|0,0,2]=4 2033 B7R0.2 CC(C)=CC(=O)NO Amb27835078 [1,1,0,0,0,0|1,0,1]=4 2034 B7R0.2 CC(C)=CC(C)CO Amb28318182 [1,1,0,0,0,0|0,0,1]=3 2035 B7R0.2 CC(C)=CC(C)NN Amb27236333 [1,1,0,0,0,0|2,0,0]=4 2036 B7R0.2 CC(C)=CC(O)C#N Amb27432192 [1,1,0,0,0,0|1,0,1]=4 2037 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,1,0,0,0,0|0,0,2]=4 2038 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|0,0,2]=4 2039 B7R0.2 CC(C)C[C@@H](C)C=O Amb27164638 [1,1,0,0,0,0|0,0,2]=4 2040 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [1,1,0,0,0,0|0,0,2]=4 2041 B7R0.2 CC(C)OC(C)C=O Amb25243083 [1,1,0,0,0,0|1,0,1]=4 2042 B7R0.2 CC(C)SC(C)C=O Amb18642905 [1,1,0,0,0,0|1,0,1]=4 2043 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|0,0,1]=3 2044 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [1,1,0,0,0,0|1,0,1]=4 2045 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [1,1,0,0,0,0|1,0,1]=4 2046 B7R0.2 CCC(Br)C=C(C)C Amb27831341 [1,1,0,0,0,0|1,0,1]=4 2047 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|0,0,2]=4 2048 B7R0.2 CCC(N)C=C(C)C Amb27450297 [1,1,0,0,0,0|1,0,1]=4 2049 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|0,0,2]=4 2050 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|0,0,2]=4 2051 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|0,0,2]=4 2052 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|1,0,1]=4 2053 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|1,0,1]=4 2054 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|1,0,1]=4 2055 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,1]=4 2056 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|0,0,2]=4 2057 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|0,0,2]=4 2058 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|0,0,2]=4 2059 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|0,0,2]=4 2060 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|0,0,2]=4 2061 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|0,0,2]=4 2062 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|0,0,2]=4 2063 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|0,0,2]=4 2064 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [1,1,0,0,0,0|0,0,2]=4 2065 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [1,1,0,0,0,0|0,0,2]=4 2066 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [1,1,0,0,0,0|0,0,2]=4 2067 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [1,1,0,0,0,0|0,0,2]=4 2068 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [1,1,0,0,0,0|0,0,2]=4 2069 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [1,1,0,0,0,0|0,0,2]=4 2070 B7R0.2 CN(C)\C=C(/Br)C=O Amb20622479 [1,1,0,0,0,0|1,0,1]=4 2071 B7R0.2 CN(C)\C=C(/Cl)C=O Amb27392189 [1,1,0,0,0,0|1,0,1]=4 2072 B7R0.2 CN(C)\C=C(/I)C=O Amb28077233 [1,1,0,0,0,0|1,0,1]=4 2073 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [1,1,0,0,0,0|1,0,0]=3 2074 B7R0.2 CNC(=O)CC(=O)[O-] Amb35747299 [1,1,0,0,0,0|1,0,1]=4 2075 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [1,1,0,0,0,0|2,0,0]=4 2076 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [1,1,0,0,0,0|2,0,0]=4 2077 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|1,0,1]=4 2078 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|1,0,1]=4 2079 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|1,0,1]=4 2080 B7R0.2 COC(=O)CC(=O)Cl Amb3939073 [1,1,0,0,0,0|2,0,0]=4 2081 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|1,0,0]=3 2082 B7R0.2 COC(=O)CC(=O)[O-] Amb2780363 [1,1,0,0,0,0|1,0,1]=4 2083 B7R0.2 COC(=O)CC(=O)[O-] Amb34915950 [1,1,0,0,0,0|1,0,1]=4 2084 B7R0.2 COC(=O)CC(C)=O Amb6608655 [1,1,0,0,0,0|2,0,0]=4 2085 B7R0.2 COC(=O)CC(N)=O Amb22043417 [1,1,0,0,0,0|2,0,0]=4 2086 B7R0.2 COC(=S)CC(N)=O Amb27230798 [1,1,0,0,0,0|2,0,0]=4 2087 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|1,0,1]=4 2088 B7R0.2 CON(C)CC(=O)O Amb8010467 [1,1,0,0,0,0|2,0,0]=4 2089 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|1,0,1]=4 2090 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [1,1,0,0,0,0|1,0,1]=4 2091 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [1,1,0,0,0,0|1,0,1]=4 2092 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|1,0,1]=4 2093 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|1,0,1]=4 2094 B7R0.2 C\C(=C\Cl)CC(N)=O Amb27391105 [1,1,0,0,0,0|2,0,0]=4 2095 B7R0.2 C\C(Br)=C\[C@@H](C)CO Amb28206195 [1,1,0,0,0,0|1,0,1]=4 2096 B7R0.2 C\C(C=O)=C/N(C)C Amb2779776 [1,1,0,0,0,0|1,0,1]=4 2097 B7R0.2 C\C(C=O)=C\N(C)C Amb19651322 [1,1,0,0,0,0|1,0,1]=4 2098 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [1,1,0,0,0,0|2,0,0]=4 2099 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [1,1,0,0,0,0|1,0,0]=3 2100 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [1,1,0,0,0,0|1,0,0]=3 2101 B7R0.2 C\C=C(\C)NC(C)=O Amb24468210 [1,1,0,0,0,0|2,0,0]=4 2102 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,1,0,0,0,0|0,0,0]=2 2103 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,1,0,0,0,0|1,0,1]=4 2104 B7R0.2 NNC(=O)CC(=O)O Amb25073925 [1,1,0,0,0,0|2,0,0]=4 2105 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,1,0,0,0,0|1,0,1]=4 2106 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [1,1,0,0,0,0|2,0,0]=4 2107 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|1,0,1]=4 2108 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [1,1,0,0,0,0|1,0,0]=3 2109 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [1,1,0,0,0,0|2,0,0]=4 2110 B7R0.2 O=C\C(Cl)=C/C(=O)O Amb27852924 [1,1,0,0,0,0|1,0,1]=4 2111 B7R0.3 C#CC(O)C\C=C\C Amb28284578 [1,1,0,0,0,0|1,0,1]=4 2112 B7R0.3 C#C\C(C)=C\CCO Amb28206463 [1,1,0,0,0,0|0,0,2]=4 2113 B7R0.3 C=C(C=O)C\C=C\C Amb26441086 [1,1,0,0,0,0|1,0,0]=3 2114 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,1,0,0,0,0|0,0,2]=4 2115 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [1,1,0,0,0,0|1,0,0]=3 2116 B7R0.3 C=CC(O)C\C=C/C Amb25983129 [1,1,0,0,0,0|1,0,1]=4 2117 B7R0.3 C=CC(O)C\C=C\C Amb27666343 [1,1,0,0,0,0|1,0,1]=4 2118 B7R0.3 C=CCCC(=O)NO Amb28205003 [1,1,0,0,0,0|0,0,2]=4 2119 B7R0.3 C=CCCC(=O)OC Amb2369959 [1,1,0,0,0,0|0,0,2]=4 2120 B7R0.3 C=CC\C=C(/C)C=O Amb18123725 [1,1,0,0,0,0|1,0,1]=4 2121 B7R0.3 C=CC\C=C(/C)CC Amb24694420 [1,1,0,0,0,0|1,0,0]=3 2122 B7R0.3 C=CC\C=C(/Cl)CO Amb27806456 [1,1,0,0,0,0|2,0,0]=4 2123 B7R0.3 C=CC\C=C(\C)CN Amb28369166 [1,1,0,0,0,0|1,0,0]=3 2124 B7R0.3 C=C\C=C\C(=O)OC Amb22350484 [1,1,0,0,0,0|0,0,2]=4 2125 B7R0.3 CC#CCC(=O)OC Amb6336504 [1,1,0,0,0,0|0,0,2]=4 2126 B7R0.3 CC=C=CC(=O)OC Amb26575881 [1,1,0,0,0,0|0,0,2]=4 2127 B7R0.3 CCC(=O)C\C=C\Cl Amb28349318 [1,1,0,0,0,0|2,0,0]=4 2128 B7R0.3 CCC(=O)NCC=O Amb17102054 [1,1,0,0,0,0|2,0,0]=4 2129 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [1,1,0,0,0,0|1,0,1]=4 2130 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [1,1,0,0,0,0|0,0,2]=4 2131 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,2]=4 2132 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|0,0,2]=4 2133 B7R0.3 CCC\C=C(/C)CC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 2134 B7R0.3 CCC\C=C(/C)CCl Amb27803634 [1,1,0,0,0,0|1,0,1]=4 2135 B7R0.3 CCC\C=C(\C)CBr Amb27984757 [1,1,0,0,0,0|1,0,1]=4 2136 B7R0.3 CCC\C=C(\C)CN Amb27953132 [1,1,0,0,0,0|1,0,1]=4 2137 B7R0.3 CCNCC(=O)NO Amb27755137 [1,1,0,0,0,0|1,0,1]=4 2138 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,1]=4 2139 B7R0.3 CCNCC(=O)OC Amb6687125 [1,1,0,0,0,0|1,0,1]=4 2140 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,1]=4 2141 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,1]=4 2142 B7R0.3 CCSCC(=O)OC Amb7753193 [1,1,0,0,0,0|1,0,1]=4 2143 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,1,0,0,0,0|0,0,2]=4 2144 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [1,1,0,0,0,0|0,0,2]=4 2145 B7R0.3 CC\C(Br)=C\CCO Amb28453501 [1,1,0,0,0,0|1,0,1]=4 2146 B7R0.3 CC\C(C)=C/CCO Amb25264354 [1,1,0,0,0,0|0,0,1]=3 2147 B7R0.3 CC\C(C)=C\CCBr Amb10070627 [1,1,0,0,0,0|1,0,1]=4 2148 B7R0.3 CC\C(C)=C\CCN Amb27243209 [1,1,0,0,0,0|1,0,1]=4 2149 B7R0.3 CC\C(C)=C\CCO Amb28388883 [1,1,0,0,0,0|0,0,1]=3 2150 B7R0.3 CC\C(C)=C\CNC Amb31161536 [1,1,0,0,0,0|2,0,0]=4 2151 B7R0.3 CC\C(C)=N\NC=O Amb28454145 [1,1,0,0,0,0|2,0,0]=4 2152 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [1,1,0,0,0,0|0,0,2]=4 2153 B7R0.3 CNCCC(=O)NO Amb27763537 [1,1,0,0,0,0|1,0,1]=4 2154 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|1,0,1]=4 2155 B7R0.3 CNCCC(=O)OC Amb7969878 [1,1,0,0,0,0|1,0,1]=4 2156 B7R0.3 CNOCC(=O)OC Amb32662920 [1,1,0,0,0,0|2,0,0]=4 2157 B7R0.3 CNOCC(=O)OC Amb33067971 [1,1,0,0,0,0|2,0,0]=4 2158 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 2159 B7R0.3 COC(=O)CCSC Amb8393179 [1,1,0,0,0,0|1,0,1]=4 2160 B7R0.3 COC(=O)CNC=O Amb22000868 [1,1,0,0,0,0|2,0,0]=4 2161 B7R0.3 COC(=O)CNC=S Amb27839121 [1,1,0,0,0,0|2,0,0]=4 2162 B7R0.3 COC(=O)C\C=C\Cl Amb28458363 [1,1,0,0,0,0|1,0,0]=3 2163 B7R0.3 COC(=O)NCC=O Amb27839038 [1,1,0,0,0,0|2,0,0]=4 2164 B7R0.3 COC(=O)OCC=O Amb28208420 [1,1,0,0,0,0|2,0,0]=4 2165 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [1,1,0,0,0,0|1,0,1]=4 2166 B7R0.3 COC(=O)\C=C\SC Amb33473626 [1,1,0,0,0,0|1,0,1]=4 2167 B7R0.3 COC(C)CCC=O Amb25917630 [1,1,0,0,0,0|0,0,2]=4 2168 B7R0.3 COC(C)\C=C\C=O Amb27640624 [1,1,0,0,0,0|0,0,2]=4 2169 B7R0.3 COCCC(=O)OC Amb6296150 [1,1,0,0,0,0|1,0,1]=4 2170 B7R0.3 CO\C(C)=C\CC=O Amb28283269 [1,1,0,0,0,0|0,0,0]=2 2171 B7R0.3 CO\C=C\C(=O)OC Amb6600489 [1,1,0,0,0,0|1,0,1]=4 2172 B7R0.3 C\C(=C/CCBr)CO Amb27454855 [1,1,0,0,0,0|1,0,1]=4 2173 B7R0.3 C\C(=C/CCCl)CCl Amb28422738 [1,1,0,0,0,0|1,0,1]=4 2174 B7R0.3 C\C(=C/CCCl)CO Amb27600969 [1,1,0,0,0,0|1,0,1]=4 2175 B7R0.3 C\C(=C\CCCl)CCl Amb27195288 [1,1,0,0,0,0|1,0,1]=4 2176 B7R0.3 C\C(C=O)=C/CC=O Amb27236148 [1,1,0,0,0,0|0,0,1]=3 2177 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,1,0,0,0,0|0,0,2]=4 2178 B7R0.3 C\C=C(\C)C#CC=O Amb27423075 [1,1,0,0,0,0|0,0,2]=4 2179 B7R0.3 C\C=C/C=C(/C)C=O Amb27392706 [1,1,0,0,0,0|1,0,1]=4 2180 B7R0.3 C\C=C/CC(O)CCl Amb27217302 [1,1,0,0,0,0|1,0,1]=4 2181 B7R0.3 C\C=C\C=C(/C)C=O Amb27204994 [1,1,0,0,0,0|1,0,1]=4 2182 B7R0.3 C\C=C\CC(=N)NO Amb26582540 [1,1,0,0,0,0|1,0,0]=3 2183 B7R0.3 C\C=C\CC(=N)OC Amb28058157 [1,1,0,0,0,0|1,0,0]=3 2184 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [1,1,0,0,0,0|0,0,0]=2 2185 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [1,1,0,0,0,0|1,0,1]=4 2186 B7R0.3 C\C=C\CC(N)CO Amb24625761 [1,1,0,0,0,0|1,0,1]=4 2187 B7R0.3 C\C=C\CC(N)CO Amb30585118 [1,1,0,0,0,0|1,0,1]=4 2188 B7R0.3 C\C=C\CC(O)CO Amb27761815 [1,1,0,0,0,0|0,0,2]=4 2189 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [1,1,0,0,0,0|1,0,1]=4 2190 B7R0.3 C\C=C\C[C@@H](O)CO Amb27981099 [1,1,0,0,0,0|0,0,2]=4 2191 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [1,1,0,0,0,0|1,0,1]=4 2192 B7R0.3 C\C=C\C[C@H](O)CO Amb27452087 [1,1,0,0,0,0|0,0,2]=4 2193 B7R0.3 C\C=C\NC(=O)NC Amb24585267 [1,1,0,0,0,0|2,0,0]=4 2194 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [1,1,0,0,0,0|1,0,0]=3 2195 B7R0.3 C\C=C\OC(=O)CCl Amb8387724 [1,1,0,0,0,0|2,0,0]=4 2196 B7R0.3 NC\C(F)=C\CCO Amb28411180 [1,1,0,0,0,0|1,0,1]=4 2197 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,1,0,0,0,0|1,0,1]=4 2198 B7R0.3 O=CC\C=C(/Cl)C=O Amb27401185 [1,1,0,0,0,0|1,0,1]=4 2199 B7R0.3 O=C\C=C\C(=O)CO Amb24574003 [1,1,0,0,0,0|1,0,1]=4 2200 B7R0.3 OCC\C=C(\Cl)CCl Amb27879840 [1,1,0,0,0,0|1,0,1]=4 2201 B7R0.4 C#CCCC=C(C)C Amb30023880 [1,1,0,0,0,0|1,0,1]=4 2202 B7R0.4 C=C(Br)C\C=C\CO Amb27481048 [1,1,0,0,0,0|2,0,0]=4 2203 B7R0.4 C=C(C)CCNC=O Amb27228134 [1,1,0,0,0,0|0,0,2]=4 2204 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [1,1,0,0,0,0|2,0,0]=4 2205 B7R0.4 C=C(C)COCC=O Amb27949608 [1,1,0,0,0,0|0,0,2]=4 2206 B7R0.4 C=C(C)C\C=C\C=O Amb18640955 [1,1,0,0,0,0|0,0,2]=4 2207 B7R0.4 C=C(C)C\C=C\CO Amb27181043 [1,1,0,0,0,0|2,0,0]=4 2208 B7R0.4 C=C=CSCC(=O)O Amb27812092 [1,1,0,0,0,0|0,0,2]=4 2209 B7R0.4 C=CC#CCC(=O)O Amb27162652 [1,1,0,0,0,0|0,0,2]=4 2210 B7R0.4 C=CCCC=C(C)C Amb25789441 [1,1,0,0,0,0|1,0,0]=3 2211 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,1,0,0,0,0|0,0,2]=4 2212 B7R0.4 C=CCNCC(=O)O Amb7766404 [1,1,0,0,0,0|0,0,2]=4 2213 B7R0.4 C=CCNCC(=O)O Amb8631497 [1,1,0,0,0,0|0,0,2]=4 2214 B7R0.4 C=CCNN=C(C)C Amb27661895 [1,1,0,0,0,0|2,0,0]=4 2215 B7R0.4 C=CCOCC(=O)O Amb9208694 [1,1,0,0,0,0|0,0,2]=4 2216 B7R0.4 C=CCSCC(=O)O Amb33526723 [1,1,0,0,0,0|0,0,2]=4 2217 B7R0.4 C=CNCCC(=O)O Amb27429817 [1,1,0,0,0,0|0,0,2]=4 2218 B7R0.4 C=COCCC(=O)O Amb28350126 [1,1,0,0,0,0|0,0,2]=4 2219 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [1,1,0,0,0,0|0,0,1]=3 2220 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,1,0,0,0,0|0,0,2]=4 2221 B7R0.4 CC(=O)C=C=CCO Amb28284681 [1,1,0,0,0,0|1,0,1]=4 2222 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [1,1,0,0,0,0|1,0,1]=4 2223 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [1,1,0,0,0,0|1,0,1]=4 2224 B7R0.4 CC(=O)NCCC=O Amb17102165 [1,1,0,0,0,0|1,0,1]=4 2225 B7R0.4 CC(=O)OC\C=C/Br Amb26652075 [1,1,0,0,0,0|2,0,0]=4 2226 B7R0.4 CC(=O)OC\C=C/Cl Amb27843145 [1,1,0,0,0,0|2,0,0]=4 2227 B7R0.4 CC(=O)OC\C=C\Br Amb27467221 [1,1,0,0,0,0|2,0,0]=4 2228 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,1,0,0,0,0|1,0,1]=4 2229 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [1,1,0,0,0,0|1,0,1]=4 2230 B7R0.4 CC(C)=C=CCCO Amb27265946 [1,1,0,0,0,0|0,0,1]=3 2231 B7R0.4 CC(C)=CCCC#N Amb18124144 [1,1,0,0,0,0|1,0,1]=4 2232 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|0,0,0]=2 2233 B7R0.4 CC(C)=CCCCN Amb18641749 [1,1,0,0,0,0|1,0,1]=4 2234 B7R0.4 CC(C)=CCCCO Amb26478086 [1,1,0,0,0,0|0,0,1]=3 2235 B7R0.4 CC(C)=CCCON Amb35588109 [1,1,0,0,0,0|0,0,1]=3 2236 B7R0.4 CC(C)=CCNC=N Amb28057742 [1,1,0,0,0,0|1,0,0]=3 2237 B7R0.4 CC(C)=CCNC=O Amb27838354 [1,1,0,0,0,0|0,0,0]=2 2238 B7R0.4 CC(C)=COCCO Amb27662198 [1,1,0,0,0,0|0,0,1]=3 2239 B7R0.4 CC(C)=C\C=C/C=O Amb27169113 [1,1,0,0,0,0|0,0,1]=3 2240 B7R0.4 CC(C)=C\C=C\CCl Amb27778733 [1,1,0,0,0,0|1,0,1]=4 2241 B7R0.4 CC(C)=C\C=C\CO Amb28400370 [1,1,0,0,0,0|0,0,1]=3 2242 B7R0.4 CC(C)=NOCCO Amb8385274 [1,1,0,0,0,0|1,0,1]=4 2243 B7R0.4 CC(C)C=C=CCO Amb27424344 [1,1,0,0,0,0|0,0,2]=4 2244 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,2]=4 2245 B7R0.4 CC(C)CCNC=O Amb27460935 [1,1,0,0,0,0|0,0,2]=4 2246 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [1,1,0,0,0,0|0,0,2]=4 2247 B7R0.4 CC(C)N\C=C\C=O Amb26418674 [1,1,0,0,0,0|0,0,2]=4 2248 B7R0.4 CC(C)OCCC=O Amb26443003 [1,1,0,0,0,0|0,0,2]=4 2249 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,2]=4 2250 B7R0.4 CC(O)C\C=C\CO Amb27432058 [1,1,0,0,0,0|1,0,1]=4 2251 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,1,0,0,0,0|0,0,2]=4 2252 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|1,0,1]=4 2253 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,2]=4 2254 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,2]=4 2255 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,2]=4 2256 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|0,0,2]=4 2257 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,0,2]=4 2258 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|0,0,2]=4 2259 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|0,0,2]=4 2260 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|0,0,2]=4 2261 B7R0.4 CCNNCC(=O)O Amb28326075 [1,1,0,0,0,0|1,0,1]=4 2262 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|0,0,2]=4 2263 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [1,1,0,0,0,0|0,0,2]=4 2264 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|0,0,2]=4 2265 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|0,0,0]=2 2266 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|1,0,0]=3 2267 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|1,0,0]=3 2268 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|0,0,0]=2 2269 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|1,0,0]=3 2270 B7R0.4 CC\C=C\CC(C)O Amb33079090 [1,1,0,0,0,0|1,0,1]=4 2271 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [1,1,0,0,0,0|1,1,0]=4 2272 B7R0.4 CC\C=C\CN(C)O Amb33268704 [1,1,0,0,0,0|2,0,0]=4 2273 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [1,1,0,0,0,0|1,0,1]=4 2274 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [1,1,0,0,0,0|1,0,1]=4 2275 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [1,1,0,0,0,0|1,0,1]=4 2276 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,1,0,0,0,0|1,0,0]=3 2277 B7R0.4 CN(C)CCCC=O Amb22753951 [1,1,0,0,0,0|1,0,1]=4 2278 B7R0.4 CN(C)CCCC=O Amb24117840 [1,1,0,0,0,0|1,0,1]=4 2279 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|0,0,2]=4 2280 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|0,0,2]=4 2281 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [1,1,0,0,0,0|0,0,2]=4 2282 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|0,0,2]=4 2283 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|1,0,1]=4 2284 B7R0.4 COCSCC(=O)O Amb27466837 [1,1,0,0,0,0|1,0,1]=4 2285 B7R0.4 COC\C=C\C(=O)O Amb33986212 [1,1,0,0,0,0|0,0,2]=4 2286 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [1,1,0,0,0,0|2,0,0]=4 2287 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [1,1,0,0,0,0|2,0,0]=4 2288 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|0,0,2]=4 2289 B7R0.4 CSCSCC(=O)O Amb27858824 [1,1,0,0,0,0|1,0,1]=4 2290 B7R0.4 CSSCCC(=O)O Amb26848465 [1,1,0,0,0,0|1,0,1]=4 2291 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,1,0,0,0,0|0,0,0]=2 2292 B7R0.4 C[C@H](O)C\C=C\CO Amb27945050 [1,1,0,0,0,0|1,0,1]=4 2293 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [1,1,0,0,0,0|1,0,0]=3 2294 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [1,1,0,0,0,0|1,0,1]=4 2295 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [1,1,0,0,0,0|1,0,1]=4 2296 B7R0.4 C\C=C\C#CC(=O)O Amb17593127 [1,1,0,0,0,0|0,0,1]=3 2297 B7R0.4 C\C=C\C=C\C(=O)Cl Amb32664141 [1,1,0,0,0,0|1,0,1]=4 2298 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [1,1,0,0,0,0|0,0,1]=3 2299 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33512746 [1,1,0,0,0,0|0,0,2]=4 2300 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33723188 [1,1,0,0,0,0|0,0,2]=4 2301 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [1,1,0,0,0,0|1,0,1]=4 2302 B7R0.4 C\C=C\C=C\C(N)=O Amb28400805 [1,1,0,0,0,0|1,0,1]=4 2303 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|0,0,0]=2 2304 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,1,0,0,0,0|1,0,0]=3 2305 B7R0.4 C\C=C\CCC(C)O Amb32665057 [1,1,0,0,0,0|1,0,1]=4 2306 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [1,1,0,0,0,0|1,0,1]=4 2307 B7R0.4 C\C=C\CNC(=O)S Amb26417290 [1,1,0,0,0,0|0,1,0]=3 2308 B7R0.4 C\C=C\CNC(N)=S Amb27267431 [1,1,0,0,0,0|1,1,0]=4 2309 B7R0.4 C\C=C\COC(C)=O Amb6366590 [1,1,0,0,0,0|1,0,0]=3 2310 B7R0.4 C\C=C\CSC(N)=S Amb26390538 [1,1,0,0,0,0|1,1,0]=4 2311 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [1,1,0,0,0,0|2,0,0]=4 2312 B7R0.4 NCC#CCC(=O)O Amb27976019 [1,1,0,0,0,0|0,0,2]=4 2313 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|0,0,2]=4 2314 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|0,0,2]=4 2315 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|0,0,2]=4 2316 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|1,0,1]=4 2317 B7R0.4 NCCNCC(=O)O Amb33339058 [1,1,0,0,0,0|1,0,1]=4 2318 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|1,0,1]=4 2319 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|1,0,1]=4 2320 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,1]=4 2321 B7R0.4 NCCSCC(=O)O Amb20622325 [1,1,0,0,0,0|1,0,1]=4 2322 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [1,1,0,0,0,0|0,0,2]=4 2323 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|0,0,2]=4 2324 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|0,0,2]=4 2325 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|0,0,2]=4 2326 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|0,0,2]=4 2327 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|0,0,2]=4 2328 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|1,0,0]=3 2329 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [1,1,0,0,0,0|1,0,1]=4 2330 B7R0.4 O=C(O)CNCCF Amb28076282 [1,1,0,0,0,0|1,0,1]=4 2331 B7R0.4 O=C(O)CNCCO Amb9325653 [1,1,0,0,0,0|1,0,1]=4 2332 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,1]=4 2333 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|1,0,1]=4 2334 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|1,0,1]=4 2335 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,1]=4 2336 B7R0.4 O=C(O)CSSCCl Amb27983630 [1,1,0,0,0,0|2,0,0]=4 2337 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|0,0,0]=2 2338 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,1,0,0,0,0|0,0,0]=2 2339 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|0,0,0]=2 2340 B7R0.4 O=C(O)\C=C/C=N/O Amb27449866 [1,1,0,0,0,0|1,0,1]=4 2341 B7R0.4 O=C(O)\C=C\C=C\Cl Amb28189602 [1,1,0,0,0,0|0,0,2]=4 2342 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [1,1,0,0,0,0|0,0,2]=4 2343 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [1,1,0,0,0,0|0,0,2]=4 2344 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|1,0,1]=4 2345 B7R0.4 O=CNCC=C(Cl)Cl Amb35690539 [1,1,0,0,0,0|2,0,0]=4 2346 B7R0.4 O=CNCCC(=O)O Amb18290434 [1,1,0,0,0,0|1,0,1]=4 2347 B7R0.4 O=CNOCC(=O)O Amb27477273 [1,1,0,0,0,0|2,0,0]=4 2348 B7R0.5 C=C(C)C(=C)CC=O Amb28245848 [1,1,0,0,0,0|0,0,1]=3 2349 B7R0.5 C=C(C)\C(C)=C\C=O Amb27852094 [1,1,0,0,0,0|0,0,2]=4 2350 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [1,1,0,0,0,0|1,0,0]=3 2351 B7R0.5 C=C(\C=C\C)C(C)=O Amb25712751 [1,1,0,0,0,0|1,0,1]=4 2352 B7R0.5 C=CCC(=O)C(=C)C Amb17593136 [1,1,0,0,0,0|1,0,1]=4 2353 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,1,0,0,0,0|0,0,2]=4 2354 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,1,0,0,0,0|0,0,2]=4 2355 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,1,0,0,0,0|0,0,2]=4 2356 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,1,0,0,0,0|0,0,2]=4 2357 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,1,0,0,0,0|0,0,2]=4 2358 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,1,0,0,0,0|0,0,2]=4 2359 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,1,0,0,0,0|0,0,2]=4 2360 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,1,0,0,0,0|0,0,2]=4 2361 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,1,0,0,0,0|0,0,2]=4 2362 B7R0.5 C=C\C=C(/Cl)C(=O)O Amb18642910 [1,1,0,0,0,0|0,0,2]=4 2363 B7R0.5 C=C\C=C(\C)C(=O)O Amb27221069 [1,1,0,0,0,0|0,0,2]=4 2364 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,1,0,0,0,0|0,0,2]=4 2365 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,1,0,0,0,0|0,0,2]=4 2366 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [1,1,0,0,0,0|1,0,0]=3 2367 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,1,0,0,0,0|1,0,1]=4 2368 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 2369 B7R0.5 CC(=O)N(C)CC=O Amb17080668 [1,1,0,0,0,0|2,0,0]=4 2370 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [1,1,0,0,0,0|1,0,1]=4 2371 B7R0.5 CC(=O)\C(C)=C\C=O Amb28208341 [1,1,0,0,0,0|1,0,1]=4 2372 B7R0.5 CC(=O)\C(C)=N\C=O Amb28316244 [1,1,0,0,0,0|2,0,0]=4 2373 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [1,1,0,0,0,0|0,0,0]=2 2374 B7R0.5 CC(C)=C(C)CCBr Amb25890211 [1,1,0,0,0,0|1,0,1]=4 2375 B7R0.5 CC(C)=C(C)CCCl Amb27613488 [1,1,0,0,0,0|1,0,1]=4 2376 B7R0.5 CC(C)=C(C)CCN Amb26481951 [1,1,0,0,0,0|1,0,1]=4 2377 B7R0.5 CC(C)=C(C)CCO Amb26370445 [1,1,0,0,0,0|0,0,1]=3 2378 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|0,0,1]=3 2379 B7R0.5 CC(C)C(=O)CCO Amb20669209 [1,1,0,0,0,0|0,0,2]=4 2380 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|0,0,2]=4 2381 B7R0.5 CC(C)C(N)CC=O Amb27628058 [1,1,0,0,0,0|0,0,2]=4 2382 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [1,1,0,0,0,0|0,0,2]=4 2383 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,1,0,0,0,0|1,0,1]=4 2384 B7R0.5 CC(CC=O)N(C)C Amb18203067 [1,1,0,0,0,0|1,0,1]=4 2385 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [1,1,0,0,0,0|2,0,0]=4 2386 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [1,1,0,0,0,0|2,0,0]=4 2387 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|0,0,2]=4 2388 B7R0.5 CCCC(C)=C(C)C Amb4019545 [1,1,0,0,0,0|1,0,1]=4 2389 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|0,0,2]=4 2390 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|0,0,2]=4 2391 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|0,0,2]=4 2392 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|0,0,2]=4 2393 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|0,0,2]=4 2394 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|0,0,2]=4 2395 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|0,0,2]=4 2396 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|0,0,2]=4 2397 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|0,0,2]=4 2398 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|0,0,2]=4 2399 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|0,0,2]=4 2400 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|0,0,2]=4 2401 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|0,0,2]=4 2402 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|0,0,2]=4 2403 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|0,0,2]=4 2404 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|0,0,2]=4 2405 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|0,0,2]=4 2406 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|1,0,1]=4 2407 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|1,0,1]=4 2408 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|1,0,1]=4 2409 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|1,0,1]=4 2410 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|1,0,1]=4 2411 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,1]=4 2412 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,1]=4 2413 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,1]=4 2414 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,1,0,0,0,0|0,0,2]=4 2415 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,1,0,0,0,0|0,0,2]=4 2416 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,1,0,0,0,0|0,0,2]=4 2417 B7R0.5 CN(C)C(=O)CCO Amb10576258 [1,1,0,0,0,0|1,0,1]=4 2418 B7R0.5 CN(C)C(=O)NC=O Amb27391650 [1,1,0,0,0,0|2,0,0]=4 2419 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [1,1,0,0,0,0|1,0,0]=3 2420 B7R0.5 CN(C)\C(O)=C\C=O Amb27830087 [1,1,0,0,0,0|1,0,1]=4 2421 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|1,0,1]=4 2422 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|1,0,1]=4 2423 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|1,0,1]=4 2424 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|1,0,1]=4 2425 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|1,0,1]=4 2426 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|1,0,1]=4 2427 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|1,0,1]=4 2428 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|1,0,1]=4 2429 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|1,0,1]=4 2430 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|1,0,1]=4 2431 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|1,0,1]=4 2432 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|1,0,1]=4 2433 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|1,0,1]=4 2434 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|1,0,1]=4 2435 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|1,0,1]=4 2436 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|1,0,1]=4 2437 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|1,0,1]=4 2438 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|1,0,1]=4 2439 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|1,0,1]=4 2440 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|1,0,1]=4 2441 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,1,0,0,0,0|2,0,0]=4 2442 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [1,1,0,0,0,0|1,0,1]=4 2443 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [1,1,0,0,0,0|1,0,1]=4 2444 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [1,1,0,0,0,0|1,0,1]=4 2445 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [1,1,0,0,0,0|1,0,1]=4 2446 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [1,1,0,0,0,0|1,0,1]=4 2447 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|1,0,1]=4 2448 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|1,0,1]=4 2449 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|1,0,1]=4 2450 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|1,0,1]=4 2451 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|1,0,1]=4 2452 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|1,0,1]=4 2453 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|1,0,1]=4 2454 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|1,0,1]=4 2455 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [1,1,0,0,0,0|2,0,0]=4 2456 B7R0.5 C[N+](C)=C(Cl)\C=C\O Amb28065177 [1,1,0,0,0,0|1,0,1]=4 2457 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|1,0,1]=4 2458 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|1,0,1]=4 2459 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [1,1,0,0,0,0|1,0,1]=4 2460 B7R0.5 C\C(=C/C=O)C(C)C Amb18641697 [1,1,0,0,0,0|0,0,2]=4 2461 B7R0.5 C\C(=C\C=O)C(C)C Amb27872238 [1,1,0,0,0,0|0,0,2]=4 2462 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,1,0,0,0,0|0,0,0]=2 2463 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [1,1,0,0,0,0|1,0,0]=3 2464 B7R0.5 C\C=C\C(C)C(C)O Amb32944797 [1,1,0,0,0,0|1,0,1]=4 2465 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,1,0,0,0,0|0,0,0]=2 2466 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [1,1,0,0,0,0|1,0,0]=3 2467 B7R0.5 C\C=C\C(O)C(C)O Amb28429731 [1,1,0,0,0,0|1,0,1]=4 2468 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,1,0,0,0,0|0,0,0]=2 2469 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,1,0,0,0,0|0,0,0]=2 2470 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,1,0,0,0,0|0,0,0]=2 2471 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [1,1,0,0,0,0|1,0,0]=3 2472 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [1,1,0,0,0,0|1,0,0]=3 2473 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,1,0,0,0,0|1,0,1]=4 2474 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [1,1,0,0,0,0|2,0,0]=4 2475 B7R0.5 O=C\C=C(/Br)C(=O)O Amb28320595 [1,1,0,0,0,0|1,0,1]=4 2476 B7R0.5 O=C\C=C(/Cl)C(=O)O Amb27784434 [1,1,0,0,0,0|1,0,1]=4 2477 B7R0.8 CC(C)(C)CCC=O Amb18641814 [1,1,0,0,0,0|0,0,2]=4 2478 B7R0.8 CC(C)(C)\C=C\C=O Amb18641695 [1,1,0,0,0,0|0,0,2]=4 2479 B7R0.8 CC(C)(F)CCC=O Amb25223234 [1,1,0,0,0,0|0,0,2]=4 2480 B7R0.8 CC(C)(F)\C=C\C=O Amb33271856 [1,1,0,0,0,0|0,0,2]=4 2481 B7R0.8 C[N+](C)(N)CCC=O Amb28250962 [1,1,0,0,0,0|1,0,1]=4 2482 B7R0.8 C\C=C\CS(=O)(=O)Cl Amb26509730 [1,1,0,0,0,0|1,0,1]=4 2483 B7R0.8 C\C=C\CS(N)(=O)=O Amb32665629 [1,1,0,0,0,0|1,0,1]=4 2484 B7R0.9 C=C(C)CS(=O)(=O)O Amb8479884 [0,1,0,0,1,0|1,0,1]=4 2485 B7R0.9 CC(=O)CC(C)(C)C Amb4605984 [0,1,0,0,1,0|1,0,1]=4 2486 B7R0.9 CC(=O)CC(C)(C)Cl Amb27861037 [0,1,0,0,1,0|1,0,1]=4 2487 B7R0.9 CC(=O)CC(C)(C)N Amb3940544 [0,1,0,0,1,0|1,0,1]=4 2488 B7R0.9 CC(=O)CC(C)(C)N Amb4136360 [0,1,0,0,1,0|1,0,1]=4 2489 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [0,1,0,0,1,0|1,0,1]=4 2490 B7R0.9 CC(=O)CC(C)(C)S Amb17593394 [0,1,0,0,1,0|1,0,1]=4 2491 B7R0.9 CC(=O)C[N+](C)(C)C Amb32661846 [0,1,0,0,1,0|2,0,0]=4 2492 B7R0.9 CC(=O)C[N+](C)(C)C Amb32662610 [0,1,0,0,1,0|2,0,0]=4 2493 B7R0.9 CC(=O)C[P+](C)(C)C Amb28285163 [0,1,0,0,1,0|2,0,0]=4 2494 B7R0.9 CC(C)(Br)CC(=O)Cl Amb32665504 [0,1,0,0,1,0|1,0,1]=4 2495 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [0,1,0,0,1,0|0,0,1]=3 2496 B7R0.9 CC(C)(C)CC(=O)Cl Amb3939309 [0,1,0,0,1,0|1,0,1]=4 2497 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [0,1,0,0,1,0|0,0,1]=3 2498 B7R0.9 CC(C)(C)CC(N)=O Amb3886534 [0,1,0,0,1,0|1,0,1]=4 2499 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [0,1,0,0,1,0|0,0,1]=3 2500 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [0,1,0,0,1,0|0,0,1]=3 2501 B7R0.9 CC(C)(N)CC(=O)Cl Amb27173472 [0,1,0,0,1,0|1,0,1]=4 2502 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [0,1,0,0,1,0|0,0,1]=3 2503 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [0,1,0,0,1,0|0,0,1]=3 2504 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [0,1,0,0,1,0|0,0,1]=3 2505 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,1,0|1,0,1]=4 2506 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,1,0|1,0,1]=4 2507 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [0,1,0,0,1,0|0,0,1]=3 2508 B7R0.9 CC(C)(O)CC(=O)[O-] Amb17678748 [0,1,0,0,1,0|0,0,2]=4 2509 B7R0.9 CC(C)(O)CC(=O)[O-] Amb22729769 [0,1,0,0,1,0|0,0,2]=4 2510 B7R0.9 CC(C)(O)CC(N)=O Amb25889946 [0,1,0,0,1,0|1,0,1]=4 2511 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [0,1,0,0,1,0|0,0,1]=3 2512 B7R0.9 CC(C)=CS(=O)(=O)Cl Amb27630073 [0,1,0,0,1,0|1,0,1]=4 2513 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [0,1,0,0,1,0|1,0,1]=4 2514 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [0,1,0,0,1,0|1,0,1]=4 2515 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [0,1,0,0,1,0|1,0,1]=4 2516 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [0,1,0,0,1,0|1,0,1]=4 2517 B7R0.9 CP(=O)(O)CC(=O)O Amb3371772 [0,1,0,0,1,0|2,0,0]=4 2518 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [0,1,0,0,1,0|1,0,0]=3 2519 B7R0.9 CS(=O)(=O)CC(=O)O Amb3939888 [0,1,0,0,1,0|2,0,0]=4 2520 B7R0.9 CS(C)(=O)=CC(N)=O Amb28397881 [0,1,0,0,1,0|2,0,0]=4 2521 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [0,1,0,0,1,0|1,0,0]=3 2522 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [0,1,0,0,1,0|1,0,0]=3 2523 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb10843741 [0,1,0,0,1,0|1,0,1]=4 2524 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb22002454 [0,1,0,0,1,0|1,0,1]=4 2525 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb6599998 [0,1,0,0,1,0|1,0,1]=4 2526 B7R0.9 C[N+](C)(C)CC(N)=O Amb4282755 [0,1,0,0,1,0|2,0,0]=4 2527 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [0,1,0,0,1,0|1,0,0]=3 2528 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [0,1,0,0,1,0|0,1,0]=3 2529 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,1,0,0,1,0|1,0,1]=4 2530 B7R0.16 C=C(C(=O)O)C(=O)Cl Amb28056536 [0,1,0,0,1,0|2,0,0]=4 2531 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,1,0,0,1,0|0,0,1]=3 2532 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,0,0,1,0|1,0,1]=4 2533 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,1,0,0,1,0|1,0,0]=3 2534 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,0,0,1,0|1,0,1]=4 2535 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,1,0,0,1,0|1,0,1]=4 2536 B7R0.16 C=C(C(C)=O)C(C)=O Amb27424014 [0,1,0,0,1,0|2,0,0]=4 2537 B7R0.16 C=C(C(C)=O)C(N)=O Amb27814821 [0,1,0,0,1,0|2,0,0]=4 2538 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,1,0,0,1,0|0,0,1]=3 2539 B7R0.16 C=C(C)C(Br)=C(C)C Amb28284189 [0,1,0,0,1,0|2,0,0]=4 2540 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,1,0,0,1,0|0,0,1]=3 2541 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [0,1,0,0,1,0|1,0,1]=4 2542 B7R0.16 C=C(C)C(Cl)C(C)=O Amb27633869 [0,1,0,0,1,0|1,0,1]=4 2543 B7R0.16 C=C(C)C(N)C(=C)O Amb27762325 [0,1,0,0,1,0|1,0,1]=4 2544 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,1,0,0,1,0|0,0,1]=3 2545 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,1,0,0,1,0|0,0,1]=3 2546 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [0,1,0,0,1,0|1,0,1]=4 2547 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,1,0,0,1,0|0,0,1]=3 2548 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,1,0,0,1,0|0,0,1]=3 2549 B7R0.16 CC(=N)C(C)C(C)=O Amb28315572 [0,1,0,0,1,0|2,0,0]=4 2550 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,1,0,0,1,0|1,0,0]=3 2551 B7R0.16 CC(=O)C(=O)C(C)=O Amb17593178 [0,1,0,0,1,0|2,0,0]=4 2552 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,1,0,0,1,0|1,0,1]=4 2553 B7R0.16 CC(=O)C(=O)N(C)C Amb17399799 [0,1,0,0,1,0|2,0,0]=4 2554 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,1,0,0,1,0|2,0,0]=4 2555 B7R0.16 CC(=O)C(=S)N(C)C Amb27409555 [0,1,0,0,1,0|2,0,0]=4 2556 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,1,0|2,0,0]=4 2557 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,1,0,0,1,0|1,0,1]=4 2558 B7R0.16 CC(=O)C(C)=C(C)C Amb17593162 [0,1,0,0,1,0|1,0,0]=3 2559 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [0,1,0,0,1,0|2,0,0]=4 2560 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [0,1,0,0,1,0|2,0,0]=4 2561 B7R0.16 CC(=O)C(Cl)=C(C)C Amb28048939 [0,1,0,0,1,0|1,0,0]=3 2562 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [0,1,0,0,1,0|2,0,0]=4 2563 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,1,0,0,1,0|1,0,1]=4 2564 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,0,0,1,0|1,0,0]=3 2565 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,1,0,0,1,0|2,0,0]=4 2566 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,1,0,0,1,0|2,0,0]=4 2567 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,1,0,0,1,0|1,0,1]=4 2568 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [0,1,0,0,1,0|2,0,0]=4 2569 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,1,0,0,1,0|1,0,1]=4 2570 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,1,0,0,1,0|1,0,1]=4 2571 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,1,0,0,1,0|1,0,1]=4 2572 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,1,0,0,1,0|1,0,1]=4 2573 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,1,0,0,1,0|1,0,1]=4 2574 B7R0.16 CC(=O)\C(C)=C(/C)N Amb25232464 [0,1,0,0,1,0|2,0,0]=4 2575 B7R0.16 CC(=O)\C(C)=C(\C)Br Amb27265798 [0,1,0,0,1,0|2,0,0]=4 2576 B7R0.16 CC(=O)\C(C)=C(\C)N Amb28316241 [0,1,0,0,1,0|2,0,0]=4 2577 B7R0.16 CC(=O)\C(F)=C(/C)F Amb27798095 [0,1,0,0,1,0|2,0,0]=4 2578 B7R0.16 CC(=O)\C(F)=C(/C)O Amb28384212 [0,1,0,0,1,0|2,0,0]=4 2579 B7R0.16 CC(=O)\C(F)=C(\C)F Amb24645401 [0,1,0,0,1,0|2,0,0]=4 2580 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,1,0,0,1,0|2,0,0]=4 2581 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,1,0,0,1,0|1,0,0]=3 2582 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,0,0,1,0|1,0,1]=4 2583 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,1,0|1,0,1]=4 2584 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,1,0,0,1,0|2,0,0]=4 2585 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,1,0|1,0,0]=3 2586 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,1,0|1,0,0]=3 2587 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,1,0,0,1,0|2,0,0]=4 2588 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,1,0,0,1,0|2,0,0]=4 2589 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,1,0,0,1,0|0,0,0]=2 2590 B7R0.16 CC(C)=C(C)B(O)O Amb21963206 [0,1,0,0,1,0|1,0,1]=4 2591 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,1,0,0,1,0|0,0,0]=2 2592 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,1,0,0,1,0|0,0,0]=2 2593 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,1,0,0,1,0|0,0,0]=2 2594 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,1,0,0,1,0|0,0,1]=3 2595 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,1,0,0,1,0|1,0,1]=4 2596 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,0,0,1,0|0,0,1]=3 2597 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,1,0,0,1,0|0,0,2]=4 2598 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,1,0,0,1,0|0,0,2]=4 2599 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,1,0,0,1,0|1,0,1]=4 2600 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,1,0,0,1,0|1,0,1]=4 2601 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,1,0|0,0,1]=3 2602 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,1,0,0,1,0|1,0,1]=4 2603 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,1,0,0,1,0|1,0,1]=4 2604 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,1,0|0,0,1]=3 2605 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,1,0|1,0,1]=4 2606 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,1,0|0,0,1]=3 2607 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,1,0|0,0,1]=3 2608 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,1,0,0,1,0|1,0,1]=4 2609 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,1,0|0,0,1]=3 2610 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,1,0|1,0,1]=4 2611 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,1,0,0,1,0|1,0,1]=4 2612 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,1,0,0,1,0|1,0,1]=4 2613 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,1,0,0,1,0|1,0,1]=4 2614 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,1,0|0,0,1]=3 2615 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,1,0,0,1,0|1,0,1]=4 2616 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,1,0|0,0,1]=3 2617 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,1,0|0,0,1]=3 2618 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,1,0|0,0,1]=3 2619 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,0,0,1,0|1,0,1]=4 2620 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,1,0,0,1,0|1,0,1]=4 2621 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,1,0|0,0,1]=3 2622 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,1,0|1,0,1]=4 2623 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,1,0|1,0,1]=4 2624 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,1,0,0,1,0|1,0,1]=4 2625 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,1,0|0,0,1]=3 2626 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,1,0,0,1,0|1,0,1]=4 2627 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,1,0|0,0,1]=3 2628 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,1,0|0,0,1]=3 2629 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,0,0,1,0|1,0,1]=4 2630 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,1,0,0,1,0|1,0,1]=4 2631 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,1,0|0,0,1]=3 2632 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,1,0,0,1,0|1,0,1]=4 2633 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,1,0,0,1,0|1,0,1]=4 2634 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,1,0,0,1,0|1,0,1]=4 2635 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,1,0,0,1,0|1,0,1]=4 2636 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,1,0|0,0,1]=3 2637 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,1,0|1,0,1]=4 2638 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,1,0|1,0,1]=4 2639 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,0,0,1,0|1,0,1]=4 2640 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,1,0|1,0,1]=4 2641 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,1,0|1,0,1]=4 2642 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,1,0|1,0,1]=4 2643 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,1,0|1,0,1]=4 2644 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,1,0|1,0,1]=4 2645 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,1,0|1,0,1]=4 2646 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,1,0|1,0,1]=4 2647 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,1,0|1,0,1]=4 2648 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,1,0|1,0,1]=4 2649 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,1,0|1,0,1]=4 2650 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,1,0|1,0,1]=4 2651 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,0,0,1,0|1,0,1]=4 2652 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,1,0|1,0,1]=4 2653 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,1,0|1,0,1]=4 2654 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,1,0|1,0,1]=4 2655 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,1,0|1,0,1]=4 2656 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,1,0|1,0,1]=4 2657 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,1,0|1,0,1]=4 2658 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,1,0|1,0,1]=4 2659 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,0,0,1,0|1,0,1]=4 2660 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,1,0|1,0,1]=4 2661 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,1,0|1,0,1]=4 2662 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,1,0,0,1,0|1,0,0]=3 2663 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,1,0,0,1,0|1,0,0]=3 2664 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,1,0|1,0,0]=3 2665 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,1,0|1,0,0]=3 2666 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,1,0|1,0,0]=3 2667 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,1,0|1,0,1]=4 2668 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,1,0|1,0,1]=4 2669 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,1,0|1,0,1]=4 2670 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,1,0|1,0,1]=4 2671 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,1,0|1,0,1]=4 2672 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,1,0|1,0,1]=4 2673 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,1,0|1,0,1]=4 2674 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,1,0|1,0,1]=4 2675 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,1,0|1,0,1]=4 2676 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,1,0|1,0,1]=4 2677 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,1,0|1,0,1]=4 2678 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,1,0|1,0,1]=4 2679 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,1,0|1,0,1]=4 2680 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,1,0|1,0,1]=4 2681 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,1,0|1,0,1]=4 2682 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,1,0|1,0,1]=4 2683 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,1,0|1,0,0]=3 2684 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,1,0|1,0,1]=4 2685 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,1,0|1,0,1]=4 2686 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,1,0|1,0,1]=4 2687 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,1,0|1,0,1]=4 2688 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,1,0|1,0,1]=4 2689 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,1,0|1,0,1]=4 2690 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,1,0|1,0,1]=4 2691 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,1,0|1,0,1]=4 2692 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,1,0|1,0,1]=4 2693 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,1,0|1,0,1]=4 2694 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,1,0|1,0,1]=4 2695 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,1,0|1,0,1]=4 2696 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,1,0|1,0,1]=4 2697 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,1,0|1,0,1]=4 2698 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,1,0|1,0,1]=4 2699 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,1,0|1,0,1]=4 2700 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,1,0,0,1,0|2,0,0]=4 2701 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,1,0,0,1,0|1,0,0]=3 2702 B7R0.16 C\C(N)=C(/Cl)C(N)=O Amb26578835 [0,1,0,0,1,0|2,0,0]=4 2703 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,1,0,0,1,0|2,0,0]=4 2704 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,1,0,0,1,0|1,0,0]=3 2705 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,1,0,0,1,0|1,0,0]=3 2706 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,1,0,0,1,0|2,0,0]=4 2707 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,1,0|2,0,0]=4 2708 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,1,0,0,1,0|2,0,0]=4 2709 B7R0.16 O=C(O)C(Br)=C(Cl)Cl Amb27827769 [0,1,0,0,1,0|2,0,0]=4 2710 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,1,0,0,1,0|2,0,0]=4 2711 B7R0.16 O=C(O)C(Cl)=C(Cl)Cl Amb2724138 [0,1,0,0,1,0|2,0,0]=4 2712 B7R0.16 O=C(O)C(F)=C(Cl)Cl Amb25732891 [0,1,0,0,1,0|2,0,0]=4 2713 B7R0.16 O=C(O)C(F)=C(F)F Amb27409880 [0,1,0,0,1,0|2,0,0]=4 2714 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,1,0,0,1,0|2,0,0]=4 2715 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,1,0,0,1,0|2,0,0]=4 2716 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,1,0,0,1,0|2,0,0]=4 2717 B9R0.1 C#CC(O)CCC=C(C)C Amb27663119 [0,1,0,0,0,1|1,0,1]=4 2718 B9R0.1 C#C\C(C)=C\CCC(=O)O Amb27461397 [0,1,0,0,0,1|0,0,1]=3 2719 B9R0.1 C=C(C)CCCC(=O)OC Amb25995990 [0,1,0,0,0,1|0,0,2]=4 2720 B9R0.1 C=C(C)CCNC(=O)OC Amb27247131 [0,1,0,0,0,1|0,0,2]=4 2721 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,1,0,0,0,1|0,0,2]=4 2722 B9R0.1 C=C(C)CC\C=C(\C)CBr Amb27481630 [0,1,0,0,0,1|2,0,0]=4 2723 B9R0.1 C=C(C)CC\C=C(\C)CCl Amb27252323 [0,1,0,0,0,1|2,0,0]=4 2724 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,1,0,0,0,1|0,0,2]=4 2725 B9R0.1 C=C(CO)CCC=C(C)C Amb27839217 [0,1,0,0,0,1|1,0,0]=3 2726 B9R0.1 C=CC(=C)CCC=C(C)C Amb3940941 [0,1,0,0,0,1|2,0,0]=4 2727 B9R0.1 C=CC(O)CCC=C(C)C Amb27261714 [0,1,0,0,0,1|1,0,1]=4 2728 B9R0.1 C=C[C@H](O)CCC=C(C)C Amb27403008 [0,1,0,0,0,1|1,0,1]=4 2729 B9R0.1 C=C\C(C)=C\CC=C(C)C Amb6366412 [0,1,0,0,0,1|2,0,0]=4 2730 B9R0.1 CC(=O)CCCC(=O)NO Amb27980256 [0,1,0,0,0,1|1,0,1]=4 2731 B9R0.1 CC(=O)CC\C=C(/C)C#N Amb26498925 [0,1,0,0,0,1|1,0,1]=4 2732 B9R0.1 CC(=O)CC\C=C(/C)C=O Amb18124577 [0,1,0,0,0,1|1,0,1]=4 2733 B9R0.1 CC(=O)CC\C=C(\C)C#N Amb26045659 [0,1,0,0,0,1|1,0,1]=4 2734 B9R0.1 CC(=O)CC\C=C(\C)C=O Amb27195922 [0,1,0,0,0,1|1,0,1]=4 2735 B9R0.1 CC(=O)NCNC(=O)CO Amb27243935 [0,1,0,0,0,1|2,0,0]=4 2736 B9R0.1 CC(=O)OC\C=C(/C)C=O Amb17593584 [0,1,0,0,0,1|1,0,1]=4 2737 B9R0.1 CC(=O)OC\C=C(/C)CBr Amb27801211 [0,1,0,0,0,1|1,0,0]=3 2738 B9R0.1 CC(=O)OC\C=C(/C)CCl Amb27628648 [0,1,0,0,0,1|1,0,0]=3 2739 B9R0.1 CC(=O)OC\C=C(/Cl)CCl Amb27408987 [0,1,0,0,0,1|2,0,0]=4 2740 B9R0.1 CC(=O)OC\C=C(\C)CCl Amb27248168 [0,1,0,0,0,1|1,0,0]=3 2741 B9R0.1 CC(=O)SC\C=C(\C)C=O Amb28411202 [0,1,0,0,0,1|1,0,1]=4 2742 B9R0.1 CC(=O)\C=C\C=C(/C)CBr Amb28057200 [0,1,0,0,0,1|1,0,1]=4 2743 B9R0.1 CC(C)=CCCC(=O)CCl Amb27173844 [0,1,0,0,0,1|1,0,0]=3 2744 B9R0.1 CC(C)=CCCC(=O)CF Amb28249661 [0,1,0,0,0,1|1,0,0]=3 2745 B9R0.1 CC(C)=CCCC(C)C=O Amb3940426 [0,1,0,0,0,1|1,0,1]=4 2746 B9R0.1 CC(C)=CCCC(O)C#N Amb27428089 [0,1,0,0,0,1|1,0,1]=4 2747 B9R0.1 CC(C)=CCC[C@@H](O)CCl Amb27494073 [0,1,0,0,0,1|1,0,1]=4 2748 B9R0.1 CC(C)=CCC[C@H](C)C=O Amb27876463 [0,1,0,0,0,1|1,0,1]=4 2749 B9R0.1 CC(C)=CCC[C@H](C)CO Amb27603484 [0,1,0,0,0,1|1,0,1]=4 2750 B9R0.1 CC(C)=CCC[C@H](O)CO Amb28050222 [0,1,0,0,0,1|0,0,2]=4 2751 B9R0.1 CC(C)=CCC\C(C)=C\Cl Amb27435214 [0,1,0,0,0,1|2,0,0]=4 2752 B9R0.1 CC(C)=CCC\C(C)=C\O Amb28050727 [0,1,0,0,0,1|1,0,0]=3 2753 B9R0.1 CC(C)=CCNC(C)CO Amb28343275 [0,1,0,0,0,1|1,0,1]=4 2754 B9R0.1 CC(C)=CCN[C@H](C)CO Amb28320108 [0,1,0,0,0,1|1,0,1]=4 2755 B9R0.1 CC(C)=CCN\C(N)=N\N Amb28041231 [0,1,0,0,0,1|2,0,0]=4 2756 B9R0.1 CC(C)=CC\C=C(/C)CN Amb35623527 [0,1,0,0,0,1|2,0,0]=4 2757 B9R0.1 CC(C)=CC\C=C(/C)CO Amb27480674 [0,1,0,0,0,1|1,0,0]=3 2758 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,1,0,0,0,1|0,0,2]=4 2759 B9R0.1 CC(C)CCNC(=O)CO Amb9421652 [0,1,0,0,0,1|0,0,2]=4 2760 B9R0.1 CC(C)CCOC(=O)CO Amb27626229 [0,1,0,0,0,1|0,0,2]=4 2761 B9R0.1 CC(C)NCCC(=O)NO Amb27948303 [0,1,0,0,0,1|0,0,2]=4 2762 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,1,0,0,0,1|0,0,2]=4 2763 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,1,0,0,0,1|0,0,2]=4 2764 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,1,0,0,0,1|0,0,2]=4 2765 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,1,0,0,0,1|0,0,2]=4 2766 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,1,0,0,0,1|0,0,2]=4 2767 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,1,0,0,0,1|0,0,2]=4 2768 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,1,0,0,0,1|0,0,2]=4 2769 B9R0.1 CC(CO)N\C=C\C(=O)O Amb27776997 [0,1,0,0,0,1|0,0,2]=4 2770 B9R0.1 CCC(=O)NCC=C(C)C Amb27628319 [0,1,0,0,0,1|1,0,0]=3 2771 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,1,0,0,0,1|1,0,1]=4 2772 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,1,0,0,0,1|1,0,1]=4 2773 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,1,0,0,0,1|1,0,1]=4 2774 B9R0.1 CCC(=O)\C=C\C=C(C)C Amb25735248 [0,1,0,0,0,1|1,0,1]=4 2775 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,1,0,0,0,1|0,0,2]=4 2776 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,1,0,0,0,1|0,0,2]=4 2777 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,1,0,0,0,1|0,0,2]=4 2778 B9R0.1 CCN(C)C\C=C\C(=O)O Amb19020698 [0,1,0,0,0,1|1,0,1]=4 2779 B9R0.1 CC[C@@H](O)CCC=C(C)C Amb27472423 [0,1,0,0,0,1|1,0,1]=4 2780 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,1,0,0,0,1|0,0,2]=4 2781 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [0,1,0,0,0,1|0,0,2]=4 2782 B9R0.1 CC[C@H](O)CCC=C(C)C Amb28050675 [0,1,0,0,0,1|1,0,1]=4 2783 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,1,0,0,0,1|0,0,0]=2 2784 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,1,0,0,0,1|1,0,0]=3 2785 B9R0.1 CN(C)CCNC(=O)CO Amb5798178 [0,1,0,0,0,1|1,0,1]=4 2786 B9R0.1 CN(C)CCOC(=O)CO Amb33016861 [0,1,0,0,0,1|1,0,1]=4 2787 B9R0.1 CNC(=N)NCCC(=O)O Amb26014274 [0,1,0,0,0,1|1,0,1]=4 2788 B9R0.1 CNC(=O)CNCC(=O)O Amb8943036 [0,1,0,0,0,1|1,0,1]=4 2789 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,1,0,0,0,1|1,0,1]=4 2790 B9R0.1 CNC(=O)CSCC(=O)O Amb6251930 [0,1,0,0,0,1|1,0,1]=4 2791 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,1,0,0,0,1|1,0,1]=4 2792 B9R0.1 CNC(=O)NOCC(=O)O Amb27970392 [0,1,0,0,0,1|2,0,0]=4 2793 B9R0.1 CNC(=O)SCC=C(C)C Amb27776881 [0,1,0,0,0,1|1,0,0]=3 2794 B9R0.1 CNC(=S)NOCC(=O)O Amb27201706 [0,1,0,0,0,1|2,0,0]=4 2795 B9R0.1 CNC(=S)S\C=C/C(=O)O Amb28396514 [0,1,0,0,0,1|1,0,1]=4 2796 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,1,0,0,0,1|1,0,1]=4 2797 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,1,0,0,0,1|1,0,1]=4 2798 B9R0.1 COC(=O)CCNC(C)=O Amb15691935 [0,1,0,0,0,1|1,0,1]=4 2799 B9R0.1 COC(=O)CCNC(C)C Amb9203616 [0,1,0,0,0,1|0,0,2]=4 2800 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,1,0,0,0,1|1,0,1]=4 2801 B9R0.1 COC(=O)CCOC(C)=O Amb27972208 [0,1,0,0,0,1|1,0,1]=4 2802 B9R0.1 COC(=O)CCOC(C)C Amb9206383 [0,1,0,0,0,1|0,0,2]=4 2803 B9R0.1 COC(=O)CC\N=C(/C)N Amb27826068 [0,1,0,0,0,1|1,0,1]=4 2804 B9R0.1 COC(=O)CNCC(=O)O Amb7766422 [0,1,0,0,0,1|1,0,1]=4 2805 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,1,0,0,0,1|0,0,2]=4 2806 B9R0.1 COC(=O)CNCN(C)C Amb28041215 [0,1,0,0,0,1|1,0,1]=4 2807 B9R0.1 COC(=O)COCC(=O)O Amb25305044 [0,1,0,0,0,1|1,0,1]=4 2808 B9R0.1 COC(=O)COCC(C)=O Amb8392403 [0,1,0,0,0,1|1,0,1]=4 2809 B9R0.1 COC(=O)COCC(C)C Amb9206382 [0,1,0,0,0,1|0,0,2]=4 2810 B9R0.1 COC(=O)CSCC(=O)O Amb33532171 [0,1,0,0,0,1|1,0,1]=4 2811 B9R0.1 COC(=O)CSCC(C)=O Amb2444691 [0,1,0,0,0,1|1,0,1]=4 2812 B9R0.1 COC(=O)CSCC(C)C Amb839626 [0,1,0,0,0,1|0,0,2]=4 2813 B9R0.1 COC(=O)C\C=C\C(C)=O Amb25205440 [0,1,0,0,0,1|1,0,0]=3 2814 B9R0.1 COC(=O)C\C=C\C(C)O Amb27756374 [0,1,0,0,0,1|1,0,1]=4 2815 B9R0.1 COC(=O)C\C=C\[C@@H](C)O Amb28321357 [0,1,0,0,0,1|1,0,1]=4 2816 B9R0.1 COC(=O)C\N=C\C(C)=O Amb28052024 [0,1,0,0,0,1|1,0,0]=3 2817 B9R0.1 COC(=O)NCC=C(Cl)Cl Amb35690708 [0,1,0,0,0,1|2,0,0]=4 2818 B9R0.1 COC(=O)NCCC(=O)O Amb6468177 [0,1,0,0,0,1|1,0,1]=4 2819 B9R0.1 COC(=O)N\C=C/C(C)=O Amb27627638 [0,1,0,0,0,1|1,0,1]=4 2820 B9R0.1 COC(=O)N\N=C\N(C)C Amb28063793 [0,1,0,0,0,1|2,0,0]=4 2821 B9R0.1 COC(=O)OCCC(C)=O Amb28049880 [0,1,0,0,0,1|1,0,1]=4 2822 B9R0.1 COC(=O)OCCC(C)C Amb27777595 [0,1,0,0,0,1|0,0,2]=4 2823 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,1,0,0,0,1|0,0,2]=4 2824 B9R0.1 COC(=O)\C=C/NC(C)=O Amb28067616 [0,1,0,0,0,1|1,0,1]=4 2825 B9R0.1 COC(=O)\C=C\CC(C)C Amb2689517 [0,1,0,0,0,1|0,0,2]=4 2826 B9R0.1 COC(=O)\C=C\CC(C)C Amb33714772 [0,1,0,0,0,1|0,0,2]=4 2827 B9R0.1 COC(=O)\C=C\CN(C)C Amb17612878 [0,1,0,0,0,1|1,0,1]=4 2828 B9R0.1 COC(=O)\C=C\SC(C)C Amb27197412 [0,1,0,0,0,1|0,0,2]=4 2829 B9R0.1 COC(=S)SCCC(=O)O Amb27983821 [0,1,0,0,0,1|1,0,1]=4 2830 B9R0.1 CON(C)CCCC(=O)O Amb28126925 [0,1,0,0,0,1|1,0,1]=4 2831 B9R0.1 CSC(=N)NCCC(=O)O Amb28193743 [0,1,0,0,0,1|1,0,1]=4 2832 B9R0.1 CSC(C)\C=C/CC(=O)O Amb28121047 [0,1,0,0,0,1|0,0,1]=3 2833 B9R0.1 CSC(C)\C=C\CC(=O)O Amb18645413 [0,1,0,0,0,1|0,0,1]=3 2834 B9R0.1 C\C(=C\C=C\C(=O)O)CO Amb27975896 [0,1,0,0,0,1|0,0,1]=3 2835 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,1,0,0,0,1|1,0,1]=4 2836 B9R0.1 C\C(CCl)=N/OCC(=O)O Amb27831952 [0,1,0,0,0,1|1,0,0]=3 2837 B9R0.1 C\C(CF)=N/OCC(=O)O Amb27174879 [0,1,0,0,0,1|1,0,0]=3 2838 B9R0.1 C\C(Cl)=C/COC(=O)CCl Amb27419892 [0,1,0,0,0,1|2,0,0]=4 2839 B9R0.1 C\C=C(/C)CCC=C(C)C Amb29565318 [0,1,0,0,0,1|2,0,0]=4 2840 B9R0.1 C\C=C(\C)CCC=C(C)C Amb26027238 [0,1,0,0,0,1|2,0,0]=4 2841 B9R0.1 N=C(CN)NCCC(=O)O Amb28346899 [0,1,0,0,0,1|1,0,1]=4 2842 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,1,0,0,0,1|1,0,1]=4 2843 B9R0.1 NCC(=O)CNCC(=O)O Amb27979091 [0,1,0,0,0,1|1,0,1]=4 2844 B9R0.1 NCC(=O)NCCC(=O)O Amb4018061 [0,1,0,0,0,1|1,0,1]=4 2845 B9R0.1 NCC(=O)ONCC(=O)O Amb27625948 [0,1,0,0,0,1|2,0,0]=4 2846 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,1,0,0,0,1|1,0,1]=4 2847 B9R0.1 O=C(O)CCNC(=O)CBr Amb17609911 [0,1,0,0,0,1|1,0,1]=4 2848 B9R0.1 O=C(O)CCNC(=O)CCl Amb2781692 [0,1,0,0,0,1|1,0,1]=4 2849 B9R0.1 O=C(O)CCNC(=O)CO Amb24478846 [0,1,0,0,0,1|1,0,1]=4 2850 B9R0.1 O=C(O)\C=C\NC(=O)CCl Amb27494076 [0,1,0,0,0,1|1,0,1]=4 2851 B9R0.7 C=C(C)C(=O)CCC(C)=O Amb28202297 [0,1,0,0,0,1|1,0,1]=4 2852 B9R0.7 C=C(C)C(=O)NCC(=O)O Amb16232088 [0,1,0,0,0,1|0,0,1]=3 2853 B9R0.7 C=C(C)C(=O)OCC(=O)O Amb18644056 [0,1,0,0,0,1|0,0,1]=3 2854 B9R0.7 C=C(C)C(=O)OCC(C)=O Amb17593585 [0,1,0,0,0,1|1,0,1]=4 2855 B9R0.7 C=C(C)C(=O)OCC(N)=O Amb25709205 [0,1,0,0,0,1|1,0,1]=4 2856 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [0,1,0,0,0,1|0,0,2]=4 2857 B9R0.7 C=C(C)C(Cl)CC=C(C)C Amb27875414 [0,1,0,0,0,1|2,0,0]=4 2858 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,1,0,0,0,1|0,0,2]=4 2859 B9R0.7 C=C(C)CCC(=C)C(=O)O Amb28047421 [0,1,0,0,0,1|0,0,2]=4 2860 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,1,0,0,0,1|0,0,2]=4 2861 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,1,0,0,0,1|0,0,2]=4 2862 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,1,0,0,0,1|0,0,2]=4 2863 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,1,0,0,0,1|0,0,2]=4 2864 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,1,0,0,0,1|0,0,2]=4 2865 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [0,1,0,0,0,1|0,0,2]=4 2866 B9R0.7 C=C(C)\C(C)=C\CC(C)=O Amb27434176 [0,1,0,0,0,1|1,0,1]=4 2867 B9R0.7 C=C(CCC(=O)O)C(=O)O Amb8391367 [0,1,0,0,0,1|2,0,0]=4 2868 B9R0.7 C=C(CCC(=O)O)C(C)=O Amb27814984 [0,1,0,0,0,1|1,0,0]=3 2869 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,1,0,0,0,1|0,0,1]=3 2870 B9R0.7 C=C(CCC(C)=O)C(C)=O Amb25303019 [0,1,0,0,0,1|2,0,0]=4 2871 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,1,0,0,0,1|1,0,1]=4 2872 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,1,0,0,0,1|1,0,1]=4 2873 B9R0.7 C=C(COC(C)=O)C(C)=O Amb25359020 [0,1,0,0,0,1|2,0,0]=4 2874 B9R0.7 C=C(COC(C)C)C(=O)O Amb25958768 [0,1,0,0,0,1|1,0,1]=4 2875 B9R0.7 C=C(C\C=C(/C)Cl)C(C)=O Amb27489726 [0,1,0,0,0,1|2,0,0]=4 2876 B9R0.7 CC(=N)N(C)CCC(=O)O Amb27242469 [0,1,0,0,0,1|1,0,1]=4 2877 B9R0.7 CC(=O)C(=O)NCC(=O)O Amb17593639 [0,1,0,0,0,1|1,0,0]=3 2878 B9R0.7 CC(=O)C(=O)OCC(=O)O Amb28126708 [0,1,0,0,0,1|1,0,0]=3 2879 B9R0.7 CC(=O)C(=O)\C=C\C(=O)O Amb27803733 [0,1,0,0,0,1|1,0,1]=4 2880 B9R0.7 CC(=O)C(Br)CC=C(C)C Amb27614912 [0,1,0,0,0,1|1,0,0]=3 2881 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [0,1,0,0,0,1|1,0,1]=4 2882 B9R0.7 CC(=O)C(F)CC=C(C)C Amb27599420 [0,1,0,0,0,1|1,0,0]=3 2883 B9R0.7 CC(=O)C(F)CCC(=O)O Amb27620074 [0,1,0,0,0,1|1,0,1]=4 2884 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,1,0,0,0,1|1,0,1]=4 2885 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [0,1,0,0,0,1|1,0,1]=4 2886 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,1,0,0,0,1|2,0,0]=4 2887 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,1,0,0,0,1|1,0,1]=4 2888 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,1,0,0,0,1|2,0,0]=4 2889 B9R0.7 CC(=O)CCC(C)=C(C)C Amb27799949 [0,1,0,0,0,1|1,0,0]=3 2890 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,1,0,0,0,1|1,0,1]=4 2891 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,1,0,0,0,1|1,0,1]=4 2892 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,1,0,0,0,1|1,0,1]=4 2893 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,1,0,0,0,1|1,0,1]=4 2894 B9R0.7 CC(=O)CNC(=O)N(C)C Amb27232544 [0,1,0,0,0,1|2,0,0]=4 2895 B9R0.7 CC(=O)COC(=O)C(C)=O Amb27212481 [0,1,0,0,0,1|2,0,0]=4 2896 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,1,0,0,0,1|1,0,1]=4 2897 B9R0.7 CC(=O)CSC(=S)N(C)C Amb28200051 [0,1,0,0,0,1|2,0,0]=4 2898 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [0,1,0,0,0,1|1,0,1]=4 2899 B9R0.7 CC(=O)C\C=C(/C)C(C)=O Amb27264520 [0,1,0,0,0,1|2,0,0]=4 2900 B9R0.7 CC(=O)C\C=C(/C)C(C)C Amb24725292 [0,1,0,0,0,1|1,0,1]=4 2901 B9R0.7 CC(=O)C\C=C(\C)C(C)C Amb24408897 [0,1,0,0,0,1|1,0,1]=4 2902 B9R0.7 CC(=O)N(C)CCC(=O)O Amb2691290 [0,1,0,0,0,1|1,0,1]=4 2903 B9R0.7 CC(=O)N(O)CCC(=O)O Amb28050128 [0,1,0,0,0,1|1,0,1]=4 2904 B9R0.7 CC(=O)NCC(=O)N(C)C Amb20624202 [0,1,0,0,0,1|2,0,0]=4 2905 B9R0.7 CC(=O)NCC(C)=C(C)C Amb28282658 [0,1,0,0,0,1|1,0,0]=3 2906 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,1,0,0,0,1|1,0,1]=4 2907 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [0,1,0,0,0,1|1,0,1]=4 2908 B9R0.7 CC(=O)OCC(=O)C(C)=O Amb25094676 [0,1,0,0,0,1|2,0,0]=4 2909 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,1,0,0,0,1|1,0,1]=4 2910 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [0,1,0,0,0,1|1,0,1]=4 2911 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,1,0,0,0,1|1,0,1]=4 2912 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,1,0,0,0,1|1,0,1]=4 2913 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [0,1,0,0,0,1|1,0,1]=4 2914 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [0,1,0,0,0,1|1,0,1]=4 2915 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,1,0,0,0,1|1,0,1]=4 2916 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,1,0,0,0,1|1,0,1]=4 2917 B9R0.7 CC(=O)ONC(C)C(=O)O Amb27765574 [0,1,0,0,0,1|2,0,0]=4 2918 B9R0.7 CC(=O)O\C=C(\F)C(=O)O Amb27236545 [0,1,0,0,0,1|1,0,1]=4 2919 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,1,0,0,0,1|1,0,1]=4 2920 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [0,1,0,0,0,1|1,0,1]=4 2921 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,1,0,0,0,1|1,0,1]=4 2922 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [0,1,0,0,0,1|1,0,1]=4 2923 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [0,1,0,0,0,1|1,0,1]=4 2924 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [0,1,0,0,0,1|1,0,1]=4 2925 B9R0.7 CC(=O)\C=C\C(C)=C(C)C Amb26841996 [0,1,0,0,0,1|1,0,1]=4 2926 B9R0.7 CC(=O)\C=C\C(F)=C(C)C Amb27490297 [0,1,0,0,0,1|1,0,1]=4 2927 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,1,0,0,0,1|1,0,1]=4 2928 B9R0.7 CC(C)=C(C)\C=C\C(=O)O Amb18643593 [0,1,0,0,0,1|0,0,1]=3 2929 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,1,0,0,0,1|0,0,0]=2 2930 B9R0.7 CC(C)=CCC(C)C(C)O Amb28381787 [0,1,0,0,0,1|1,0,1]=4 2931 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,1,0,0,0,1|0,0,0]=2 2932 B9R0.7 CC(C)=CCC(N)C(N)=O Amb24697159 [0,1,0,0,0,1|1,0,0]=3 2933 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,1,0,0,0,1|0,0,0]=2 2934 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,1,0,0,0,1|0,0,0]=2 2935 B9R0.7 CC(C)=C\C=C(/C)C(=O)O Amb27210759 [0,1,0,0,0,1|0,0,1]=3 2936 B9R0.7 CC(C)=C\C=C(/C)C(N)=O Amb4035443 [0,1,0,0,0,1|1,0,1]=4 2937 B9R0.7 CC(C)=C\C=C(/F)C(=O)O Amb28050050 [0,1,0,0,0,1|0,0,1]=3 2938 B9R0.7 CC(C)=NOC(C)C(=O)O Amb9814220 [0,1,0,0,0,1|1,0,0]=3 2939 B9R0.7 CC(C)=NO[C@H](C)C(=O)O Amb27831924 [0,1,0,0,0,1|1,0,0]=3 2940 B9R0.7 CC(C)C#CC(C)C(=O)O Amb27646536 [0,1,0,0,0,1|0,0,2]=4 2941 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,1,0,0,0,1|0,0,1]=3 2942 B9R0.7 CC(C)C(=O)CNC(N)=O Amb27262218 [0,1,0,0,0,1|1,0,1]=4 2943 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,1,0,0,0,1|0,0,1]=3 2944 B9R0.7 CC(C)C(=O)NCC(N)=O Amb17231981 [0,1,0,0,0,1|1,0,1]=4 2945 B9R0.7 CC(C)C(=O)\C=C\C(=O)O Amb25117573 [0,1,0,0,0,1|0,0,2]=4 2946 B9R0.7 CC(C)C(=S)SCC(=O)O Amb27878469 [0,1,0,0,0,1|0,0,1]=3 2947 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,1,0,0,0,1|0,0,2]=4 2948 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,1,0,0,0,1|0,0,2]=4 2949 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,1,0,0,0,1|0,0,2]=4 2950 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,1,0,0,0,1|0,0,2]=4 2951 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,1,0,0,0,1|0,0,2]=4 2952 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,1,0,0,0,1|0,0,2]=4 2953 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,1,0,0,0,1|0,0,2]=4 2954 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,1,0,0,0,1|0,0,2]=4 2955 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,1,0,0,0,1|0,0,2]=4 2956 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,1,0,0,0,1|0,0,2]=4 2957 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,1,0,0,0,1|0,0,2]=4 2958 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,1,0,0,0,1|0,0,2]=4 2959 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,1,0,0,0,1|0,0,2]=4 2960 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,1,0,0,0,1|0,0,2]=4 2961 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,1,0,0,0,1|0,0,2]=4 2962 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,0,0,0,1|0,0,2]=4 2963 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,0,0,0,1|0,0,2]=4 2964 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,1,0,0,0,1|0,0,2]=4 2965 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,1,0,0,0,1|0,0,2]=4 2966 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,1,0,0,0,1|0,0,2]=4 2967 B9R0.7 CC(C)C\C=C(/F)C(=O)O Amb18124770 [0,1,0,0,0,1|0,0,2]=4 2968 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,1,0,0,0,1|0,0,2]=4 2969 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,1,0,0,0,1|0,0,2]=4 2970 B9R0.7 CC(C)N(C)\C=C\C(=O)O Amb27768790 [0,1,0,0,0,1|0,0,2]=4 2971 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,1,0,0,0,1|0,0,2]=4 2972 B9R0.7 CC(C)OCC(=O)C(=O)O Amb27620494 [0,1,0,0,0,1|1,0,1]=4 2973 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,1,0,0,0,1|0,0,2]=4 2974 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,1,0,0,0,1|0,0,2]=4 2975 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,1,0,0,0,1|0,0,2]=4 2976 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,1,0,0,0,1|0,0,2]=4 2977 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,1,0,0,0,1|0,0,2]=4 2978 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,1,0,0,0,1|0,0,2]=4 2979 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,1,0,0,0,1|0,0,2]=4 2980 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,1,0,0,0,1|0,0,2]=4 2981 B9R0.7 CC(C)S(=O)\C=C\C(=O)O Amb27166984 [0,1,0,0,0,1|0,0,2]=4 2982 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,1,0,0,0,1|0,0,2]=4 2983 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,1,0,0,0,1|0,0,2]=4 2984 B9R0.7 CC(CCC(=O)O)N(C)C Amb32654401 [0,1,0,0,0,1|1,0,1]=4 2985 B9R0.7 CC(CCC(=O)O)N(C)C Amb8010013 [0,1,0,0,0,1|1,0,1]=4 2986 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [0,1,0,0,0,1|1,0,1]=4 2987 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [0,1,0,0,0,1|1,0,1]=4 2988 B9R0.7 CC(CNN(C)C)C(=O)O Amb27855116 [0,1,0,0,0,1|1,0,1]=4 2989 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,1,0,0,0,1|1,0,1]=4 2990 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,1,0,0,0,1|1,0,1]=4 2991 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,1,0,0,0,1|1,0,1]=4 2992 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,1,0,0,0,1|1,0,1]=4 2993 B9R0.7 CC(O)\C=C\C(C)C(=O)O Amb28246267 [0,1,0,0,0,1|1,0,1]=4 2994 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,1,0,0,0,1|1,0,1]=4 2995 B9R0.7 CN(C)C(=O)C#CC(=O)O Amb26940350 [0,1,0,0,0,1|1,0,1]=4 2996 B9R0.7 CN(C)C(=O)CCC(=O)Cl Amb27273505 [0,1,0,0,0,1|2,0,0]=4 2997 B9R0.7 CN(C)C(=O)CCC(=O)O Amb1135807 [0,1,0,0,0,1|1,0,0]=3 2998 B9R0.7 CN(C)C(=O)CCC(N)=O Amb17334218 [0,1,0,0,0,1|2,0,0]=4 2999 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,1,0,0,0,1|1,0,0]=3 3000 B9R0.7 CN(C)C(=O)SCC(=O)O Amb28199270 [0,1,0,0,0,1|1,0,0]=3 3001 B9R0.7 CN(C)C(=O)\C=C/C(=O)O Amb2967257 [0,1,0,0,0,1|1,0,1]=4 3002 B9R0.7 CN(C)C(=O)\C=C\C(=O)O Amb34913235 [0,1,0,0,0,1|1,0,1]=4 3003 B9R0.7 CN(C)C(=S)NCC(=O)O Amb25708504 [0,1,0,0,0,1|1,0,0]=3 3004 B9R0.7 CN(C)C(=S)SCC(=O)O Amb3986957 [0,1,0,0,0,1|1,0,0]=3 3005 B9R0.7 CN(C)C(=S)SCC(N)=O Amb27859156 [0,1,0,0,0,1|2,0,0]=4 3006 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,1,0,0,0,1|1,0,1]=4 3007 B9R0.7 CN(C)CCC(F)C(=O)O Amb27959150 [0,1,0,0,0,1|1,0,1]=4 3008 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [0,1,0,0,0,1|1,0,1]=4 3009 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [0,1,0,0,0,1|1,0,1]=4 3010 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [0,1,0,0,0,1|1,0,1]=4 3011 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [0,1,0,0,0,1|1,0,1]=4 3012 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [0,1,0,0,0,1|1,0,1]=4 3013 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [0,1,0,0,0,1|1,0,1]=4 3014 B9R0.7 CN(C)\C=C\C(=O)C(=O)O Amb27615648 [0,1,0,0,0,1|1,0,1]=4 3015 B9R0.7 CN(N)C(=S)NCC(=O)O Amb26318925 [0,1,0,0,0,1|2,0,0]=4 3016 B9R0.7 CN(O)C(=O)CCC(=O)O Amb27460547 [0,1,0,0,0,1|2,0,0]=4 3017 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,1,0,0,0,1|1,0,1]=4 3018 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 3019 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,1,0,0,0,1|1,0,1]=4 3020 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,1,0,0,0,1|1,0,1]=4 3021 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,1,0,0,0,1|1,0,1]=4 3022 B9R0.7 C[C@H](O)\C=C\[C@@H](C)C(=O)O Amb27617100 [0,1,0,0,0,1|1,0,1]=4 3023 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [0,1,0,0,0,1|1,0,1]=4 3024 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [0,1,0,0,0,1|1,0,1]=4 3025 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [0,1,0,0,0,1|1,0,1]=4 3026 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [0,1,0,0,0,1|1,0,1]=4 3027 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [0,1,0,0,0,1|1,0,1]=4 3028 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [0,1,0,0,0,1|1,0,1]=4 3029 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [0,1,0,0,0,1|1,0,1]=4 3030 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [0,1,0,0,0,1|1,0,1]=4 3031 B9R0.7 C\C(=C/CC(=O)O)C(=O)O Amb27214024 [0,1,0,0,0,1|2,0,0]=4 3032 B9R0.7 C\C(=C/CC(=O)O)C(C)C Amb25866328 [0,1,0,0,0,1|0,0,1]=3 3033 B9R0.7 C\C(=C/CC(C)C)C(=O)O Amb27815070 [0,1,0,0,0,1|0,0,2]=4 3034 B9R0.7 C\C(=C\CC(=O)O)C(=O)O Amb25960751 [0,1,0,0,0,1|2,0,0]=4 3035 B9R0.7 C\C(=C\CC(C)C)C(=O)O Amb27203321 [0,1,0,0,0,1|0,0,2]=4 3036 B9R0.7 C\C(=N/CC(=O)O)C(=O)O Amb27759453 [0,1,0,0,0,1|2,0,0]=4 3037 B9R0.7 C\C(Cl)=C/CC(Cl)C(=O)O Amb27212547 [0,1,0,0,0,1|1,0,0]=3 3038 B9R0.7 C\C(Cl)=C\CC(Cl)C(=O)O Amb17594711 [0,1,0,0,0,1|1,0,0]=3 3039 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,1,0,0,0,1|1,0,0]=3 3040 B9R0.7 N=C(N)C(=N)NCC(=O)O Amb27817484 [0,1,0,0,0,1|2,0,0]=4 3041 B9R0.7 NC(=O)C(=O)NCC(=O)O Amb28050058 [0,1,0,0,0,1|2,0,0]=4 3042 B9R0.7 NC(CC=C(Cl)Cl)C(=O)O Amb28239821 [0,1,0,0,0,1|2,0,0]=4 3043 B9R0.7 N[C@@H](CC=C(Cl)Cl)C(=O)O Amb29866596 [0,1,0,0,0,1|2,0,0]=4 3044 B9R0.7 N[C@H](CC=C(Cl)Cl)C(=O)O Amb29866643 [0,1,0,0,0,1|2,0,0]=4 3045 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb1154117 [0,1,0,0,0,1|2,0,0]=4 3046 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb16232496 [0,1,0,0,0,1|2,0,0]=4 3047 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb22746233 [0,1,0,0,0,1|2,0,0]=4 3048 B9R0.7 O=C(O)CCC(Cl)=C(Cl)Cl Amb27621905 [0,1,0,0,0,1|2,0,0]=4 3049 B9R0.7 O=C(O)CNC(=O)C(=O)O Amb2447304 [0,1,0,0,0,1|2,0,0]=4 3050 B9R0.7 O=C(O)COC(=O)C(=O)O Amb28050116 [0,1,0,0,0,1|2,0,0]=4 3051 B9R0.7 O=C(O)C\C=C(/Cl)C(=O)O Amb27863082 [0,1,0,0,0,1|2,0,0]=4 3052 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,1,0,0,0,1|0,0,2]=4 3053 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,1,0,0,0,1|0,0,1]=3 3054 B9R0.53 CC(=O)CC(=O)CC(C)=O Amb4018226 [0,1,0,0,0,1|2,0,0]=4 3055 B9R0.53 CC(=O)CC(=O)CC(C)C Amb8516702 [0,1,0,0,0,1|1,0,1]=4 3056 B9R0.53 CC(=O)CC(=O)NC(C)=O Amb2410281 [0,1,0,0,0,1|2,0,0]=4 3057 B9R0.53 CC(=O)CC(=O)NN(C)C Amb28121577 [0,1,0,0,0,1|2,0,0]=4 3058 B9R0.53 CC(=O)CC(=O)OC(C)=O Amb28460740 [0,1,0,0,0,1|2,0,0]=4 3059 B9R0.53 CC(=O)CC(=O)OC(C)C Amb6608870 [0,1,0,0,0,1|1,0,1]=4 3060 B9R0.53 CC(=O)CC(=O)\C=C(/C)N Amb28314223 [0,1,0,0,0,1|2,0,0]=4 3061 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [0,1,0,0,0,1|1,0,1]=4 3062 B9R0.53 CC(=O)NC(=O)C=C(C)C Amb27876464 [0,1,0,0,0,1|1,0,1]=4 3063 B9R0.53 CC(=O)NC(=O)CC(=O)O Amb24671240 [0,1,0,0,0,1|1,0,0]=3 3064 B9R0.53 CC(=O)NC(C)CC(=O)O Amb9007551 [0,1,0,0,0,1|1,0,1]=4 3065 B9R0.53 CC(=O)NN(C)CC(=O)O Amb24430379 [0,1,0,0,0,1|2,0,0]=4 3066 B9R0.53 CC(=O)N[C@@H](C)CC(=O)O Amb2372568 [0,1,0,0,0,1|1,0,1]=4 3067 B9R0.53 CC(=O)O[C@@H](C)CC(=O)O Amb28340506 [0,1,0,0,0,1|1,0,1]=4 3068 B9R0.53 CC(=O)SC(C)CC(=O)O Amb4014288 [0,1,0,0,0,1|1,0,1]=4 3069 B9R0.53 CC(=O)[CH-]C(=O)CC(C)=O Amb28182517 [0,1,0,0,0,1|2,0,0]=4 3070 B9R0.53 CC(=O)\C=C(/C)CC(C)=O Amb24647875 [0,1,0,0,0,1|2,0,0]=4 3071 B9R0.53 CC(=O)\C=C(/O)C=C(C)C Amb28198590 [0,1,0,0,0,1|1,0,1]=4 3072 B9R0.53 CC(=O)\C=C(/O)CC(C)=O Amb27945526 [0,1,0,0,0,1|2,0,0]=4 3073 B9R0.53 CC(=O)\C=C(\C)CC(C)=O Amb25719264 [0,1,0,0,0,1|2,0,0]=4 3074 B9R0.53 CC(C)=CC(=O)NC(N)=O Amb27814879 [0,1,0,0,0,1|1,0,1]=4 3075 B9R0.53 CC(C)=CC(C)SC(=N)N Amb27632366 [0,1,0,0,0,1|2,0,0]=4 3076 B9R0.53 CC(C)=CC(N)CC(N)=O Amb25805588 [0,1,0,0,0,1|1,0,0]=3 3077 B9R0.53 CC(C)=C\C(C)=C\C(=O)O Amb27422044 [0,1,0,0,0,1|0,0,1]=3 3078 B9R0.53 CC(C)CC(=N)CC(N)=O Amb27827487 [0,1,0,0,0,1|1,0,1]=4 3079 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,1,0,0,0,1|0,0,2]=4 3080 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,1,0,0,0,1|0,0,2]=4 3081 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,1,0,0,0,1|0,0,2]=4 3082 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,1,0,0,0,1|0,0,2]=4 3083 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,1,0,0,0,1|0,0,2]=4 3084 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,1,0,0,0,1|0,0,2]=4 3085 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,1,0,0,0,1|0,0,2]=4 3086 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,1,0,0,0,1|0,0,2]=4 3087 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,1,0,0,0,1|0,0,2]=4 3088 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,1,0,0,0,1|0,0,2]=4 3089 B9R0.53 CC(C)NC(=O)CC(=O)O Amb17399889 [0,1,0,0,0,1|0,0,1]=3 3090 B9R0.53 CC(C)NC(=O)CC(N)=O Amb28050038 [0,1,0,0,0,1|1,0,1]=4 3091 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,1,0,0,0,1|0,0,2]=4 3092 B9R0.53 CC(C)OC(=O)CC(=O)O Amb25887628 [0,1,0,0,0,1|0,0,1]=3 3093 B9R0.53 CC(C)OC(=O)CC(N)=O Amb27765049 [0,1,0,0,0,1|1,0,1]=4 3094 B9R0.53 CC(CC(=O)O)CN(C)C Amb27948144 [0,1,0,0,0,1|1,0,1]=4 3095 B9R0.53 CC(CC(=O)O)CN(C)C Amb32680754 [0,1,0,0,0,1|1,0,1]=4 3096 B9R0.53 CC(CC(=O)O)NN(C)C Amb28317947 [0,1,0,0,0,1|1,0,1]=4 3097 B9R0.53 CN(C)CC(O)CC(=O)O Amb4477325 [0,1,0,0,0,1|1,0,1]=4 3098 B9R0.53 CN(C)C[C@H](O)CC(=O)O Amb10069803 [0,1,0,0,0,1|1,0,1]=4 3099 B9R0.53 CN(C)NC(=O)CC(=O)O Amb20246800 [0,1,0,0,0,1|1,0,0]=3 3100 B9R0.53 C\C(=C/C(=O)O)CC(=O)O Amb24556420 [0,1,0,0,0,1|2,0,0]=4 3101 B9R0.53 C\C(=C\C(=O)O)CC(=O)O Amb26421861 [0,1,0,0,0,1|2,0,0]=4 3102 B9R0.53 C\C(=C\C(=O)O)CC(C)C Amb26947874 [0,1,0,0,0,1|0,0,2]=4 3103 B9R0.53 C\C(=C\C(C)C)CC(=O)O Amb27784871 [0,1,0,0,0,1|0,0,1]=3 3104 B9R0.53 NC(=O)NC(=O)CC(=O)O Amb25887627 [0,1,0,0,0,1|2,0,0]=4 3105 B9R0.53 O=C(O)CC(=O)CC(=O)O Amb6298323 [0,1,0,0,0,1|2,0,0]=4 3106 B9R0.53 O=C(O)\C=C(\Cl)CC(=O)O Amb2612119 [0,1,0,0,0,1|2,0,0]=4 3107 B9R0.56 CC(=O)C\C=C\[Si](C)(C)C Amb26447708 [0,1,0,0,0,1|1,1,0]=4 3108 B9R0.56 CC(C)(C)C=C=CC(=O)O Amb17593545 [0,1,0,0,0,1|0,0,2]=4 3109 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [0,1,0,0,0,1|0,0,2]=4 3110 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,1,0,0,0,1|0,0,2]=4 3111 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,1,0,0,0,1|0,0,2]=4 3112 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [0,1,0,0,0,1|0,0,2]=4 3113 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [0,1,0,0,0,1|0,0,2]=4 3114 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [0,1,0,0,0,1|0,0,2]=4 3115 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [0,1,0,0,0,1|0,0,2]=4 3116 B9R0.56 CC(C)(C)OCCC(=O)O Amb2691288 [0,1,0,0,0,1|0,0,2]=4 3117 B9R0.56 CC(C)(C)SCCC(=O)O Amb6680208 [0,1,0,0,0,1|0,0,2]=4 3118 B9R0.56 CC(C)(C)\C=C\CC(=O)O Amb24608675 [0,1,0,0,0,1|0,0,1]=3 3119 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [0,1,0,0,0,1|0,0,2]=4 3120 B9R0.56 CC(C)(N)COCC(=O)O Amb18630788 [0,1,0,0,0,1|0,0,2]=4 3121 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [0,1,0,0,0,1|0,0,2]=4 3122 B9R0.56 CC(C)(O)CSCC(=O)O Amb18307056 [0,1,0,0,0,1|0,0,2]=4 3123 B9R0.56 CC(C)(O)C\C=C\C(=O)O Amb18644104 [0,1,0,0,0,1|0,0,2]=4 3124 B9R0.56 CC(C)=CCCS(=O)(=O)Cl Amb32667983 [0,1,0,0,0,1|1,0,1]=4 3125 B9R0.56 CC(C)=CCCS(N)(=O)=O Amb30024156 [0,1,0,0,0,1|1,0,1]=4 3126 B9R0.56 CC(C)=CCNS(C)(=N)=O Amb30019548 [0,1,0,0,0,1|2,0,0]=4 3127 B9R0.56 CP(C)(=O)CNCC(=O)O Amb25339632 [0,1,0,0,0,1|1,0,1]=4 3128 B9R0.56 C[N+](C)(C)CCCC(=O)O Amb9825976 [0,1,0,0,0,1|1,0,1]=4 3129 B9R0.56 C[Si](C)(C)C#CCC(=O)O Amb25273592 [0,1,0,0,0,1|0,1,1]=4 3130 B9R0.56 C[Si](C)(C)CCCC(=O)O Amb26455818 [0,1,0,0,0,1|0,1,1]=4 3131 B9R0.56 C[Si](C)(C)C\C=C/C(=O)O Amb27434781 [0,1,0,0,0,1|0,1,1]=4 3132 B9R0.56 C[Si](C)(C)O\C=C\C(=O)O Amb27863599 [0,1,0,0,0,1|0,1,1]=4 3133 B9R0.21 CC(C)(C)NCC(=O)NO Amb27830850 [0,2,0,0,0,0|1,0,1]=4 3134 B9R0.21 CC(C)(C)OCC(=O)NO Amb27425147 [0,2,0,0,0,0|1,0,1]=4 3135 B9R0.21 COC(=O)CCC(C)(C)N Amb19415866 [0,2,0,0,0,0|0,0,2]=4 3136 B9R0.21 COC(=O)CCC(C)(C)N Amb24383846 [0,2,0,0,0,0|0,0,2]=4 3137 B9R0.21 COC(=O)CC[Si](C)(C)C Amb25681301 [0,2,0,0,0,0|0,1,1]=4 3138 B9R0.21 COC(=O)CNC(C)(C)C Amb2779525 [0,2,0,0,0,0|1,0,1]=4 3139 B9R0.21 COC(=O)COC(C)(C)C Amb7789989 [0,2,0,0,0,0|1,0,1]=4 3140 B9R0.21 COC(=O)CSC(C)(C)C Amb7752950 [0,2,0,0,0,0|1,0,1]=4 3141 B9R0.21 COC(=O)\C=C\C(C)(C)C Amb32789660 [0,2,0,0,0,0|0,0,2]=4 3142 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330542 [0,2,0,0,0,0|0,0,2]=4 3143 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330543 [0,2,0,0,0,0|0,0,2]=4 3144 B9R0.21 C\C(=C/CS(C)(=O)=O)CCl Amb27974126 [0,2,0,0,0,0|1,0,1]=4 3145 B9R0.21 C\C(=C/CS(C)(=O)=O)CN Amb27839437 [0,2,0,0,0,0|1,0,1]=4 3146 B9R0.23 C=C(C)CC(C)C(=O)OC Amb27857780 [0,2,0,0,0,0|0,0,2]=4 3147 B9R0.23 C=C(C)CC(Cl)C(=O)OC Amb28051409 [0,2,0,0,0,0|0,0,2]=4 3148 B9R0.23 C=C(C)CC(N)C(=O)OC Amb26654974 [0,2,0,0,0,0|0,0,2]=4 3149 B9R0.23 C=C(C)CC(O)C(=O)OC Amb24464009 [0,2,0,0,0,0|0,0,2]=4 3150 B9R0.23 C=C(C)C[C@@H](O)C(=O)OC Amb27219810 [0,2,0,0,0,0|0,0,2]=4 3151 B9R0.23 C=C(CC(=O)O)C(=O)OC Amb4034427 [0,2,0,0,0,0|1,0,0]=3 3152 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,2,0,0,0,0|0,0,2]=4 3153 B9R0.23 C=C(CC)C(O)C=C(C)C Amb27839347 [0,2,0,0,0,0|2,0,0]=4 3154 B9R0.23 CC(C)=C=C(C)C(=O)CO Amb28049895 [0,2,0,0,0,0|0,0,2]=4 3155 B9R0.23 CC(C)=CC(=O)C(=O)CBr Amb27777252 [0,2,0,0,0,0|1,0,1]=4 3156 B9R0.23 CC(C)CC(N)C(=O)NO Amb27264492 [0,2,0,0,0,0|0,0,2]=4 3157 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,2,0,0,0,0|0,0,2]=4 3158 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,2,0,0,0,0|1,0,1]=4 3159 B9R0.23 CCC(=O)N(C)CC(=O)O Amb1113094 [0,2,0,0,0,0|2,0,0]=4 3160 B9R0.23 CCC(C)C(=N)CC(C)=O Amb27629398 [0,2,0,0,0,0|1,0,1]=4 3161 B9R0.23 CCC(C)C(=O)CC(C)=O Amb24544654 [0,2,0,0,0,0|1,0,1]=4 3162 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,2,0,0,0,0|0,0,2]=4 3163 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,2,0,0,0,0|0,0,2]=4 3164 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,2,0,0,0,0|0,0,2]=4 3165 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,2,0,0,0,0|1,0,1]=4 3166 B9R0.23 CCC(C)S(=O)CC(=O)O Amb18523822 [0,2,0,0,0,0|1,0,1]=4 3167 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,2,0,0,0,0|0,0,2]=4 3168 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,2,0,0,0,0|0,0,2]=4 3169 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,2,0,0,0,0|0,0,2]=4 3170 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,2,0,0,0,0|0,0,2]=4 3171 B9R0.23 CCC(C)\C(C)=C\C(=O)O Amb27837581 [0,2,0,0,0,0|0,0,2]=4 3172 B9R0.23 CCC(C)\C(Cl)=C\C(=O)O Amb28254394 [0,2,0,0,0,0|0,0,2]=4 3173 B9R0.23 CCN(C)C(=O)CC(=O)O Amb18987423 [0,2,0,0,0,0|1,0,0]=3 3174 B9R0.23 CCN(C)C(=O)CC(N)=O Amb16233768 [0,2,0,0,0,0|2,0,0]=4 3175 B9R0.23 CCN(C)C(C)CC(=O)O Amb22587145 [0,2,0,0,0,0|1,0,1]=4 3176 B9R0.23 CCN(C)C(C)CC(=O)O Amb9399322 [0,2,0,0,0,0|1,0,1]=4 3177 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,2,0,0,0,0|0,0,2]=4 3178 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,2,0,0,0,0|0,0,2]=4 3179 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,2,0,0,0,0|0,0,2]=4 3180 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,2,0,0,0,0|0,0,2]=4 3181 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,2,0,0,0,0|0,0,2]=4 3182 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,2,0,0,0,0|0,0,2]=4 3183 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,2,0,0,0,0|0,0,0]=2 3184 B9R0.23 CN(CC(=O)O)C(=O)CCl Amb21956220 [0,2,0,0,0,0|2,0,0]=4 3185 B9R0.23 CN(CC(=O)O)C(=O)CN Amb21929346 [0,2,0,0,0,0|2,0,0]=4 3186 B9R0.23 CN(CC(=O)O)C(=O)CO Amb25848387 [0,2,0,0,0,0|2,0,0]=4 3187 B9R0.23 CN(CC(=O)O)C(=O)CS Amb27406788 [0,2,0,0,0,0|2,0,0]=4 3188 B9R0.23 CNC(=N)N(C)CC(=O)O Amb27465437 [0,2,0,0,0,0|2,0,0]=4 3189 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,2,0,0,0,0|1,0,1]=4 3190 B9R0.23 CNC(=O)\C(C)=C\C(=O)O Amb27202767 [0,2,0,0,0,0|1,0,1]=4 3191 B9R0.23 COC(=O)C(=O)CC(C)=O Amb1155424 [0,2,0,0,0,0|2,0,0]=4 3192 B9R0.23 COC(=O)C(Br)CC(=O)O Amb18656999 [0,2,0,0,0,0|1,0,1]=4 3193 B9R0.23 COC(=O)C(Br)CC(C)C Amb22490955 [0,2,0,0,0,0|0,0,2]=4 3194 B9R0.23 COC(=O)C(C)=C=C(C)C Amb32423563 [0,2,0,0,0,0|0,0,2]=4 3195 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [0,2,0,0,0,0|1,0,1]=4 3196 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,2,0,0,0,0|1,0,1]=4 3197 B9R0.23 COC(=O)C(C)CN(C)C Amb8428189 [0,2,0,0,0,0|1,0,1]=4 3198 B9R0.23 COC(=O)C(C)NC(C)=O Amb24650565 [0,2,0,0,0,0|2,0,0]=4 3199 B9R0.23 COC(=O)C(C)NC(C)=S Amb27838032 [0,2,0,0,0,0|2,0,0]=4 3200 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,2,0,0,0,0|1,0,1]=4 3201 B9R0.23 COC(=O)C(C)NN(C)C Amb27985422 [0,2,0,0,0,0|2,0,0]=4 3202 B9R0.23 COC(=O)C(Cl)CC(=O)O Amb27589899 [0,2,0,0,0,0|1,0,1]=4 3203 B9R0.23 COC(=O)C(Cl)CC(C)C Amb18800856 [0,2,0,0,0,0|0,0,2]=4 3204 B9R0.23 COC(=O)C(Cl)NC(C)=O Amb28193243 [0,2,0,0,0,0|2,0,0]=4 3205 B9R0.23 COC(=O)C(F)CC(=O)O Amb27837974 [0,2,0,0,0,0|1,0,1]=4 3206 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,2,0,0,0,0|1,0,1]=4 3207 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,2,0,0,0,0|1,0,1]=4 3208 B9R0.23 COC(=O)C(N)CC(C)C Amb1152419 [0,2,0,0,0,0|0,0,2]=4 3209 B9R0.23 COC(=O)C(N)CC(C)C Amb22489476 [0,2,0,0,0,0|0,0,2]=4 3210 B9R0.23 COC(=O)C(N)CC(C)C Amb932819 [0,2,0,0,0,0|0,0,2]=4 3211 B9R0.23 COC(=O)C(N)CN(C)C Amb24715537 [0,2,0,0,0,0|1,0,1]=4 3212 B9R0.23 COC(=O)C(N)CN(C)C Amb28555446 [0,2,0,0,0,0|1,0,1]=4 3213 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [0,2,0,0,0,0|1,0,1]=4 3214 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,2,0,0,0,0|0,0,2]=4 3215 B9R0.23 COC(=O)N(C)CC(=O)O Amb6668732 [0,2,0,0,0,0|2,0,0]=4 3216 B9R0.23 COC(=O)N(C)N=C(C)C Amb28049740 [0,2,0,0,0,0|2,0,0]=4 3217 B9R0.23 COC(=O)[C@@H](Br)CC(C)C Amb27400688 [0,2,0,0,0,0|0,0,2]=4 3218 B9R0.23 COC(=O)[C@@H](C)NC(C)=O Amb17621817 [0,2,0,0,0,0|2,0,0]=4 3219 B9R0.23 COC(=O)[C@@H](C)OC(C)=O Amb28314265 [0,2,0,0,0,0|2,0,0]=4 3220 B9R0.23 COC(=O)[C@@H](F)CC(=O)O Amb27406311 [0,2,0,0,0,0|1,0,1]=4 3221 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,2,0,0,0,0|1,0,1]=4 3222 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,2,0,0,0,0|1,0,1]=4 3223 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb533935 [0,2,0,0,0,0|0,0,2]=4 3224 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb8513236 [0,2,0,0,0,0|0,0,2]=4 3225 B9R0.23 COC(=O)[C@@H](N)CN(C)C Amb31295179 [0,2,0,0,0,0|1,0,1]=4 3226 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [0,2,0,0,0,0|1,0,1]=4 3227 B9R0.23 COC(=O)[C@H](Br)CC(C)C Amb27796257 [0,2,0,0,0,0|0,0,2]=4 3228 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [0,2,0,0,0,0|1,0,1]=4 3229 B9R0.23 COC(=O)[C@H](C)NC(C)=O Amb4034849 [0,2,0,0,0,0|2,0,0]=4 3230 B9R0.23 COC(=O)[C@H](C)NC(C)=S Amb26907443 [0,2,0,0,0,0|2,0,0]=4 3231 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,2,0,0,0,0|1,0,1]=4 3232 B9R0.23 COC(=O)[C@H](Cl)CC(=O)O Amb27232518 [0,2,0,0,0,0|1,0,1]=4 3233 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,2,0,0,0,0|1,0,1]=4 3234 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb2719741 [0,2,0,0,0,0|0,0,2]=4 3235 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb3941143 [0,2,0,0,0,0|0,0,2]=4 3236 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [0,2,0,0,0,0|0,0,0]=2 3237 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [0,2,0,0,0,0|1,0,1]=4 3238 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,2,0,0,0,0|0,0,2]=4 3239 B9R0.23 COC(=O)\C(Br)=C\C(=O)O Amb15695379 [0,2,0,0,0,0|1,0,1]=4 3240 B9R0.23 COC(=O)\C(C)=C\C(=O)O Amb27221493 [0,2,0,0,0,0|1,0,1]=4 3241 B9R0.23 COC(=O)\C(C)=C\C(C)=O Amb27164598 [0,2,0,0,0,0|1,0,1]=4 3242 B9R0.23 COC(=O)\C(F)=C\C(=O)O Amb28288995 [0,2,0,0,0,0|1,0,1]=4 3243 B9R0.23 COC(=O)\C(I)=C\C(C)C Amb27230893 [0,2,0,0,0,0|0,0,2]=4 3244 B9R0.23 COC(=O)\C(N)=C\C(C)=O Amb24411031 [0,2,0,0,0,0|1,0,1]=4 3245 B9R0.23 COC(=O)\C(N)=C\C(C)C Amb28050074 [0,2,0,0,0,0|0,0,2]=4 3246 B9R0.23 COC(=O)\C(O)=C\C(C)=O Amb1981446 [0,2,0,0,0,0|1,0,1]=4 3247 B9R0.23 COC(=O)\C([O-])=C\C(C)=O Amb29083217 [0,2,0,0,0,0|1,0,1]=4 3248 B9R0.23 COC(=S)N(C)CC(=O)O Amb24514158 [0,2,0,0,0,0|2,0,0]=4 3249 B9R0.23 COC(C)C(=O)CC(C)=O Amb26479508 [0,2,0,0,0,0|1,0,1]=4 3250 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,2,0,0,0,0|0,0,2]=4 3251 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,2,0,0,0,0|0,0,2]=4 3252 B9R0.23 CON(C)C(=O)CC(C)=O Amb26436045 [0,2,0,0,0,0|2,0,0]=4 3253 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,2,0,0,0,0|0,0,2]=4 3254 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,2,0,0,0,0|0,0,2]=4 3255 B9R0.23 CSC(=N)N(C)CC(=O)O Amb27834370 [0,2,0,0,0,0|2,0,0]=4 3256 B9R0.23 CSC(=S)N(C)CC(=O)O Amb26852199 [0,2,0,0,0,0|2,0,0]=4 3257 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,2,0,0,0,0|1,0,1]=4 3258 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,2,0,0,0,0|0,0,2]=4 3259 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,2,0,0,0,0|1,0,1]=4 3260 B9R0.23 C\C=C(\C)C(=O)NC(C)=O Amb27810928 [0,2,0,0,0,0|2,0,0]=4 3261 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,2,0,0,0,0|0,0,1]=3 3262 B9R0.23 C\C=C(\C)C(O)C=C(C)C Amb27171286 [0,2,0,0,0,0|2,0,0]=4 3263 B9R0.23 O=C(O)CC(Br)C(=O)CBr Amb15772353 [0,2,0,0,0,0|1,0,1]=4 3264 B9R0.23 O=C(O)CC(S)C(=O)CS Amb27758589 [0,2,0,0,0,0|1,0,1]=4 3265 B9R0.24 C=C\C(C)=C/CC(=O)NC Amb28400323 [0,2,0,0,0,0|1,0,1]=4 3266 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,2]=4 3267 B9R0.24 CCC(C)NCC(=O)OC Amb6687134 [0,2,0,0,0,0|1,0,1]=4 3268 B9R0.24 CCC(C)\C=C/C(=O)OC Amb27760361 [0,2,0,0,0,0|0,0,2]=4 3269 B9R0.24 CCC(C)\C=C\C(=O)OC Amb28049396 [0,2,0,0,0,0|0,0,2]=4 3270 B9R0.24 CCN(C)CCC(=O)OC Amb8890963 [0,2,0,0,0,0|1,0,1]=4 3271 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,1]=4 3272 B9R0.24 CNC(=O)SCC(=O)OC Amb27180433 [0,2,0,0,0,0|2,0,0]=4 3273 B9R0.24 COC(=O)C=C=C(C)CO Amb28281347 [0,2,0,0,0,0|0,0,2]=4 3274 B9R0.24 COC(=O)CCC(=O)CBr Amb33526898 [0,2,0,0,0,0|1,0,1]=4 3275 B9R0.24 COC(=O)CCC(=O)CCl Amb26649344 [0,2,0,0,0,0|1,0,1]=4 3276 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,1]=4 3277 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,2,0,0,0,0|1,0,1]=4 3278 B9R0.24 COC(=O)CCC(=O)NO Amb28454716 [0,2,0,0,0,0|1,0,1]=4 3279 B9R0.24 COC(=O)CCC(=O)OC Amb2793094 [0,2,0,0,0,0|1,0,1]=4 3280 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,2,0,0,0,0|0,0,2]=4 3281 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,2,0,0,0,0|0,0,2]=4 3282 B9R0.24 COC(=O)CCC(C)OC Amb26355788 [0,2,0,0,0,0|0,0,2]=4 3283 B9R0.24 COC(=O)CCN(C)OC Amb27206937 [0,2,0,0,0,0|1,0,1]=4 3284 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,2,0,0,0,0|0,0,2]=4 3285 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,2,0,0,0,0|0,0,2]=4 3286 B9R0.24 COC(=O)CC\C(C)=N\O Amb28064373 [0,2,0,0,0,0|1,0,1]=4 3287 B9R0.24 COC(=O)CNC(=O)CBr Amb17329958 [0,2,0,0,0,0|2,0,0]=4 3288 B9R0.24 COC(=O)CNC(=O)CCl Amb367447 [0,2,0,0,0,0|2,0,0]=4 3289 B9R0.24 COC(=O)CNC(=O)CN Amb2701513 [0,2,0,0,0,0|2,0,0]=4 3290 B9R0.24 COC(=O)CNC(=O)CN Amb5783125 [0,2,0,0,0,0|2,0,0]=4 3291 B9R0.24 COC(=O)CNC(=O)CO Amb28410960 [0,2,0,0,0,0|2,0,0]=4 3292 B9R0.24 COC(=O)CNC(=O)OC Amb9265412 [0,2,0,0,0,0|2,0,0]=4 3293 B9R0.24 COC(=O)CNC(=O)SC Amb24620395 [0,2,0,0,0,0|2,0,0]=4 3294 B9R0.24 COC(=O)COC(=O)CO Amb28206230 [0,2,0,0,0,0|2,0,0]=4 3295 B9R0.24 COC(=O)CSC(=O)CCl Amb27407672 [0,2,0,0,0,0|2,0,0]=4 3296 B9R0.24 COC(=O)C\C=C(\C)CO Amb28050664 [0,2,0,0,0,0|0,0,0]=2 3297 B9R0.24 COC(=O)C\N=C(/C)OC Amb27632931 [0,2,0,0,0,0|1,0,0]=3 3298 B9R0.24 COC(=O)NCC(=O)NO Amb27211651 [0,2,0,0,0,0|2,0,0]=4 3299 B9R0.24 COC(=O)N\C=C(/C)C=O Amb27837939 [0,2,0,0,0,0|1,0,1]=4 3300 B9R0.24 COC(=O)N\N=C(\C)CCl Amb28346299 [0,2,0,0,0,0|2,0,0]=4 3301 B9R0.24 COC(=O)O\C=C(\C)C=O Amb27640699 [0,2,0,0,0,0|1,0,1]=4 3302 B9R0.24 COC(=O)\C=C/C(=O)OC Amb8514575 [0,2,0,0,0,0|1,0,1]=4 3303 B9R0.24 COC(=O)\C=C\C(=O)CBr Amb26539741 [0,2,0,0,0,0|1,0,1]=4 3304 B9R0.24 COC(=O)\C=C\C(=O)OC Amb1789270 [0,2,0,0,0,0|1,0,1]=4 3305 B9R0.24 COC(=O)\C=C\C(C)CO Amb28454593 [0,2,0,0,0,0|0,0,2]=4 3306 B9R0.24 C\C=C(/C)CNC(=O)OC Amb28346258 [0,2,0,0,0,0|1,0,1]=4 3307 B9R0.24 C\C=C(C)\C=C\C(=O)CC Amb27204819 [0,2,0,0,0,0|1,0,1]=4 3308 B9R0.42 C=C(C)C(=O)CC(=O)OC Amb26925268 [0,2,0,0,0,0|0,0,1]=3 3309 B9R0.42 C=C(C)C(O)CC(=O)OC Amb27839501 [0,2,0,0,0,0|0,0,2]=4 3310 B9R0.42 C=C(C)[C@@H](O)CC(=O)OC Amb33199529 [0,2,0,0,0,0|0,0,2]=4 3311 B9R0.42 C=C(C)[C@H](O)CC(=O)OC Amb33199525 [0,2,0,0,0,0|0,0,2]=4 3312 B9R0.42 C=C(C=O)CC(=O)C(C)C Amb28436744 [0,2,0,0,0,0|1,0,1]=4 3313 B9R0.42 C=C(CC(=O)OC)C(=O)O Amb4035034 [0,2,0,0,0,0|2,0,0]=4 3314 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,2,0,0,0,0|0,0,2]=4 3315 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,2,0,0,0,0|0,0,2]=4 3316 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,2,0,0,0,0|0,0,2]=4 3317 B9R0.42 C=C(OC(=O)OC)C(C)=O Amb25951847 [0,2,0,0,0,0|2,0,0]=4 3318 B9R0.42 C=C\C(C)=C/[C@@H](C)C(C)=O Amb25991210 [0,2,0,0,0,0|1,0,1]=4 3319 B9R0.42 CC(=C/Br)\C=C(/C)C(=O)O Amb28050022 [0,2,0,0,0,0|0,0,2]=4 3320 B9R0.42 CC(=O)C(C)\C=C(/C)C=O Amb27753996 [0,2,0,0,0,0|1,0,1]=4 3321 B9R0.42 CC(=O)C(C)\C=C(\C)CO Amb27490625 [0,2,0,0,0,0|1,0,0]=3 3322 B9R0.42 CC(=O)N(C)CC(=O)NO Amb28291755 [0,2,0,0,0,0|2,0,0]=4 3323 B9R0.42 CC(C)=C(C)\C=C(/C)C=O Amb28052687 [0,2,0,0,0,0|1,0,1]=4 3324 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [0,2,0,0,0,0|1,0,1]=4 3325 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,2,0,0,0,0|0,0,2]=4 3326 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,2,0,0,0,0|0,0,2]=4 3327 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,2,0,0,0,0|0,0,2]=4 3328 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,2,0,0,0,0|0,0,2]=4 3329 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,2,0,0,0,0|0,0,2]=4 3330 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,2,0,0,0,0|1,0,1]=4 3331 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,2,0,0,0,0|1,0,1]=4 3332 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,2,0,0,0,0|1,0,1]=4 3333 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,2,0,0,0,0|1,0,1]=4 3334 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [0,2,0,0,0,0|2,0,0]=4 3335 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [0,2,0,0,0,0|2,0,0]=4 3336 B9R0.42 CC(OC(=O)CCl)C(=O)O Amb28042677 [0,2,0,0,0,0|2,0,0]=4 3337 B9R0.42 CCC(=O)CC(=O)C(C)=O Amb25110491 [0,2,0,0,0,0|2,0,0]=4 3338 B9R0.42 CCC(=O)CC(=O)C(C)C Amb9775083 [0,2,0,0,0,0|1,0,1]=4 3339 B9R0.42 CCC(=O)CC(=S)N(C)C Amb24357254 [0,2,0,0,0,0|2,0,0]=4 3340 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,2,0,0,0,0|1,0,1]=4 3341 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,2,0,0,0,0|1,0,1]=4 3342 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,2,0,0,0,0|1,0,1]=4 3343 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,2,0,0,0,0|1,0,1]=4 3344 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,2,0,0,0,0|1,0,1]=4 3345 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [0,2,0,0,0,0|2,0,0]=4 3346 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [0,2,0,0,0,0|2,0,0]=4 3347 B9R0.42 CCC(=O)\C=C(/C)C(=O)O Amb27613306 [0,2,0,0,0,0|1,0,1]=4 3348 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,2,0,0,0,0|0,0,2]=4 3349 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,2,0,0,0,0|0,0,2]=4 3350 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,2,0,0,0,0|0,0,2]=4 3351 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,2,0,0,0,0|0,0,2]=4 3352 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,2,0,0,0,0|0,0,2]=4 3353 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,2,0,0,0,0|0,0,2]=4 3354 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,2,0,0,0,0|0,0,2]=4 3355 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,2,0,0,0,0|0,0,2]=4 3356 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,2,0,0,0,0|0,0,2]=4 3357 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,2,0,0,0,0|0,0,2]=4 3358 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,2,0,0,0,0|1,0,1]=4 3359 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,2,0,0,0,0|1,0,1]=4 3360 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,2,0,0,0,0|1,0,1]=4 3361 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,2,0,0,0,0|1,0,1]=4 3362 B9R0.42 CCC(C)\C=C(/C)C(=O)O Amb18643945 [0,2,0,0,0,0|0,0,2]=4 3363 B9R0.42 CCC(C)\C=C(\C)C(=O)O Amb27837721 [0,2,0,0,0,0|0,0,2]=4 3364 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [0,2,0,0,0,0|1,0,1]=4 3365 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [0,2,0,0,0,0|1,0,1]=4 3366 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,2,0,0,0,0|1,0,1]=4 3367 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,2,0,0,0,0|0,0,2]=4 3368 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,2,0,0,0,0|0,0,2]=4 3369 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,2,0,0,0,0|0,0,2]=4 3370 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,2,0,0,0,0|0,0,2]=4 3371 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,2,0,0,0,0|0,0,2]=4 3372 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,2,0,0,0,0|0,0,2]=4 3373 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,2,0,0,0,0|0,0,2]=4 3374 B9R0.42 CC[C@H](C)\C=C(/C)C(=O)O Amb27831923 [0,2,0,0,0,0|0,0,2]=4 3375 B9R0.42 CN(C)C(=O)CC(=O)CBr Amb27231438 [0,2,0,0,0,0|2,0,0]=4 3376 B9R0.42 CN(C)C(=O)CC(=O)CCl Amb24707806 [0,2,0,0,0,0|2,0,0]=4 3377 B9R0.42 CN(C)C(=O)C\C(N)=N\O Amb8846345 [0,2,0,0,0,0|2,0,0]=4 3378 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,2,0,0,0,0|1,0,1]=4 3379 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,2,0,0,0,0|1,0,1]=4 3380 B9R0.42 CNC(=O)NC(C)C(=O)O Amb1130316 [0,2,0,0,0,0|2,0,0]=4 3381 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O Amb24478025 [0,2,0,0,0,0|2,0,0]=4 3382 B9R0.42 CNC(=O)N[C@H](C)C(=O)O Amb24558529 [0,2,0,0,0,0|2,0,0]=4 3383 B9R0.42 CNC(=O)OC(C)C(=O)O Amb35655772 [0,2,0,0,0,0|2,0,0]=4 3384 B9R0.42 CNC(=O)O[C@@H](C)C(=O)O Amb35647450 [0,2,0,0,0,0|2,0,0]=4 3385 B9R0.42 CNC(=O)O[C@H](C)C(=O)O Amb29866286 [0,2,0,0,0,0|2,0,0]=4 3386 B9R0.42 COC(=O)CC(=O)C(=O)O Amb22728219 [0,2,0,0,0,0|2,0,0]=4 3387 B9R0.42 COC(=O)CC(=O)C(=O)[O-] Amb34916317 [0,2,0,0,0,0|2,0,0]=4 3388 B9R0.42 COC(=O)CC(=O)C(C)=O Amb25146895 [0,2,0,0,0,0|1,0,0]=3 3389 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,2,0,0,0,0|1,0,1]=4 3390 B9R0.42 COC(=O)CC(=O)C(C)C Amb2689576 [0,2,0,0,0,0|0,0,1]=3 3391 B9R0.42 COC(=O)CC(=O)C(C)Cl Amb27592185 [0,2,0,0,0,0|1,0,1]=4 3392 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,2,0,0,0,0|1,0,1]=4 3393 B9R0.42 COC(=O)CC(=O)C(C)O Amb27827292 [0,2,0,0,0,0|1,0,1]=4 3394 B9R0.42 COC(=O)CC(=O)N(C)C Amb17399891 [0,2,0,0,0,0|1,0,0]=3 3395 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,2,0,0,0,0|1,0,1]=4 3396 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,2,0,0,0,0|1,0,1]=4 3397 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,2,0,0,0,0|1,0,1]=4 3398 B9R0.42 COC(=O)CC(C)N(C)C Amb9399294 [0,2,0,0,0,0|1,0,1]=4 3399 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,2,0,0,0,0|1,0,1]=4 3400 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,2,0,0,0,0|1,0,1]=4 3401 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,2,0,0,0,0|1,0,1]=4 3402 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,2,0,0,0,0|1,0,1]=4 3403 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,2,0,0,0,0|1,0,1]=4 3404 B9R0.42 COC(=O)CC(N)C(C)C Amb22168224 [0,2,0,0,0,0|0,0,2]=4 3405 B9R0.42 COC(=O)CC(N)C(C)C Amb26870018 [0,2,0,0,0,0|0,0,2]=4 3406 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,2,0,0,0,0|1,0,1]=4 3407 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,2,0,0,0,0|0,0,2]=4 3408 B9R0.42 COC(=O)CN(C)C(C)=O Amb9263349 [0,2,0,0,0,0|2,0,0]=4 3409 B9R0.42 COC(=O)CN(C)C(C)C Amb7757820 [0,2,0,0,0,0|1,0,1]=4 3410 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,2,0,0,0,0|1,0,1]=4 3411 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,2,0,0,0,0|1,0,1]=4 3412 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,2,0,0,0,0|1,0,1]=4 3413 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,2,0,0,0,0|1,0,1]=4 3414 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb26391960 [0,2,0,0,0,0|0,0,2]=4 3415 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb30640927 [0,2,0,0,0,0|0,0,2]=4 3416 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,2,0,0,0,0|1,0,1]=4 3417 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,2,0,0,0,0|0,0,2]=4 3418 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,2,0,0,0,0|1,0,1]=4 3419 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,2,0,0,0,0|1,0,1]=4 3420 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,2,0,0,0,0|1,0,1]=4 3421 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,2,0,0,0,0|1,0,1]=4 3422 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb23401522 [0,2,0,0,0,0|0,0,2]=4 3423 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb25865860 [0,2,0,0,0,0|0,0,2]=4 3424 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,2,0,0,0,0|1,0,1]=4 3425 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,2,0,0,0,0|0,0,2]=4 3426 B9R0.42 COC(=O)NC(C)C(=O)O Amb6668789 [0,2,0,0,0,0|2,0,0]=4 3427 B9R0.42 COC(=O)N[C@@H](C)C(=O)O Amb24477985 [0,2,0,0,0,0|2,0,0]=4 3428 B9R0.42 COC(=O)N[C@H](C)C(=O)O Amb24381066 [0,2,0,0,0,0|2,0,0]=4 3429 B9R0.42 COC(=O)\C=C(/C)C(=O)O Amb18644070 [0,2,0,0,0,0|1,0,1]=4 3430 B9R0.42 COC(=O)\C=C(/C)C(C)=O Amb20668358 [0,2,0,0,0,0|1,0,1]=4 3431 B9R0.42 COC(=O)\C=C(/C)C(C)C Amb33472138 [0,2,0,0,0,0|0,0,2]=4 3432 B9R0.42 COC(=O)\C=C(/N)C(C)C Amb32701567 [0,2,0,0,0,0|0,0,2]=4 3433 B9R0.42 COC(=O)\C=C(/N)N(C)C Amb27216562 [0,2,0,0,0,0|1,0,1]=4 3434 B9R0.42 COC(=O)\C=C(\C)N(C)C Amb2386647 [0,2,0,0,0,0|1,0,1]=4 3435 B9R0.42 COC(=O)\N=C(/N)C(C)C Amb25147336 [0,2,0,0,0,0|1,0,1]=4 3436 B9R0.42 COC(=S)SC(C)C(=O)O Amb28458571 [0,2,0,0,0,0|2,0,0]=4 3437 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,2,0,0,0,0|0,0,2]=4 3438 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,2,0,0,0,0|0,0,2]=4 3439 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,2,0,0,0,0|0,0,2]=4 3440 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,2,0,0,0,0|0,0,2]=4 3441 B9R0.42 COC(C)\C=C(\C)C(=O)O Amb27432877 [0,2,0,0,0,0|0,0,2]=4 3442 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,2,0,0,0,0|0,0,2]=4 3443 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,2,0,0,0,0|0,0,2]=4 3444 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,2,0,0,0,0|0,0,2]=4 3445 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [0,2,0,0,0,0|2,0,0]=4 3446 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,2,0,0,0,0|0,0,2]=4 3447 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [0,2,0,0,0,0|2,0,0]=4 3448 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [0,2,0,0,0,0|2,0,0]=4 3449 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [0,2,0,0,0,0|2,0,0]=4 3450 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,2,0,0,0,0|0,0,2]=4 3451 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,2,0,0,0,0|0,0,2]=4 3452 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,2,0,0,0,0|0,0,2]=4 3453 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,2,0,0,0,0|0,0,1]=3 3454 B9R0.42 C\C=C(C)/C=C(\C)C(C)=O Amb27640694 [0,2,0,0,0,0|1,0,1]=4 3455 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,2,0,0,0,0|1,0,1]=4 3456 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,2,0,0,0,0|1,0,1]=4 3457 B9R0.42 NC(\C=C(\P)C=O)C(=O)O Amb25361040 [0,2,0,0,0,0|1,0,1]=4 3458 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,2,0,0,0,0|1,0,1]=4 3459 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,2,0,0,0,0|1,0,1]=4 3460 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,2,0,0,0,0|1,0,1]=4 3461 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [0,2,0,0,0,0|1,0,1]=4 3462 B9R0.42 O=C(CCl)NC(O)C(=O)O Amb27598875 [0,2,0,0,0,0|2,0,0]=4 3463 B9R0.43 C=CC(C=C)=CCC(=O)O Amb28050147 [0,2,0,0,0,0|0,0,2]=4 3464 B9R0.43 CC(=O)OC\C(C=O)=N\O Amb27438152 [0,2,0,0,0,0|2,0,0]=4 3465 B9R0.43 CCC(C=O)CC=C(C)C Amb18643625 [0,2,0,0,0,0|1,0,1]=4 3466 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,2,0,0,0,0|0,0,2]=4 3467 B9R0.43 CCC(CC)OCC(=O)O Amb28051262 [0,2,0,0,0,0|1,0,1]=4 3468 B9R0.43 CCC(CC)SCC(=O)O Amb28182473 [0,2,0,0,0,0|1,0,1]=4 3469 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,2,0,0,0,0|0,0,2]=4 3470 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,2,0,0,0,0|0,0,2]=4 3471 B9R0.43 CCC(OC)OCC(=O)O Amb33341549 [0,2,0,0,0,0|1,0,1]=4 3472 B9R0.43 CCC(\C=C\C(=O)O)CC Amb24375784 [0,2,0,0,0,0|0,0,2]=4 3473 B9R0.43 CCC(\C=C\C(=O)O)OC Amb33326095 [0,2,0,0,0,0|0,0,2]=4 3474 B9R0.43 CCN(CC)CCC(=O)O Amb6651899 [0,2,0,0,0,0|1,0,1]=4 3475 B9R0.43 CCN(CC)CCC(=O)O Amb8513118 [0,2,0,0,0,0|1,0,1]=4 3476 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,2,0,0,0,0|1,0,1]=4 3477 B9R0.43 CNC(=NCC(=O)O)NC Amb24478941 [0,2,0,0,0,0|1,0,0]=3 3478 B9R0.43 COC(CCC(=O)O)OC Amb24657204 [0,2,0,0,0,0|0,0,2]=4 3479 B9R0.43 COC(OC)OCC(=O)O Amb33340630 [0,2,0,0,0,0|1,0,1]=4 3480 B9R0.43 CSC(=NCC(=O)O)SC Amb28118980 [0,2,0,0,0,0|1,0,0]=3 3481 B9R0.43 C\C=C(/C=C/C(=O)O)CC Amb28315773 [0,2,0,0,0,0|0,0,1]=3 3482 B9R0.43 C\C=C(/CC)CCC(C)=O Amb25857597 [0,2,0,0,0,0|1,0,1]=4 3483 B9R0.43 C\C=C(\C=C\C(=O)O)CC Amb18643591 [0,2,0,0,0,0|0,0,1]=3 3484 B9R0.43 C\C=C(\C=C\C(N)=O)CC Amb27593317 [0,2,0,0,0,0|1,0,1]=4 3485 B9R0.43 C\C=C(\C=O)CC=C(C)C Amb28198047 [0,2,0,0,0,0|1,0,0]=3 3486 B9R0.43 C\N=C(/NC)NCC(N)=O Amb27627819 [0,2,0,0,0,0|2,0,0]=4 3487 B9R0.43 C\N=C(/NC)SCC(N)=O Amb27204430 [0,2,0,0,0,0|2,0,0]=4 3488 B9R0.43 O=C(O)CSC(CS)CS Amb27400350 [0,2,0,0,0,0|1,0,1]=4 3489 B9R0.48 C#CCC(=O)NCC(=O)O Amb27641047 [0,2,0,0,0,0|2,0,0]=4 3490 B9R0.48 C#CCN(C)CCC(=O)O Amb17561257 [0,2,0,0,0,0|1,0,1]=4 3491 B9R0.48 C#CCN(C)\C=C\C(=O)O Amb27243643 [0,2,0,0,0,0|1,0,1]=4 3492 B9R0.48 C=C(C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|0,0,2]=4 3493 B9R0.48 C=C(C)\C=C\C(=O)OCC Amb26890933 [0,2,0,0,0,0|0,0,2]=4 3494 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|0,0,2]=4 3495 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,2,0,0,0,0|0,0,2]=4 3496 B9R0.48 C=CCN(C)\C=C\C(=O)O Amb27422117 [0,2,0,0,0,0|1,0,1]=4 3497 B9R0.48 C=CC\C(C)=C/CC(C)O Amb27829947 [0,2,0,0,0,0|1,0,1]=4 3498 B9R0.48 CC(=C\C=O)\C=C\C(=O)O Amb27210491 [0,2,0,0,0,0|0,0,2]=4 3499 B9R0.48 CC(C)=CCC(C)CC=O Amb18643637 [0,2,0,0,0,0|1,0,1]=4 3500 B9R0.48 CC(C)=CCN(C)CCO Amb26657209 [0,2,0,0,0,0|2,0,0]=4 3501 B9R0.48 CC(C)=CC\C(C)=C\C=O Amb27263893 [0,2,0,0,0,0|1,0,0]=3 3502 B9R0.48 CC(C)CCC(=O)OCCl Amb24480678 [0,2,0,0,0,0|0,0,2]=4 3503 B9R0.48 CC(C)\C=C\C(=O)\C=C\O Amb27427742 [0,2,0,0,0,0|0,0,2]=4 3504 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|0,0,2]=4 3505 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,2,0,0,0,0|0,0,2]=4 3506 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,2,0,0,0,0|0,0,2]=4 3507 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,2,0,0,0,0|1,0,1]=4 3508 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|1,0,1]=4 3509 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,2,0,0,0,0|0,0,2]=4 3510 B9R0.48 CC(\C=C\C(=O)O)=C/C=O Amb27215348 [0,2,0,0,0,0|0,0,2]=4 3511 B9R0.48 CC(\C=C\C(=O)O)CCO Amb27646330 [0,2,0,0,0,0|0,0,2]=4 3512 B9R0.48 CCCC(=O)NCC(=O)O Amb5741675 [0,2,0,0,0,0|2,0,0]=4 3513 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,2,0,0,0,0|2,0,0]=4 3514 B9R0.48 CCCC(=O)SCC(=O)O Amb27400351 [0,2,0,0,0,0|2,0,0]=4 3515 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|0,0,2]=4 3516 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|1,0,1]=4 3517 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [0,2,0,0,0,0|0,0,2]=4 3518 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [0,2,0,0,0,0|1,0,1]=4 3519 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [0,2,0,0,0,0|1,0,1]=4 3520 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|0,0,2]=4 3521 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,1]=4 3522 B9R0.48 CCNC(=O)NCC(=O)O Amb1129570 [0,2,0,0,0,0|2,0,0]=4 3523 B9R0.48 CCNC(=O)OCC(=O)O Amb27173452 [0,2,0,0,0,0|2,0,0]=4 3524 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [0,2,0,0,0,0|1,0,1]=4 3525 B9R0.48 CCNC(=O)\C=C\C(=O)O Amb9251696 [0,2,0,0,0,0|1,0,1]=4 3526 B9R0.48 CCNC(=S)NCC(=O)O Amb25857780 [0,2,0,0,0,0|2,0,0]=4 3527 B9R0.48 CCNC(=S)OCC(=O)O Amb28343116 [0,2,0,0,0,0|2,0,0]=4 3528 B9R0.48 CCOC(=O)CC=C(C)C Amb4036274 [0,2,0,0,0,0|0,0,0]=2 3529 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 3530 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,2,0,0,0,0|1,0,1]=4 3531 B9R0.48 CCOC(=O)CCC(C)C Amb9273760 [0,2,0,0,0,0|0,0,2]=4 3532 B9R0.48 CCOC(=O)CCN(C)C Amb6608740 [0,2,0,0,0,0|1,0,1]=4 3533 B9R0.48 CCOC(=O)CNC(C)=O Amb33534694 [0,2,0,0,0,0|2,0,0]=4 3534 B9R0.48 CCOC(=O)CNC(C)=S Amb27794578 [0,2,0,0,0,0|2,0,0]=4 3535 B9R0.48 CCOC(=O)CNC(C)C Amb19887458 [0,2,0,0,0,0|1,0,1]=4 3536 B9R0.48 CCOC(=O)CNC(C)C Amb6706356 [0,2,0,0,0,0|1,0,1]=4 3537 B9R0.48 CCOC(=O)COC(C)C Amb9206384 [0,2,0,0,0,0|1,0,1]=4 3538 B9R0.48 CCOC(=O)NCC(=O)O Amb6246368 [0,2,0,0,0,0|2,0,0]=4 3539 B9R0.48 CCOC(=O)OCC(=O)O Amb25367281 [0,2,0,0,0,0|2,0,0]=4 3540 B9R0.48 CCOC(=O)\C=C/C(=O)O Amb24462678 [0,2,0,0,0,0|1,0,1]=4 3541 B9R0.48 CCOC(=O)\C=C/N(C)C Amb23554946 [0,2,0,0,0,0|1,0,1]=4 3542 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [0,2,0,0,0,0|1,0,1]=4 3543 B9R0.48 CCOC(=O)\C=C\C(C)=O Amb3428594 [0,2,0,0,0,0|1,0,1]=4 3544 B9R0.48 CCOC(=O)\C=C\C(C)C Amb20247117 [0,2,0,0,0,0|0,0,2]=4 3545 B9R0.48 CCOC(=O)\C=C\N(C)C Amb35826729 [0,2,0,0,0,0|1,0,1]=4 3546 B9R0.48 CCOC(=O)\C=C\N(C)C Amb8387434 [0,2,0,0,0,0|1,0,1]=4 3547 B9R0.48 CCOC(=O)\N=C\C(C)=O Amb27668941 [0,2,0,0,0,0|2,0,0]=4 3548 B9R0.48 CCOC(=S)NCC(=O)O Amb26481347 [0,2,0,0,0,0|2,0,0]=4 3549 B9R0.48 CCOC(=S)SCC(=O)O Amb4017675 [0,2,0,0,0,0|2,0,0]=4 3550 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,2,0,0,0,0|0,0,2]=4 3551 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|1,0,1]=4 3552 B9R0.48 CCOC(C)\C=C\C(=O)O Amb33425399 [0,2,0,0,0,0|0,0,2]=4 3553 B9R0.48 CCO\C(C)=C\CC(C)=O Amb27630467 [0,2,0,0,0,0|1,0,0]=3 3554 B9R0.48 CCSC(=S)SCC(=O)O Amb28385725 [0,2,0,0,0,0|2,0,0]=4 3555 B9R0.48 CCS\C(S)=N/CC(=O)O Amb21862600 [0,2,0,0,0,0|2,0,0]=4 3556 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|0,0,1]=3 3557 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,2,0,0,0,0|1,0,1]=4 3558 B9R0.48 CC\C=C(C)/C=C/C(C)=O Amb27861011 [0,2,0,0,0,0|1,0,1]=4 3559 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|0,0,1]=3 3560 B9R0.48 CN(C)CCC(=O)ONN Amb27217216 [0,2,0,0,0,0|1,0,1]=4 3561 B9R0.48 CN(C)\C=N\C(=O)\C=C\O Amb27213680 [0,2,0,0,0,0|2,0,0]=4 3562 B9R0.48 CN(CC#N)CCC(=O)O Amb17561163 [0,2,0,0,0,0|1,0,1]=4 3563 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [0,2,0,0,0,0|1,0,1]=4 3564 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,2,0,0,0,0|1,0,1]=4 3565 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [0,2,0,0,0,0|1,0,1]=4 3566 B9R0.48 CNCC(=O)NCC(=O)O Amb19010138 [0,2,0,0,0,0|2,0,0]=4 3567 B9R0.48 CNOC(=O)CCC(=O)O Amb28126710 [0,2,0,0,0,0|1,0,1]=4 3568 B9R0.48 COCC(=O)CC=C(C)C Amb27233842 [0,2,0,0,0,0|0,0,0]=2 3569 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,2,0,0,0,0|1,0,1]=4 3570 B9R0.48 COCC(=O)CCC(C)C Amb28069967 [0,2,0,0,0,0|0,0,2]=4 3571 B9R0.48 COCC(=O)CCN(C)C Amb27866944 [0,2,0,0,0,0|1,0,1]=4 3572 B9R0.48 COCC(=O)CNC(C)C Amb27231606 [0,2,0,0,0,0|1,0,1]=4 3573 B9R0.48 COCC(=O)COC(C)=O Amb27599018 [0,2,0,0,0,0|2,0,0]=4 3574 B9R0.48 COCC(=O)NCC(=O)O Amb1118442 [0,2,0,0,0,0|2,0,0]=4 3575 B9R0.48 COCC(=O)\C=C/N(C)C Amb28385150 [0,2,0,0,0,0|1,0,1]=4 3576 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|1,0,1]=4 3577 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|1,0,1]=4 3578 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|1,0,1]=4 3579 B9R0.48 CONC(=O)CCC(=O)O Amb27839045 [0,2,0,0,0,0|1,0,1]=4 3580 B9R0.48 CONC(=O)CCC(C)C Amb27491099 [0,2,0,0,0,0|0,0,2]=4 3581 B9R0.48 CONC(=O)CNC(C)=O Amb27771053 [0,2,0,0,0,0|2,0,0]=4 3582 B9R0.48 CONC(=O)CSC(C)C Amb27490607 [0,2,0,0,0,0|1,0,1]=4 3583 B9R0.48 CONC(=O)\C=C/C(=O)O Amb27855758 [0,2,0,0,0,0|1,0,1]=4 3584 B9R0.48 CO\N=C(/C)CCC(C)=O Amb24583507 [0,2,0,0,0,0|1,0,1]=4 3585 B9R0.48 CSSC(C)CCC(=O)O Amb27843301 [0,2,0,0,0,0|0,0,2]=4 3586 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,2,0,0,0,0|0,0,2]=4 3587 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,2,0,0,0,0|0,0,2]=4 3588 B9R0.48 C[C@H](\C=C\C(=O)O)CCO Amb28050109 [0,2,0,0,0,0|0,0,2]=4 3589 B9R0.48 C\C(=C/CO)CCC(=O)O Amb27630663 [0,2,0,0,0,0|0,0,1]=3 3590 B9R0.48 C\C=C\C(=O)CC=C(C)C Amb25878661 [0,2,0,0,0,0|1,0,0]=3 3591 B9R0.48 C\C=C\C(=O)NCC(=O)O Amb9719598 [0,2,0,0,0,0|2,0,0]=4 3592 B9R0.48 C\C=C\C(=O)SCC(=O)O Amb27400187 [0,2,0,0,0,0|2,0,0]=4 3593 B9R0.48 C\C=C\C(C)\C=C/C(=O)O Amb27468642 [0,2,0,0,0,0|0,0,2]=4 3594 B9R0.48 C\C=N\C(=O)CCC(=O)O Amb27217285 [0,2,0,0,0,0|1,0,1]=4 3595 B9R0.48 N#CCC(=O)CCC(=O)O Amb24053663 [0,2,0,0,0,0|1,0,1]=4 3596 B9R0.48 NCCC(=O)NCC(=O)O Amb28555431 [0,2,0,0,0,0|2,0,0]=4 3597 B9R0.48 NCCC(=O)NCC(=O)O Amb4035945 [0,2,0,0,0,0|2,0,0]=4 3598 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [0,2,0,0,0,0|1,0,1]=4 3599 B9R0.48 O=C(O)CCC(=O)NCO Amb28132582 [0,2,0,0,0,0|1,0,1]=4 3600 B9R0.48 O=C(O)\C=C\C(=O)NCO Amb28346249 [0,2,0,0,0,0|1,0,1]=4 3601 B9R0.48 O=CCC(=O)CCC(=O)O Amb18644074 [0,2,0,0,0,0|1,0,1]=4 3602 B9R0.64 C#CC(C)(C)OCC(=O)O Amb27630706 [0,2,0,0,0,0|1,0,1]=4 3603 B9R0.64 C=CC(C)(C)CCC(=O)O Amb28429810 [0,2,0,0,0,0|0,0,2]=4 3604 B9R0.64 CC(C)(C#N)CCC(=O)O Amb26858929 [0,2,0,0,0,0|0,0,2]=4 3605 B9R0.64 CC(C)(C#N)NCC(=O)O Amb25699825 [0,2,0,0,0,0|1,0,1]=4 3606 B9R0.64 CC(C)(C=O)CCC(=O)O Amb18644118 [0,2,0,0,0,0|0,0,2]=4 3607 B9R0.64 CC(C)(C=O)\C=C/C(=O)O Amb27473340 [0,2,0,0,0,0|0,0,2]=4 3608 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,2,0,0,0,0|0,0,2]=4 3609 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,2,0,0,0,0|0,0,2]=4 3610 B9R0.64 CC(C)(CO)OCC(=O)O Amb33202720 [0,2,0,0,0,0|1,0,1]=4 3611 B9R0.64 CC(C)(\C=C\C(=O)O)CO Amb26900319 [0,2,0,0,0,0|0,0,2]=4 3612 B9R0.64 CC(C)=CCC(C)(C)C=O Amb18643624 [0,2,0,0,0,0|1,0,1]=4 3613 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,2,0,0,0,0|0,0,2]=4 3614 B9R0.64 CCC(C)(C)OCC(=O)O Amb9208491 [0,2,0,0,0,0|1,0,1]=4 3615 B9R0.64 CCC(C)(C)\C=C\C(=O)O Amb33428990 [0,2,0,0,0,0|0,0,2]=4 3616 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,2,0,0,0,0|0,0,2]=4 3617 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,2,0,0,0,0|0,0,2]=4 3618 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,2,0,0,0,0|0,0,2]=4 3619 B9R0.64 COC(C)(C)CCC(=O)O Amb27835401 [0,2,0,0,0,0|0,0,2]=4 3620 B9R0.64 CSC(C)(C)CCC(=O)O Amb28245393 [0,2,0,0,0,0|0,0,2]=4 3621 B9R0.10 C=C(CC(C)=O)[Si](C)(C)C Amb27602072 [0,2,0,0,0,0|1,1,0]=4 3622 B9R0.10 CC(=O)CC(=O)C(C)(C)C Amb7764664 [0,2,0,0,0,0|1,0,1]=4 3623 B9R0.10 CC(C)(C)C(=O)CC(=O)[Na] Amb27762570 [0,2,0,0,0,0|1,0,1]=4 3624 B9R0.10 CC(C)(C)C(=O)CC(N)=O Amb28240438 [0,2,0,0,0,0|1,0,1]=4 3625 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,2,0,0,0,0|0,0,2]=4 3626 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,2,0,0,0,0|0,0,2]=4 3627 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,2,0,0,0,0|0,0,2]=4 3628 B9R0.10 CC(C)(C)S(=O)CC(=O)O Amb18974534 [0,2,0,0,0,0|1,0,1]=4 3629 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,2,0,0,0,0|0,0,2]=4 3630 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,2,0,0,0,0|0,0,2]=4 3631 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,2,0,0,0,0|0,0,2]=4 3632 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,2,0,0,0,0|0,0,2]=4 3633 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,2,0,0,0,0|0,0,2]=4 3634 B9R0.10 CC(C)(C)\C(N)=C\C(=O)O Amb28313951 [0,2,0,0,0,0|0,0,2]=4 3635 B9R0.10 CC(C)(F)C(N)CC(=O)O Amb33273018 [0,2,0,0,0,0|0,0,2]=4 3636 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,2,0,0,0,0|0,0,2]=4 3637 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,2,0,0,0,0|0,0,2]=4 3638 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,2,0,0,0,0|0,0,2]=4 3639 B9R0.10 CC(C)(S)C(N)CC(=O)O Amb28182470 [0,2,0,0,0,0|0,0,2]=4 3640 B9R0.10 CC(C)=CC(Cl)S(=O)(=O)Cl Amb27595566 [0,2,0,0,0,0|1,0,1]=4 3641 B9R0.10 CC(C)=CC(O)C(C)(C)O Amb28206074 [0,2,0,0,0,0|1,0,1]=4 3642 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,2,0,0,0,0|0,0,2]=4 3643 B9R0.10 CC(CC(=O)O)C(C)(C)F Amb27633286 [0,2,0,0,0,0|0,0,2]=4 3644 B9R0.10 CC(CC(=O)O)C(C)(C)N Amb19651352 [0,2,0,0,0,0|0,0,2]=4 3645 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,2,0,0,0,0|0,0,2]=4 3646 B9R0.10 CN(CC(=O)O)C(C)(C)C Amb17334246 [0,2,0,0,0,0|1,0,1]=4 3647 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,2,0,0,0,0|0,0,2]=4 3648 B9R0.10 C[Si](C)(C)\C(Cl)=C\C(=O)O Amb27657462 [0,2,0,0,0,0|0,1,1]=4 3649 B9R0.10 C\C(=C/C(=O)O)C(C)(C)C Amb6749108 [0,2,0,0,0,0|0,0,2]=4 3650 B9R0.10 C\C(=C\C(=O)O)C(C)(C)C Amb28314071 [0,2,0,0,0,0|0,0,2]=4 3651 B9R0.11 C=C(C)C(C)(C)CC(=O)O Amb25703730 [0,2,0,0,0,0|0,0,2]=4 3652 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb22641962 [0,2,0,0,0,0|0,0,2]=4 3653 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb31307620 [0,2,0,0,0,0|0,0,2]=4 3654 B9R0.11 C=C(C)C(F)(F)CC(=O)O Amb32810021 [0,2,0,0,0,0|0,0,2]=4 3655 B9R0.11 C=C(C)CC(C)(C)C(=O)O Amb27619182 [0,2,0,0,0,0|0,0,2]=4 3656 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,2,0,0,0,0|0,0,2]=4 3657 B9R0.11 C=C(C)CC(C)(O)C(=O)O Amb24763776 [0,2,0,0,0,0|0,0,2]=4 3658 B9R0.11 C=C(C)CC(F)(F)C(=O)O Amb26356276 [0,2,0,0,0,0|0,0,2]=4 3659 B9R0.11 C=C(C)C[C@](C)(O)C(=O)O Amb27618953 [0,2,0,0,0,0|0,0,2]=4 3660 B9R0.11 CC(=O)C(C)(C)CC(=O)O Amb594714 [0,2,0,0,0,0|1,0,1]=4 3661 B9R0.11 CC(=O)C(C)(O)C=C(C)C Amb17593604 [0,2,0,0,0,0|1,0,0]=3 3662 B9R0.11 CC(=O)CC(C)(C)C(=O)O Amb18644092 [0,2,0,0,0,0|1,0,1]=4 3663 B9R0.11 CC(=O)CC(C)(S)C(=O)O Amb27984551 [0,2,0,0,0,0|1,0,1]=4 3664 B9R0.11 CC(=O)C[C@](C)(O)C(=O)O Amb27170683 [0,2,0,0,0,0|1,0,1]=4 3665 B9R0.11 CC(=O)NC(C)(C)C(=O)O Amb13952726 [0,2,0,0,0,0|2,0,0]=4 3666 B9R0.11 CC(=O)NC(C)(N)C(=O)O Amb27881127 [0,2,0,0,0,0|2,0,0]=4 3667 B9R0.11 CC(=O)OC(C)(C)C(=O)O Amb18644243 [0,2,0,0,0,0|2,0,0]=4 3668 B9R0.11 CC(=O)SC(C)(C)C(=O)O Amb17607677 [0,2,0,0,0,0|2,0,0]=4 3669 B9R0.11 CC(=O)SC(F)(F)C(=O)O Amb27252817 [0,2,0,0,0,0|2,0,0]=4 3670 B9R0.11 CC(C)=CC(C)(C)C(=O)O Amb27162610 [0,2,0,0,0,0|0,0,0]=2 3671 B9R0.11 CC(C)=CC(C)(C)C(C)O Amb27839271 [0,2,0,0,0,0|1,0,1]=4 3672 B9R0.11 CC(C)C(C)(C)CC(=O)O Amb18124695 [0,2,0,0,0,0|0,0,2]=4 3673 B9R0.11 CC(C)C(C)(N)CC(=O)O Amb25934755 [0,2,0,0,0,0|0,0,2]=4 3674 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,2,0,0,0,0|0,0,2]=4 3675 B9R0.11 CC(C)C(F)(F)CC(=O)O Amb26991653 [0,2,0,0,0,0|0,0,2]=4 3676 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,2,0,0,0,0|0,0,2]=4 3677 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,2,0,0,0,0|0,0,2]=4 3678 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,2,0,0,0,0|0,0,2]=4 3679 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,2,0,0,0,0|0,0,2]=4 3680 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,2,0,0,0,0|0,0,2]=4 3681 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,2,0,0,0,0|0,0,2]=4 3682 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,2,0,0,0,0|0,0,2]=4 3683 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,2,0,0,0,0|1,0,1]=4 3684 B9R0.11 CC(C)OC(C)(C)C(=O)O Amb18976739 [0,2,0,0,0,0|1,0,1]=4 3685 B9R0.11 CC(C)S(=O)(=O)CC(=O)O Amb6281038 [0,2,0,0,0,0|1,0,1]=4 3686 B9R0.11 CC(C)SC(C)(C)C(=O)O Amb17501486 [0,2,0,0,0,0|1,0,1]=4 3687 B9R0.11 CC(C)[C@@](C)(N)CC(=O)O Amb27185746 [0,2,0,0,0,0|0,0,2]=4 3688 B9R0.11 CC(C)[C@](C)(N)CC(=O)O Amb28346262 [0,2,0,0,0,0|0,0,2]=4 3689 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,2,0,0,0,0|0,0,2]=4 3690 B9R0.11 CN(C)C(C)(C)CC(=O)O Amb27839164 [0,2,0,0,0,0|1,0,1]=4 3691 B9R0.11 CN(C)CC(C)(C)C(=O)O Amb17334247 [0,2,0,0,0,0|1,0,1]=4 3692 B9R0.11 CN(C)CC(C)(C)C(=O)O Amb33527437 [0,2,0,0,0,0|1,0,1]=4 3693 B9R0.11 CN(C)CC(C)(N)C(=O)O Amb18294465 [0,2,0,0,0,0|1,0,1]=4 3694 B9R0.11 CN(C)CC(F)(F)C(=O)O Amb25857752 [0,2,0,0,0,0|1,0,1]=4 3695 B9R0.11 CN(C)S(=O)(=O)CC(=O)O Amb6742030 [0,2,0,0,0,0|2,0,0]=4 3696 B9R0.39 C#CC(CC(=O)O)C(C)C Amb27408324 [0,2,0,0,0,0|0,0,2]=4 3697 B9R0.39 C#CC(NC(C)=O)C(=O)O Amb27411184 [0,2,0,0,0,0|2,0,0]=4 3698 B9R0.39 C#C[C@@H](CC(=O)O)C(C)C Amb27977044 [0,2,0,0,0,0|0,0,2]=4 3699 B9R0.39 C#C[C@@H](NC(C)=O)C(=O)O Amb27393972 [0,2,0,0,0,0|2,0,0]=4 3700 B9R0.39 C#C[C@H](CC(=O)O)C(C)C Amb27253902 [0,2,0,0,0,0|0,0,2]=4 3701 B9R0.39 C=C(C)C(CC)CC(=O)O Amb27655611 [0,2,0,0,0,0|0,0,2]=4 3702 B9R0.39 C=C(C)C(CN)CC(=O)O Amb33199956 [0,2,0,0,0,0|0,0,2]=4 3703 B9R0.39 C=C(C)CC(C#N)C(=O)O Amb35741470 [0,2,0,0,0,0|0,0,2]=4 3704 B9R0.39 C=C(C)CC(C=O)=C(C)C Amb18124525 [0,2,0,0,0,0|2,0,0]=4 3705 B9R0.39 C=C(C)CC(CBr)=C(C)C Amb28251144 [0,2,0,0,0,0|2,0,0]=4 3706 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [0,2,0,0,0,0|0,0,2]=4 3707 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [0,2,0,0,0,0|0,0,2]=4 3708 B9R0.39 C=C(C)\C=C(/CC)C(=O)O Amb28457972 [0,2,0,0,0,0|0,0,2]=4 3709 B9R0.39 C=CC(CC(=O)O)C(C)C Amb18643903 [0,2,0,0,0,0|0,0,2]=4 3710 B9R0.39 C=CC(SC(C)C)C(=O)O Amb28123807 [0,2,0,0,0,0|1,0,1]=4 3711 B9R0.39 C=C[C@@H](CC(=O)O)C(C)C Amb27881786 [0,2,0,0,0,0|0,0,2]=4 3712 B9R0.39 C=C[C@@H](NC(C)=O)C(=O)O Amb28050121 [0,2,0,0,0,0|2,0,0]=4 3713 B9R0.39 C=C[C@H](CC(=O)O)C(C)C Amb27962891 [0,2,0,0,0,0|0,0,2]=4 3714 B9R0.39 CC(=N)N[C@@H](CO)C(=O)O Amb27192588 [0,2,0,0,0,0|2,0,0]=4 3715 B9R0.39 CC(=O)CC(C=O)C(=O)O Amb28048038 [0,2,0,0,0,0|1,0,1]=4 3716 B9R0.39 CC(=O)C\C(=N\O)C(C)=O Amb27256458 [0,2,0,0,0,0|2,0,0]=4 3717 B9R0.39 CC(=O)N(CC(=O)O)N=O Amb27391141 [0,2,0,0,0,0|2,0,0]=4 3718 B9R0.39 CC(=O)NC(CCl)C(=O)O Amb27494110 [0,2,0,0,0,0|2,0,0]=4 3719 B9R0.39 CC(=O)NC(CN)C(=O)O Amb28128874 [0,2,0,0,0,0|2,0,0]=4 3720 B9R0.39 CC(=O)NC(CO)C(=O)O Amb1115493 [0,2,0,0,0,0|2,0,0]=4 3721 B9R0.39 CC(=O)NC(CS)C(=O)O Amb1112748 [0,2,0,0,0,0|2,0,0]=4 3722 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O Amb22746917 [0,2,0,0,0,0|2,0,0]=4 3723 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O Amb2684240 [0,2,0,0,0,0|2,0,0]=4 3724 B9R0.39 CC(=O)N[C@H](CCl)C(=O)O Amb27171775 [0,2,0,0,0,0|2,0,0]=4 3725 B9R0.39 CC(=O)N[C@H](CS)C(=O)O Amb25887589 [0,2,0,0,0,0|2,0,0]=4 3726 B9R0.39 CC(=O)OC(C#N)=C(C)C Amb24460378 [0,2,0,0,0,0|2,0,0]=4 3727 B9R0.39 CC(=O)OC(CCl)C(=O)O Amb27796012 [0,2,0,0,0,0|2,0,0]=4 3728 B9R0.39 CC(=O)O[C@@H](CN)C(=O)O Amb27874054 [0,2,0,0,0,0|2,0,0]=4 3729 B9R0.39 CC(=O)SC(C=O)=C(C)C Amb28050015 [0,2,0,0,0,0|2,0,0]=4 3730 B9R0.39 CC(C)C(C#N)CC(=O)O Amb25818234 [0,2,0,0,0,0|0,0,2]=4 3731 B9R0.39 CC(C)C(CN)CC(=O)O Amb26910759 [0,2,0,0,0,0|0,0,2]=4 3732 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [0,2,0,0,0,0|0,0,2]=4 3733 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,2,0,0,0,0|0,0,2]=4 3734 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,2,0,0,0,0|0,0,2]=4 3735 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,2,0,0,0,0|0,0,2]=4 3736 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [0,2,0,0,0,0|0,0,2]=4 3737 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,2,0,0,0,0|0,0,2]=4 3738 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,2,0,0,0,0|0,0,2]=4 3739 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,2,0,0,0,0|0,0,2]=4 3740 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,2,0,0,0,0|0,0,2]=4 3741 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,2,0,0,0,0|0,0,2]=4 3742 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,2,0,0,0,0|0,0,2]=4 3743 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,2,0,0,0,0|0,0,2]=4 3744 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,2,0,0,0,0|0,0,2]=4 3745 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,2,0,0,0,0|0,0,2]=4 3746 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,2,0,0,0,0|0,0,2]=4 3747 B9R0.39 CC(C)N(C#N)CC(=O)O Amb35634517 [0,2,0,0,0,0|1,0,1]=4 3748 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,2,0,0,0,0|1,0,1]=4 3749 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,2,0,0,0,0|1,0,1]=4 3750 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,2,0,0,0,0|1,0,1]=4 3751 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,2,0,0,0,0|1,0,1]=4 3752 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,2,0,0,0,0|1,0,1]=4 3753 B9R0.39 CC(C)[C@@H](C#N)CC(=O)O Amb27473398 [0,2,0,0,0,0|0,0,2]=4 3754 B9R0.39 CC(C)[C@H](C#N)CC(=O)O Amb28184580 [0,2,0,0,0,0|0,0,2]=4 3755 B9R0.39 CC(C)\C=C(/C#N)C(=O)O Amb25864734 [0,2,0,0,0,0|0,0,2]=4 3756 B9R0.39 CCC(CC(=O)O)C(C)C Amb33534084 [0,2,0,0,0,0|0,0,2]=4 3757 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [0,2,0,0,0,0|1,0,1]=4 3758 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,2,0,0,0,0|0,0,2]=4 3759 B9R0.39 CCC(NC(C)=O)C(=O)O Amb2099651 [0,2,0,0,0,0|2,0,0]=4 3760 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,2,0,0,0,0|1,0,1]=4 3761 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,2,0,0,0,0|1,0,1]=4 3762 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,2,0,0,0,0|1,0,1]=4 3763 B9R0.39 CCN(CC(=O)O)C(C)=O Amb17399887 [0,2,0,0,0,0|2,0,0]=4 3764 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,2,0,0,0,0|0,0,2]=4 3765 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O Amb3941467 [0,2,0,0,0,0|2,0,0]=4 3766 B9R0.39 CC[C@H](CC(=O)O)C(C)C Amb25989910 [0,2,0,0,0,0|0,0,2]=4 3767 B9R0.39 CC[C@H](NC(C)=O)C(=O)O Amb3990111 [0,2,0,0,0,0|2,0,0]=4 3768 B9R0.39 CC[C@H](OC(C)=O)C(=O)O Amb27948340 [0,2,0,0,0,0|2,0,0]=4 3769 B9R0.39 CC\C(=C/C(=O)O)C(C)=O Amb26391990 [0,2,0,0,0,0|1,0,1]=4 3770 B9R0.39 CC\C(=C/C(=O)O)C(C)C Amb18967765 [0,2,0,0,0,0|0,0,2]=4 3771 B9R0.39 CC\C(=C/C(C)C)C(=O)O Amb18643946 [0,2,0,0,0,0|0,0,2]=4 3772 B9R0.39 CN(C)C(CO)CC(=O)O Amb18202308 [0,2,0,0,0,0|1,0,1]=4 3773 B9R0.39 CN(C)CC(C#N)C(=O)O Amb26639275 [0,2,0,0,0,0|1,0,1]=4 3774 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,2,0,0,0,0|1,0,1]=4 3775 B9R0.39 CNC(CC(=O)O)C(C)C Amb27209417 [0,2,0,0,0,0|0,0,2]=4 3776 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,2,0,0,0,0|0,0,2]=4 3777 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,2,0,0,0,0|0,0,2]=4 3778 B9R0.39 CNC(CN(C)C)C(=O)O Amb28388875 [0,2,0,0,0,0|1,0,1]=4 3779 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,2,0,0,0,0|0,0,2]=4 3780 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,2,0,0,0,0|0,0,2]=4 3781 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,2,0,0,0,0|0,0,2]=4 3782 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,2,0,0,0,0|0,0,2]=4 3783 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,2,0,0,0,0|0,0,0]=2 3784 B9R0.39 COC(CC(=O)O)C(C)=O Amb27952022 [0,2,0,0,0,0|1,0,1]=4 3785 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,2,0,0,0,0|0,0,2]=4 3786 B9R0.39 COC(CN(C)C)C(=O)O Amb27196900 [0,2,0,0,0,0|1,0,1]=4 3787 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,2,0,0,0,0|0,0,2]=4 3788 B9R0.39 CO\C(=C/C(=O)O)C(C)=O Amb28345759 [0,2,0,0,0,0|1,0,1]=4 3789 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,2,0,0,0,0|0,0,2]=4 3790 B9R0.39 CSC(NC(C)=O)=C(C)C Amb27224392 [0,2,0,0,0,0|2,0,0]=4 3791 B9R0.39 C\C(Cl)=C/C(ON)C(=O)O Amb27252200 [0,2,0,0,0,0|1,0,0]=3 3792 B9R0.39 C\C=C(/CC(=O)O)C(=O)O Amb8631758 [0,2,0,0,0,0|2,0,0]=4 3793 B9R0.39 C\C=C(\CC(=O)O)C(=O)O Amb25292254 [0,2,0,0,0,0|2,0,0]=4 3794 B9R0.39 C\C=C(\CC(C)=O)C(C)C Amb25265231 [0,2,0,0,0,0|1,0,1]=4 3795 B9R0.39 N\C=C(\CC(=O)O)C(=O)O Amb28050321 [0,2,0,0,0,0|2,0,0]=4 3796 B9R0.39 O=C(O)C\C(=N/O)C(=O)O Amb24117074 [0,2,0,0,0,0|2,0,0]=4 3797 B9R0.39 O=C(O)C\C(=N\O)C(=O)O Amb27828721 [0,2,0,0,0,0|2,0,0]=4 3798 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,2,0,0,0,0|0,0,2]=4 3799 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,2,0,0,0,0|0,0,2]=4 3800 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,2,0,0,0,0|0,0,2]=4 3801 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,2,0,0,0,0|0,0,2]=4 3802 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,2,0,0,0,0|0,0,2]=4 3803 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,2,0,0,0,0|0,0,2]=4 3804 B9R0.57 CC(C)(C)OC(F)C(=O)O Amb27399823 [0,2,0,0,0,0|1,0,1]=4 3805 B9R0.57 CC(C)(C)\C=C(/F)C(=O)O Amb27194420 [0,2,0,0,0,0|0,0,2]=4 3806 B9R0.57 CC(C)(C)\C=C(\Br)C(=O)O Amb27230191 [0,2,0,0,0,0|0,0,2]=4 3807 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,2,0,0,0,0|0,0,2]=4 3808 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,2,0,0,0,0|0,0,2]=4 3809 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,2,0,0,0,0|0,0,2]=4 3810 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,2,0,0,0,0|0,0,2]=4 3811 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,2,0,0,0,0|0,0,2]=4 3812 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,2,0,0,0,0|0,0,2]=4 3813 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,2,0,0,0,0|0,0,2]=4 3814 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,2,0,0,0,0|0,0,2]=4 3815 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,2,0,0,0,0|0,0,2]=4 3816 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,2,0,0,0,0|0,0,2]=4 3817 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,2,0,0,0,0|0,0,2]=4 3818 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,2,0,0,0,0|0,0,2]=4 3819 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,2,0,0,0,0|0,0,2]=4 3820 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,2,0,0,0,0|0,0,2]=4 3821 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,2,0,0,0,0|0,0,2]=4 3822 B9R0.57 CC(CP(C)(C)=O)C(=O)O Amb28050894 [0,2,0,0,0,0|1,0,1]=4 3823 B9R0.57 CC(C[Si](C)(C)C)C(=O)O Amb28383938 [0,2,0,0,0,0|0,1,1]=4 3824 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,2,0,0,0,0|1,0,1]=4 3825 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,2,0,0,0,0|1,0,1]=4 3826 B9R0.57 CC(N[Si](C)(C)C)C(=O)O Amb27984746 [0,2,0,0,0,0|1,1,0]=4 3827 B9R0.57 CC(OC(C)(C)C)C(=O)O Amb9208483 [0,2,0,0,0,0|1,0,1]=4 3828 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,2,0,0,0,0|0,0,2]=4 3829 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,2,0,0,0,0|0,0,2]=4 3830 B9R0.57 C[C@H](O[Si](C)(C)C)C(=O)O Amb28320757 [0,2,0,0,0,0|1,1,0]=4 3831 B9R0.57 C[Si](C)(C)CC(N)C(=O)O Amb26361043 [0,2,0,0,0,0|0,1,1]=4 3832 B9R0.57 C[Si](C)(C)C[C@@H](N)C(=O)O Amb27658975 [0,2,0,0,0,0|0,1,1]=4 3833 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O Amb24482244 [0,2,0,0,0,0|0,1,1]=4 3834 B9R0.57 C[Si](C)(O)C[C@H](N)C(=O)O Amb27408998 [0,2,0,0,0,0|0,1,1]=4 3835 B9R0.57 C\C(=C/C(C)(C)C)C(=O)O Amb28050296 [0,2,0,0,0,0|0,0,2]=4 3836 B9R0.79 C=C(C)C(=O)C(C)C(C)=O Amb25869922 [0,2,0,0,0,0|1,0,1]=4 3837 B9R0.79 C=C(C)C(C)C(C)C(=O)O Amb28042819 [0,2,0,0,0,0|0,0,2]=4 3838 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [0,2,0,0,0,0|0,0,2]=4 3839 B9R0.79 C=C(C)C(O)C(C)C(=O)O Amb18644101 [0,2,0,0,0,0|0,0,2]=4 3840 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,2,0,0,0,0|0,0,2]=4 3841 B9R0.79 C=C(C)[C@@H](C)[C@@H](C)C(=O)O Amb28050111 [0,2,0,0,0,0|0,0,2]=4 3842 B9R0.79 C=C(C)[C@@H](O)[C@@H](C)C(=O)O Amb28283987 [0,2,0,0,0,0|0,0,2]=4 3843 B9R0.79 CC(=O)C(=O)C(O)C(C)=O Amb25910745 [0,2,0,0,0,0|2,0,0]=4 3844 B9R0.79 CC(=O)C(Br)C(=O)N(C)C Amb28128408 [0,2,0,0,0,0|2,0,0]=4 3845 B9R0.79 CC(=O)C(C)C(=O)C(C)C Amb17778960 [0,2,0,0,0,0|1,0,1]=4 3846 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,2,0,0,0,0|1,0,1]=4 3847 B9R0.79 CC(=O)C(Cl)C(=O)N(C)C Amb6608840 [0,2,0,0,0,0|2,0,0]=4 3848 B9R0.79 CC(=O)C(F)C(=O)N(C)C Amb25853211 [0,2,0,0,0,0|2,0,0]=4 3849 B9R0.79 CC(=O)C(O)C(=O)C(C)C Amb27480227 [0,2,0,0,0,0|1,0,1]=4 3850 B9R0.79 CC(=O)C(O)C(O)C(=O)O Amb25292189 [0,2,0,0,0,0|1,0,1]=4 3851 B9R0.79 CC(=O)N(Cl)[C@@H](C)C(=O)O Amb28458454 [0,2,0,0,0,0|2,0,0]=4 3852 B9R0.79 CC(=O)[C@@H](C)[C@@H](O)C(=O)O Amb27661780 [0,2,0,0,0,0|1,0,1]=4 3853 B9R0.79 CC(=O)[C@@H](C)[C@H](O)C(=O)O Amb28050113 [0,2,0,0,0,0|1,0,1]=4 3854 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,2,0,0,0,0|1,0,1]=4 3855 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,2,0,0,0,0|1,0,1]=4 3856 B9R0.79 CC(C(=O)O)C(=O)N(C)C Amb24454556 [0,2,0,0,0,0|1,0,0]=3 3857 B9R0.79 CC(C(=O)O)C(C)N(C)C Amb28139119 [0,2,0,0,0,0|1,0,1]=4 3858 B9R0.79 CC(C(=O)O)C(Cl)=C(Cl)Cl Amb27789586 [0,2,0,0,0,0|2,0,0]=4 3859 B9R0.79 CC(C(N)C(=O)O)N(C)C Amb30020664 [0,2,0,0,0,0|1,0,1]=4 3860 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,2,0,0,0,0|0,0,0]=2 3861 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,2,0,0,0,0|0,0,0]=2 3862 B9R0.79 CC(C)C(=O)C(=O)C(=O)O Amb31099538 [0,2,0,0,0,0|0,0,2]=4 3863 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,2,0,0,0,0|0,0,1]=3 3864 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,2,0,0,0,0|0,0,2]=4 3865 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,2,0,0,0,0|0,0,2]=4 3866 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,2,0,0,0,0|0,0,2]=4 3867 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,2,0,0,0,0|0,0,2]=4 3868 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,2,0,0,0,0|0,0,2]=4 3869 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,2,0,0,0,0|0,0,2]=4 3870 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,2,0,0,0,0|0,0,2]=4 3871 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,2,0,0,0,0|0,0,2]=4 3872 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,2,0,0,0,0|0,0,2]=4 3873 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,2,0,0,0,0|0,0,2]=4 3874 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,2,0,0,0,0|0,0,2]=4 3875 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,2,0,0,0,0|0,0,2]=4 3876 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,2,0,0,0,0|0,0,2]=4 3877 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,2,0,0,0,0|0,0,2]=4 3878 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,2,0,0,0,0|0,0,2]=4 3879 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,2,0,0,0,0|0,0,2]=4 3880 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,2,0,0,0,0|0,0,2]=4 3881 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,2,0,0,0,0|1,0,1]=4 3882 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,2,0,0,0,0|0,0,2]=4 3883 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,2,0,0,0,0|0,0,2]=4 3884 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,2,0,0,0,0|0,0,2]=4 3885 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,2,0,0,0,0|0,0,2]=4 3886 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,2,0,0,0,0|0,0,2]=4 3887 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,2,0,0,0,0|0,0,2]=4 3888 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,2,0,0,0,0|0,0,2]=4 3889 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,2,0,0,0,0|0,0,2]=4 3890 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,2,0,0,0,0|0,0,2]=4 3891 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,2,0,0,0,0|0,0,2]=4 3892 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,2,0,0,0,0|0,0,2]=4 3893 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,2,0,0,0,0|0,0,2]=4 3894 B9R0.79 CN(C)C(=O)C(=O)C(=O)O Amb28316062 [0,2,0,0,0,0|1,0,1]=4 3895 B9R0.79 CN(C)C(=O)C(F)C(=O)O Amb28050091 [0,2,0,0,0,0|1,0,0]=3 3896 B9R0.79 CN(C)C(=O)C(N)C(N)=O Amb28132673 [0,2,0,0,0,0|2,0,0]=4 3897 B9R0.79 C[C@@H]([C@@H](O)C(=O)O)N(C)C Amb28364201 [0,2,0,0,0,0|1,0,1]=4 3898 B9R0.79 C\C(=C(\F)C(=O)O)C(C)C Amb27615103 [0,2,0,0,0,0|0,0,2]=4 3899 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,0,0,1,0,0|0,0,2]=4 3900 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [1,0,0,1,0,0|1,0,1]=4 3901 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [1,0,0,1,0,0|1,0,1]=4 3902 B7R1.2 CC1=CCC(O)O1 Amb27241898 [1,0,0,1,0,0|0,0,2]=4 3903 B7R1.2 CC1=CCP(Cl)C1 Amb27261470 [1,0,0,1,0,0|2,0,0]=4 3904 B7R1.2 CC1=CNC(=O)N1 Amb20667076 [1,0,0,1,0,0|2,0,0]=4 3905 B7R1.2 CC1=COC(=O)C1 Amb27624758 [1,0,0,1,0,0|1,0,0]=3 3906 B7R1.2 CC1=COC(=O)N1 Amb27185570 [1,0,0,1,0,0|2,0,0]=4 3907 B7R1.2 CC1=CSC(=O)N1 Amb19372452 [1,0,0,1,0,0|2,0,0]=4 3908 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [1,0,0,1,0,0|2,0,0]=4 3909 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [1,0,0,1,0,0|2,0,0]=4 3910 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [1,0,0,1,0,0|1,0,0]=3 3911 B7R1.2 CC1=NNC(=O)C1 Amb932788 [1,0,0,1,0,0|2,0,0]=4 3912 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [1,0,0,1,0,0|2,0,0]=4 3913 B7R1.2 CC1=NOC(=O)C1 Amb22274079 [1,0,0,1,0,0|2,0,0]=4 3914 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [1,0,0,1,0,0|2,0,0]=4 3915 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,0,0,1,0,0|0,0,2]=4 3916 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,0,0,1,0,0|0,0,2]=4 3917 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|1,0,1]=4 3918 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,0,0,1,0,0|1,0,1]=4 3919 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,1]=4 3920 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|0,0,2]=4 3921 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|0,0,2]=4 3922 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|1,0,1]=4 3923 B7R1.2 CN1C=CC(=O)C1 Amb28201569 [1,0,0,1,0,0|1,0,1]=4 3924 B7R1.2 CN1CCC(=O)C1 Amb22236123 [1,0,0,1,0,0|1,0,1]=4 3925 B7R1.2 CN1CCC(=O)C1 Amb8947873 [1,0,0,1,0,0|1,0,1]=4 3926 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,0,0,1,0,0|0,0,2]=4 3927 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,2]=4 3928 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|0,0,2]=4 3929 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,0,0,1,0,0|0,0,2]=4 3930 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|0,0,2]=4 3931 B7R1.2 Cc1ccc(Br)o1 Amb10600628 [1,0,0,1,0,0|1,0,1]=4 3932 B7R1.2 Cc1ccc(C)o1 Amb2447078 [1,0,0,1,0,0|1,0,1]=4 3933 B7R1.2 Cc1ccc(Cl)o1 Amb25242029 [1,0,0,1,0,0|1,0,1]=4 3934 B7R1.2 Cc1ccc(F)o1 Amb27397440 [1,0,0,1,0,0|1,0,1]=4 3935 B7R1.2 Cc1ccc(I)o1 Amb25723970 [1,0,0,1,0,0|1,0,1]=4 3936 B7R1.2 Cc1ccc(N)o1 Amb10600629 [1,0,0,1,0,0|1,0,1]=4 3937 B7R1.2 Cc1ccc(O)o1 Amb26645726 [1,0,0,1,0,0|0,0,2]=4 3938 B7R1.2 Cc1ccc(O)s1 Amb17593190 [1,0,0,1,0,0|0,1,1]=4 3939 B7R1.2 Cc1ccc(S)o1 Amb25888543 [1,0,0,1,0,0|0,1,1]=4 3940 B7R1.2 Cc1cnc(Br)o1 Amb24113164 [1,0,0,1,0,0|2,0,0]=4 3941 B7R1.2 Cc1cnc(Br)o1 Amb25861323 [1,0,0,1,0,0|2,0,0]=4 3942 B7R1.2 Cc1cnc(C)o1 Amb23399817 [1,0,0,1,0,0|2,0,0]=4 3943 B7R1.2 Cc1cnc(Cl)o1 Amb19516434 [1,0,0,1,0,0|2,0,0]=4 3944 B7R1.2 Cc1cnc(Cl)o1 Amb24117495 [1,0,0,1,0,0|2,0,0]=4 3945 B7R1.2 Cc1cnc(I)o1 Amb27757971 [1,0,0,1,0,0|2,0,0]=4 3946 B7R1.2 Cc1cnc(N)o1 Amb18277977 [1,0,0,1,0,0|2,0,0]=4 3947 B7R1.2 Cc1cnc(O)s1 Amb13884319 [1,0,0,1,0,0|1,1,0]=4 3948 B7R1.2 Cc1csc(O)c1 Amb20617904 [1,0,0,1,0,0|1,0,1]=4 3949 B7R1.2 N=C1CC(=O)CS1 Amb27227202 [1,0,0,1,0,0|2,0,0]=4 3950 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [1,0,0,1,0,0|2,0,0]=4 3951 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [1,0,0,1,0,0|1,0,1]=4 3952 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [1,0,0,1,0,0|1,0,1]=4 3953 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [1,0,0,1,0,0|1,0,1]=4 3954 B7R1.2 O=C1CC(Br)=CO1 Amb27263920 [1,0,0,1,0,0|2,0,0]=4 3955 B7R1.2 O=C1CC(Cl)=CS1 Amb27239976 [1,0,0,1,0,0|2,0,0]=4 3956 B7R1.2 O=C1CC=C(Br)S1 Amb25961289 [1,0,0,1,0,0|1,1,0]=4 3957 B7R1.2 O=C1CC=C(S)S1 Amb27621600 [1,0,0,1,0,0|1,1,0]=4 3958 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [1,0,0,1,0,0|1,0,1]=4 3959 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [1,0,0,1,0,0|1,0,1]=4 3960 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [1,0,0,1,0,0|2,0,0]=4 3961 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [1,0,0,1,0,0|2,0,0]=4 3962 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [1,0,0,1,0,0|2,0,0]=4 3963 B7R1.2 O=C1COC(=O)C1 Amb2721303 [1,0,0,1,0,0|2,0,0]=4 3964 B7R1.2 O=C1COC(=O)O1 Amb27837383 [1,0,0,1,0,0|2,0,0]=4 3965 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [1,0,0,1,0,0|2,0,0]=4 3966 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [1,0,0,1,0,0|1,0,1]=4 3967 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|1,0,1]=4 3968 B7R1.3 CC1=CCCNC1 Amb23439963 [1,0,0,1,0,0|1,0,1]=4 3969 B7R1.3 CC1=CCCNC1 Amb25063349 [1,0,0,1,0,0|1,0,1]=4 3970 B7R1.3 CC1=CCNCC1 Amb18639053 [1,0,0,1,0,0|2,0,0]=4 3971 B7R1.3 CC1=CCNCC1 Amb21961140 [1,0,0,1,0,0|2,0,0]=4 3972 B7R1.3 CC1=CCOCC1 Amb24070517 [1,0,0,1,0,0|2,0,0]=4 3973 B7R1.3 NC1=CC=CCO1 Amb22167473 [1,0,0,1,0,0|1,0,1]=4 3974 B7R1.3 O=C1C=CC=CO1 Amb21951679 [1,0,0,1,0,0|0,0,2]=4 3975 B7R1.3 O=C1C=CCCO1 Amb15693457 [1,0,0,1,0,0|0,0,2]=4 3976 B7R1.3 O=C1CCC=CN1 Amb26365285 [1,0,0,1,0,0|2,0,0]=4 3977 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|0,0,2]=4 3978 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|1,0,1]=4 3979 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|1,0,1]=4 3980 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,1]=4 3981 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|1,0,1]=4 3982 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,2]=4 3983 B7R1.7 C\C=C\CC1CO1 Amb25285825 [1,0,0,1,0,0|1,0,1]=4 3984 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|0,0,0]=2 3985 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,2]=4 3986 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [1,0,0,1,0,0|0,0,2]=4 3987 B7R1.10 C=C1CC(C=O)C1 Amb22896623 [1,0,0,1,0,0|0,0,2]=4 3988 B7R1.10 CC1CC(C=O)C1 Amb27827798 [1,0,0,1,0,0|0,0,2]=4 3989 B7R1.10 COC1=CC(=O)C1 Amb25092069 [1,0,0,1,0,0|2,0,0]=4 3990 B7R1.12 C=C1CC1C(=O)O Amb9774969 [1,0,0,1,0,0|0,0,2]=4 3991 B7R1.12 CC(=O)C1N=C1C Amb28050540 [1,0,0,1,0,0|2,0,0]=4 3992 B7R1.12 CC(C)C1=C(Br)C1 Amb25972622 [1,0,0,1,0,0|1,0,1]=4 3993 B7R1.12 CC1=CC1C(=O)O Amb27157805 [1,0,0,1,0,0|0,0,0]=2 3994 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|0,0,2]=4 3995 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,1]=4 3996 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|1,0,1]=4 3997 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|1,0,1]=4 3998 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|0,0,2]=4 3999 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|0,0,2]=4 4000 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|1,0,1]=4 4001 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|1,0,1]=4 4002 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|1,0,1]=4 4003 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|0,0,2]=4 4004 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,2]=4 4005 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|1,0,1]=4 4006 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|1,0,1]=4 4007 B7R1.14 CP1(=O)CC=CC1 Amb24093483 [1,0,0,1,0,0|2,0,0]=4 4008 B7R1.14 O=P1(Cl)CC=CC1 Amb25810627 [1,0,0,1,0,0|2,0,0]=4 4009 B7R1.14 O=S1(=O)CC=CC1 Amb2540206 [1,0,0,1,0,0|1,0,1]=4 4010 B7R1.17 CC1(C)C=CC1=O Amb27486040 [1,0,0,1,0,0|0,0,2]=4 4011 B7R1.17 CC1(C)CCC1=O Amb28050382 [1,0,0,1,0,0|0,0,2]=4 4012 B7R1.17 CC1(C)OCC1=O Amb27666218 [1,0,0,1,0,0|1,0,1]=4 4013 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [1,0,0,1,0,0|2,0,0]=4 4014 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|0,0,2]=4 4015 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|0,0,2]=4 4016 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,1]=4 4017 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|1,0,1]=4 4018 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,1]=4 4019 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|1,0,1]=4 4020 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,1,0,0|1,0,1]=4 4021 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,1,0,0|1,0,1]=4 4022 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,1,0,0|1,0,1]=4 4023 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,0,1]=4 4024 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|1,0,1]=4 4025 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|1,0,1]=4 4026 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|1,0,1]=4 4027 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|1,0,1]=4 4028 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|1,0,1]=4 4029 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|1,0,1]=4 4030 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [1,0,0,1,0,0|0,0,2]=4 4031 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|0,0,2]=4 4032 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,1]=4 4033 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|1,0,1]=4 4034 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|1,0,1]=4 4035 B7R1.23 CC1(C)CC1C=O Amb28071200 [1,0,0,1,0,0|0,0,2]=4 4036 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [1,0,0,1,0,0|0,0,2]=4 4037 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|1,0,1]=4 4038 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [1,0,0,1,0,0|1,0,1]=4 4039 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,1,0|1,0,1]=4 4040 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,1,0|1,0,1]=4 4041 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,1,0|0,0,1]=3 4042 B9R1.35 C=C(C)C1=CC(=O)CC1 Amb27838786 [0,0,0,1,0,1|1,0,1]=4 4043 B9R1.35 C=C(C)C1=NCC(=O)O1 Amb27770419 [0,0,0,1,0,1|0,0,1]=3 4044 B9R1.35 C=C(C)C1CNC(=O)O1 Amb33199198 [0,0,0,1,0,1|0,0,2]=4 4045 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,1|0,0,2]=4 4046 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,1|0,0,2]=4 4047 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,1|0,0,2]=4 4048 B9R1.35 CC(=O)C1=CCC(=S)O1 Amb27261937 [0,0,0,1,0,1|1,1,0]=4 4049 B9R1.35 CC(=O)C1=NC(=O)CS1 Amb29850784 [0,0,0,1,0,1|2,0,0]=4 4050 B9R1.35 CC(=O)C1CC(C)=NO1 Amb24457979 [0,0,0,1,0,1|2,0,0]=4 4051 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [0,0,0,1,0,1|1,0,0]=3 4052 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [0,0,0,1,0,1|1,0,1]=4 4053 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,1|1,0,1]=4 4054 B9R1.35 CC(=O)[C@H]1CC(C)=NO1 Amb27212515 [0,0,0,1,0,1|2,0,0]=4 4055 B9R1.35 CC(C)=C1CCC(O)C1 Amb27956597 [0,0,0,1,0,1|1,0,1]=4 4056 B9R1.35 CC(C)=C1N=CC(=O)O1 Amb27843713 [0,0,0,1,0,1|0,0,1]=3 4057 B9R1.35 CC(C)C1=CC(=O)CC1 Amb26866593 [0,0,0,1,0,1|1,0,1]=4 4058 B9R1.35 CC(C)C1=CCC(=O)O1 Amb27462536 [0,0,0,1,0,1|0,0,1]=3 4059 B9R1.35 CC(C)C1=NCC(=O)N1 Amb27446386 [0,0,0,1,0,1|1,0,1]=4 4060 B9R1.35 CC(C)C1=NNC(=O)O1 Amb20246867 [0,0,0,1,0,1|1,0,1]=4 4061 B9R1.35 CC(C)C1=NSC(=O)O1 Amb27762657 [0,0,0,1,0,1|1,0,1]=4 4062 B9R1.35 CC(C)C1CNC(=O)O1 Amb27494066 [0,0,0,1,0,1|0,0,2]=4 4063 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,1|0,0,2]=4 4064 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,1,0,1|0,0,2]=4 4065 B9R1.35 CC1=CCC(C(N)=O)C1 Amb28195175 [0,0,0,1,0,1|1,0,0]=3 4066 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,1,0,1|1,0,1]=4 4067 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,1,0,1|1,0,1]=4 4068 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,1|1,0,1]=4 4069 B9R1.35 CC1=NC(C(=O)O)CS1 Amb18124720 [0,0,0,1,0,1|1,0,1]=4 4070 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [0,0,0,1,0,1|1,0,1]=4 4071 B9R1.35 CC1=NCC(C(=O)O)S1 Amb27958674 [0,0,0,1,0,1|1,0,1]=4 4072 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [0,0,0,1,0,1|1,0,1]=4 4073 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,1,0,1|1,0,0]=3 4074 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,1,0,1|1,0,0]=3 4075 B9R1.35 CC1=N[C@@H](C(=O)O)CS1 Amb32676192 [0,0,0,1,0,1|1,0,1]=4 4076 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,1,0,1|1,0,1]=4 4077 B9R1.35 CC1=N[C@H](C(=O)O)CS1 Amb35648200 [0,0,0,1,0,1|1,0,1]=4 4078 B9R1.35 CC1C=CC(C(=O)O)O1 Amb18642586 [0,0,0,1,0,1|1,0,1]=4 4079 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,1|0,0,2]=4 4080 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,1|0,0,2]=4 4081 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [0,0,0,1,0,1|1,0,1]=4 4082 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,1|0,0,2]=4 4083 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|0,0,2]=4 4084 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|0,0,2]=4 4085 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,1|0,0,2]=4 4086 B9R1.35 CN(C)C1=CC(=O)CC1 Amb28131924 [0,0,0,1,0,1|2,0,0]=4 4087 B9R1.35 CN(C)C1=NC(=O)CC1 Amb27944641 [0,0,0,1,0,1|2,0,0]=4 4088 B9R1.35 CN(C)C1=NC(=O)CS1 Amb27212694 [0,0,0,1,0,1|2,0,0]=4 4089 B9R1.35 CN(C)C1=NCC(=O)N1 Amb25246655 [0,0,0,1,0,1|2,0,0]=4 4090 B9R1.35 CN(C)C1=NCC(=O)O1 Amb28075156 [0,0,0,1,0,1|1,0,0]=3 4091 B9R1.35 CN1C=NC(C(=O)O)C1 Amb28934983 [0,0,0,1,0,1|1,0,0]=3 4092 B9R1.35 CN1C=NC(C(=O)O)C1 Amb8393352 [0,0,0,1,0,1|1,0,0]=3 4093 B9R1.35 CN1CC(C(=O)O)=CO1 Amb22388521 [0,0,0,1,0,1|1,0,1]=4 4094 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,0,0,1,0,1|1,0,1]=4 4095 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,0,0,1,0,1|1,0,1]=4 4096 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,0,0,1,0,1|1,0,1]=4 4097 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,0,0,1,0,1|1,0,1]=4 4098 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,0,0,1,0,1|1,0,1]=4 4099 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)O)S1 Amb28347473 [0,0,0,1,0,1|1,0,1]=4 4100 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [0,0,0,1,0,1|0,0,1]=3 4101 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,1|0,0,2]=4 4102 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,1|0,0,2]=4 4103 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|0,0,2]=4 4104 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|0,0,2]=4 4105 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,1|0,0,2]=4 4106 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|0,0,2]=4 4107 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|0,0,2]=4 4108 B9R1.35 Cc1cc(C(=O)O)co1 Amb16231454 [0,0,0,1,0,1|0,0,2]=4 4109 B9R1.35 Cc1cc(C(=O)O)cs1 Amb6335894 [0,0,0,1,0,1|0,0,2]=4 4110 B9R1.35 Cc1ccc(C(=O)O)o1 Amb6318544 [0,0,0,1,0,1|1,0,1]=4 4111 B9R1.35 Cc1ccc(C(=O)O)s1 Amb1157149 [0,0,0,1,0,1|1,0,1]=4 4112 B9R1.35 Cc1cnc(C(=O)O)o1 Amb18832708 [0,0,0,1,0,1|1,0,1]=4 4113 B9R1.35 Cc1cnc(C(=O)O)s1 Amb8010646 [0,0,0,1,0,1|1,0,1]=4 4114 B9R1.35 Cc1coc(C(=O)O)c1 Amb18642368 [0,0,0,1,0,1|0,0,2]=4 4115 B9R1.35 Cc1coc(C(=O)O)n1 Amb18832706 [0,0,0,1,0,1|1,0,1]=4 4116 B9R1.35 Cc1csc(C(=O)O)c1 Amb2691600 [0,0,0,1,0,1|0,0,2]=4 4117 B9R1.35 Cc1csc(C(=O)O)n1 Amb5759010 [0,0,0,1,0,1|1,0,1]=4 4118 B9R1.35 Cc1nc(C(=O)O)co1 Amb6307241 [0,0,0,1,0,1|1,0,1]=4 4119 B9R1.35 Cc1nc(C(=O)O)cs1 Amb22587710 [0,0,0,1,0,1|1,0,1]=4 4120 B9R1.35 Cc1nc(C(=O)O)cs1 Amb2723085 [0,0,0,1,0,1|1,0,1]=4 4121 B9R1.35 Cc1nc(C(=O)O)cs1 Amb33446967 [0,0,0,1,0,1|1,0,1]=4 4122 B9R1.35 Cc1ncc(C(=O)O)o1 Amb17399815 [0,0,0,1,0,1|1,0,1]=4 4123 B9R1.35 Cc1ncc(C(=O)O)s1 Amb8630402 [0,0,0,1,0,1|1,0,1]=4 4124 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20622377 [0,0,0,1,0,1|1,0,1]=4 4125 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20623555 [0,0,0,1,0,1|1,0,1]=4 4126 B9R1.35 N[C@@H]1C=C[C@H](C(=O)O)C1 Amb8516355 [0,0,0,1,0,1|1,0,1]=4 4127 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb16232675 [0,0,0,1,0,1|1,0,1]=4 4128 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb19515761 [0,0,0,1,0,1|1,0,1]=4 4129 B9R1.35 O=C(O)C1CC(Br)=NO1 Amb26852251 [0,0,0,1,0,1|2,0,0]=4 4130 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,1,0,1|1,0,1]=4 4131 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,1,0,1|1,0,0]=3 4132 B9R1.35 O=C1C=CC(C(=O)O)N1 Amb27775192 [0,0,0,1,0,1|2,0,0]=4 4133 B9R1.35 O=C1CC(C(=O)O)=CN1 Amb18832707 [0,0,0,1,0,1|1,0,1]=4 4134 B9R1.35 O=C1CC(C(=O)O)=CO1 Amb3499387 [0,0,0,1,0,1|1,0,1]=4 4135 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,1,0,1|1,0,1]=4 4136 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,1,0,1|1,0,1]=4 4137 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,1,0,1|1,0,1]=4 4138 B9R1.35 O=C1CC(C(=O)O)NN1 Amb18642739 [0,0,0,1,0,1|2,0,0]=4 4139 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,1|1,0,1]=4 4140 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,1|1,0,1]=4 4141 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,1|1,0,1]=4 4142 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,1|1,0,1]=4 4143 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,1|1,0,1]=4 4144 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,1|1,0,1]=4 4145 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,1|1,0,1]=4 4146 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,1,0,1|1,0,1]=4 4147 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,1,0,1|1,0,1]=4 4148 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,1,0,1|1,0,1]=4 4149 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,1,0,1|1,0,1]=4 4150 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,1,0,1|1,0,1]=4 4151 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,0,0,1,0,1|0,0,2]=4 4152 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,0,0,1,0,1|0,0,2]=4 4153 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [0,0,0,1,0,1|0,0,2]=4 4154 B9R1.46 O=C(O)CCC1=C(Br)C1 Amb27650642 [0,0,0,1,0,1|1,0,0]=3 4155 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,0,0,1,0,1|1,0,0]=3 4156 B9R1.49 O=C1COC(=O)CCN1 Amb27168286 [0,0,0,1,0,1|1,0,1]=4 4157 B9R1.53 C=C1CC(CC(=O)O)C1 Amb35788335 [0,0,0,1,0,1|0,0,2]=4 4158 B9R1.53 C=C1CN(CC(=O)O)C1 Amb30026788 [0,0,0,1,0,1|0,0,2]=4 4159 B9R1.53 CC1CC(CC(=O)O)C1 Amb27461451 [0,0,0,1,0,1|0,0,2]=4 4160 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,0,0,1,0,1|0,0,2]=4 4161 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,0,0,1,0,1|0,0,2]=4 4162 B9R1.53 CN1CC(CC(=O)O)C1 Amb26596162 [0,0,0,1,0,1|1,0,1]=4 4163 B9R1.53 CN1CC(CC(=O)O)C1 Amb28895941 [0,0,0,1,0,1|1,0,1]=4 4164 B9R1.53 C[C@H]1C[C@H](CC(=O)O)C1 Amb27859343 [0,0,0,1,0,1|0,0,2]=4 4165 B9R1.53 O=C(O)CC1CC(=O)C1 Amb27493654 [0,0,0,1,0,1|1,0,1]=4 4166 B9R1.53 O=C(O)CC1CC(=O)N1 Amb24351879 [0,0,0,1,0,1|1,0,1]=4 4167 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,0,0,1,0,1|0,0,2]=4 4168 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,0,0,1,0,1|0,0,2]=4 4169 B9R1.66 CC1(C)OC=CC(=O)O1 Amb27635269 [0,0,0,1,0,1|0,0,2]=4 4170 B9R1.66 C[Si]1(C)CCCC(=O)O1 Amb27845166 [0,0,0,1,0,1|0,1,1]=4 4171 B9R1.85 CC(C)=CCCC1CO1 Amb28207204 [0,0,0,1,0,1|1,0,1]=4 4172 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,0,0,1,0,1|0,0,2]=4 4173 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,0,0,1,0,1|0,0,2]=4 4174 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,0,0,1,0,1|0,0,2]=4 4175 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [0,0,0,1,0,1|0,0,2]=4 4176 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,0,0,1,0,1|0,0,2]=4 4177 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,0,0,1,0,1|0,0,2]=4 4178 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,0,0,1,0,1|0,0,2]=4 4179 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,0,0,1,0,1|0,0,2]=4 4180 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [0,0,0,1,0,1|0,0,2]=4 4181 B9R1.85 O=C(O)\C=C\NC1CC1 Amb22363623 [0,0,0,1,0,1|0,0,2]=4 4182 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [0,0,0,1,0,1|0,0,2]=4 4183 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [0,0,0,1,0,1|0,0,2]=4 4184 B9R1.161 CC(=O)C1=NC1C(C)=O Amb25728261 [0,0,0,1,0,1|2,0,0]=4 4185 B9R1.161 CC(=O)C1CC1=C(C)C Amb27409612 [0,0,0,1,0,1|1,0,0]=3 4186 B9R1.161 CC(C)=C1CC1C(C)O Amb27806624 [0,0,0,1,0,1|1,0,1]=4 4187 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,0,1,0,1|0,0,2]=4 4188 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,0,1,0,1|0,0,2]=4 4189 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,1|0,0,2]=4 4190 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,0,0,1,0,1|0,0,2]=4 4191 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,0,0,1,0,1|0,0,2]=4 4192 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,0,0,1,0,1|0,0,2]=4 4193 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,0,0,1,0,1|0,0,2]=4 4194 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,0,0,1,0,1|0,0,2]=4 4195 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,0,0,1,0,1|0,0,2]=4 4196 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,0,0,1,0,1|0,0,2]=4 4197 B9R1.170 CC1(C)C\C1=C/C(=O)O Amb25056977 [0,0,0,1,0,1|0,0,2]=4 4198 B9R1.1 C#CC1=CCC(=O)CC1 Amb28249288 [0,1,0,1,0,0|1,0,1]=4 4199 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [0,1,0,1,0,0|1,0,1]=4 4200 B9R1.1 CC1=CCC(CO)CC1 Amb2699906 [0,1,0,1,0,0|1,0,1]=4 4201 B9R1.1 CC=C1CCC(=O)CC1 Amb28129794 [0,1,0,1,0,0|1,0,1]=4 4202 B9R1.1 CCC1=CCC(O)CC1 Amb27618200 [0,1,0,1,0,0|1,0,1]=4 4203 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,1]=4 4204 B9R1.1 COC1=CCC(O)CC1 Amb21858056 [0,1,0,1,0,0|1,0,1]=4 4205 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|1,0,1]=4 4206 B9R1.1 N#CC1=CCC(=O)CC1 Amb27588804 [0,1,0,1,0,0|1,0,1]=4 4207 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,1,0,1,0,0|1,0,1]=4 4208 B9R1.1 O=C1C=CC(CO)=CO1 Amb25835811 [0,1,0,1,0,0|0,0,2]=4 4209 B9R1.1 O=C1CC=C(CO)CC1 Amb28253672 [0,1,0,1,0,0|1,0,0]=3 4210 B9R1.1 O=C1COC(CCl)CO1 Amb33734959 [0,1,0,1,0,0|1,0,1]=4 4211 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|1,0,1]=4 4212 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [0,1,0,1,0,0|1,0,1]=4 4213 B9R1.10 CC1(C)CCC(=O)OC1 Amb28120623 [0,1,0,1,0,0|0,0,2]=4 4214 B9R1.10 CC1(C)OCC(=O)CO1 Amb5718679 [0,1,0,1,0,0|1,0,1]=4 4215 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,1,0,1,0,0|0,0,2]=4 4216 B9R1.55 CC(C)=C1CC(C)C1=O Amb27838814 [0,1,0,1,0,0|1,0,1]=4 4217 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,1,0,1,0,0|0,0,2]=4 4218 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,1,0,0|0,0,2]=4 4219 B9R1.55 CN1CC(C(=O)O)C1=O Amb17593354 [0,1,0,1,0,0|1,0,0]=3 4220 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,1,0,1,0,0|0,0,2]=4 4221 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [0,1,0,1,0,0|2,0,0]=4 4222 B9R1.67 CC(C)=CC1CCC1=O Amb27948578 [0,1,0,1,0,0|1,0,0]=3 4223 B9R1.67 CC(C)=CC1CCC1O Amb32944793 [0,1,0,1,0,0|1,0,1]=4 4224 B9R1.67 CC(C)=CC1SCC1=O Amb27180398 [0,1,0,1,0,0|0,1,0]=3 4225 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,1]=4 4226 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,1]=4 4227 B9R1.69 CC1=C(C)NC(=O)C=C1 Amb19516765 [0,1,0,1,0,0|1,0,1]=4 4228 B9R1.69 CC1=C(C)NC(=O)CC1 Amb8394546 [0,1,0,1,0,0|1,0,1]=4 4229 B9R1.69 CC1=CC(C)C(O)CC1 Amb27664856 [0,1,0,1,0,0|1,0,1]=4 4230 B9R1.69 CC1=CC=C(O)C(=O)N1 Amb24725980 [0,1,0,1,0,0|1,0,1]=4 4231 B9R1.69 CC1=CCC(=O)C[C@@H]1C Amb27434226 [0,1,0,1,0,0|1,0,0]=3 4232 B9R1.69 CC1=CCC(O)C(C)C1 Amb27977995 [0,1,0,1,0,0|1,0,1]=4 4233 B9R1.69 CC1=CCC(O)C(O)C1 Amb28208568 [0,1,0,1,0,0|0,0,2]=4 4234 B9R1.69 CC1=CC[C@@H](O)C(C)C1 Amb27956617 [0,1,0,1,0,0|1,0,1]=4 4235 B9R1.69 CC1=CC[C@@H](O)C[C@H]1C Amb27970535 [0,1,0,1,0,0|1,0,1]=4 4236 B9R1.69 CC1=CC[C@@H](O)[C@H](O)C1 Amb27422441 [0,1,0,1,0,0|0,0,2]=4 4237 B9R1.69 CC1=CC[C@H](O)C[C@@H]1C Amb27446679 [0,1,0,1,0,0|1,0,1]=4 4238 B9R1.69 CC1=CC[C@H](O)[C@H](O)C1 Amb27882767 [0,1,0,1,0,0|0,0,2]=4 4239 B9R1.69 CC1=CNC(=O)CC1=O Amb27246493 [0,1,0,1,0,0|1,0,1]=4 4240 B9R1.69 CC1=CNC(=O)OC1=O Amb28208149 [0,1,0,1,0,0|1,0,1]=4 4241 B9R1.69 CC1=C[C@@H](N)[C@@H](C)OC1 Amb27188228 [0,1,0,1,0,0|1,0,1]=4 4242 B9R1.69 CC1=C[C@@H](O)[C@H](O)CC1 Amb27255140 [0,1,0,1,0,0|1,0,1]=4 4243 B9R1.69 CC1=C[C@H](O)[C@H](O)CC1 Amb28321435 [0,1,0,1,0,0|1,0,1]=4 4244 B9R1.69 CC1=N[C@@H](C)C(=O)OC1 Amb27656381 [0,1,0,1,0,0|1,0,0]=3 4245 B9R1.69 CC1CCC(=O)C(O)C1 Amb25333970 [0,1,0,1,0,0|0,0,2]=4 4246 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 4247 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 4248 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [0,1,0,1,0,0|2,0,0]=4 4249 B9R1.69 CC1OC(=O)C=CC1=O Amb27948593 [0,1,0,1,0,0|1,0,1]=4 4250 B9R1.69 CC1OC(=O)COC1=O Amb27421415 [0,1,0,1,0,0|2,0,0]=4 4251 B9R1.69 CN1CCC(=O)C(O)C1 Amb32649088 [0,1,0,1,0,0|1,0,1]=4 4252 B9R1.69 CN1CCC(=O)CC1=O Amb27154977 [0,1,0,1,0,0|2,0,0]=4 4253 B9R1.69 CN1CNC(=O)CC1=O Amb27267762 [0,1,0,1,0,0|2,0,0]=4 4254 B9R1.69 C[C@@H]1CCC(=O)C(O)C1 Amb27838716 [0,1,0,1,0,0|0,0,2]=4 4255 B9R1.69 C[C@@H]1CCC(=O)[C@H](O)C1 Amb27434293 [0,1,0,1,0,0|0,0,2]=4 4256 B9R1.69 C[C@@H]1NC(=O)COC1=O Amb28059067 [0,1,0,1,0,0|2,0,0]=4 4257 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,1,0,1,0,0|0,0,2]=4 4258 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,1,0,1,0,0|0,0,2]=4 4259 B9R1.69 C[C@H]1OC(=O)C=CC1=O Amb28351021 [0,1,0,1,0,0|1,0,1]=4 4260 B9R1.69 Cc1ccc(O)cc1C Amb3939551 [0,1,0,1,0,0|1,0,1]=4 4261 B9R1.69 Cc1cnc(O)nc1C Amb20182445 [0,1,0,1,0,0|2,0,0]=4 4262 B9R1.69 Cc1cnc(O)nc1C Amb22587317 [0,1,0,1,0,0|2,0,0]=4 4263 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,1,0,1,0,0|1,0,1]=4 4264 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,1,0,1,0,0|1,0,1]=4 4265 B9R1.78 CC1CC1CC(=O)NO Amb27981204 [0,1,0,1,0,0|0,0,2]=4 4266 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,1]=4 4267 B9R1.80 COC(=O)CNC1CC1 Amb6706354 [0,1,0,1,0,0|1,0,1]=4 4268 B9R1.80 COC(=O)CSC1CC1 Amb6760569 [0,1,0,1,0,0|1,0,1]=4 4269 B9R1.80 COC(=O)\C=C\C1CC1 Amb33986066 [0,1,0,1,0,0|0,0,2]=4 4270 B9R1.80 O=C(CCC1CC1)NO Amb28248660 [0,1,0,1,0,0|0,0,2]=4 4271 B9R1.80 O=C(CNC1CC1)NO Amb27395406 [0,1,0,1,0,0|1,0,1]=4 4272 B9R1.82 C=C1CC(C(=O)OC)C1 Amb21962131 [0,1,0,1,0,0|0,0,2]=4 4273 B9R1.82 CC(CO)C1CC(=O)O1 Amb28315511 [0,1,0,1,0,0|0,0,2]=4 4274 B9R1.82 CC1CC(C(=O)NO)C1 Amb27203488 [0,1,0,1,0,0|0,0,2]=4 4275 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,1]=4 4276 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,1,0,1,0,0|2,0,0]=4 4277 B9R1.82 COC(=O)C1CC(C)C1 Amb25771219 [0,1,0,1,0,0|0,0,2]=4 4278 B9R1.82 COC(=O)C1CC(C)N1 Amb33743739 [0,1,0,1,0,0|1,0,1]=4 4279 B9R1.82 COC(=O)C1CC(C)N1 Amb33743758 [0,1,0,1,0,0|1,0,1]=4 4280 B9R1.82 COC(=O)C1CC(C)O1 Amb22737249 [0,1,0,1,0,0|1,0,1]=4 4281 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,1,0,1,0,0|2,0,0]=4 4282 B9R1.82 COC(=O)[C@@H]1CC(=S)N1 Amb24478569 [0,1,0,1,0,0|2,0,0]=4 4283 B9R1.82 COC(=O)[C@@H]1C[C@@H](C)O1 Amb24056487 [0,1,0,1,0,0|1,0,1]=4 4284 B9R1.82 COC(=O)[C@@H]1C[C@H](C)O1 Amb26885653 [0,1,0,1,0,0|1,0,1]=4 4285 B9R1.82 O=C1CC(C(=O)NO)C1 Amb27163827 [0,1,0,1,0,0|1,0,1]=4 4286 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|0,0,2]=4 4287 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,1,0,1,0,0|0,0,2]=4 4288 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,1]=4 4289 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,1,0,1,0,0|0,0,2]=4 4290 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,1,0,1,0,0|1,0,0]=3 4291 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,1]=4 4292 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|1,0,1]=4 4293 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|1,0,1]=4 4294 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,1]=4 4295 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,1]=4 4296 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|1,0,1]=4 4297 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|1,0,1]=4 4298 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,1]=4 4299 B9R1.84 O=C(O)CSC1COC1 Amb27589904 [0,1,0,1,0,0|1,0,1]=4 4300 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [0,1,0,1,0,0|0,0,2]=4 4301 B9R1.84 O=C(O)\C=C\N1CCC1 Amb27494371 [0,1,0,1,0,0|1,0,1]=4 4302 B9R1.86 CC(C)=CC1CC1C=O Amb27169456 [0,1,0,1,0,0|1,0,1]=4 4303 B9R1.86 CC(C)=C[C@@H]1C[C@@H]1C=O Amb28411163 [0,1,0,1,0,0|1,0,1]=4 4304 B9R1.86 CC(C)=C[C@@H]1C[C@H]1C=O Amb28130990 [0,1,0,1,0,0|1,0,1]=4 4305 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|0,0,2]=4 4306 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,1,0,1,0,0|0,0,2]=4 4307 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,1,0,1,0,0|0,0,2]=4 4308 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,1,0,1,0,0|1,0,1]=4 4309 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,1,0,1,0,0|0,0,2]=4 4310 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,1,0,1,0,0|0,0,2]=4 4311 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,1,0,1,0,0|0,0,2]=4 4312 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,1,0,1,0,0|0,0,2]=4 4313 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,1,0,1,0,0|0,0,2]=4 4314 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,1,0,1,0,0|0,0,2]=4 4315 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,1,0,1,0,0|0,0,2]=4 4316 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,1,0,1,0,0|0,0,2]=4 4317 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,1,0,1,0,0|0,0,2]=4 4318 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,1,0,1,0,0|0,0,2]=4 4319 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,1,0,1,0,0|0,0,2]=4 4320 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,1,0,1,0,0|0,0,2]=4 4321 B9R1.95 NN=C1CC(C(=O)O)C1 Amb23570285 [0,1,0,1,0,0|1,0,1]=4 4322 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|0,0,2]=4 4323 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,1,0,1,0,0|0,0,2]=4 4324 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,1,0,1,0,0|0,0,2]=4 4325 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,1,0,1,0,0|0,0,2]=4 4326 B9R1.104 CC1=C(CC(C)O)C1C Amb27972526 [0,1,0,1,0,0|1,0,1]=4 4327 B9R1.125 CC1(CN)CCC(=O)O1 Amb27815595 [0,1,0,1,0,0|0,0,2]=4 4328 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|0,0,2]=4 4329 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|0,0,2]=4 4330 B9R1.133 CCC1=CCS(=O)(=O)C1 Amb26019564 [0,1,0,1,0,0|1,0,1]=4 4331 B9R1.133 NCC1=CCS(=O)(=O)C1 Amb4166378 [0,1,0,1,0,0|1,0,1]=4 4332 B9R1.133 O=S1(=O)CC=C(CBr)C1 Amb1058866 [0,1,0,1,0,0|1,0,1]=4 4333 B9R1.133 [NH3+]CC1=CCS(=O)(=O)C1 Amb2548456 [0,1,0,1,0,0|1,0,1]=4 4334 B9R1.133 [NH3+]CC1=CCS(=O)(=O)C1 Amb9804798 [0,1,0,1,0,0|1,0,1]=4 4335 B9R1.138 CC1(C)NCC(=O)N1O Amb27945580 [0,1,0,1,0,0|1,0,1]=4 4336 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,1,0,1,0,0|0,0,2]=4 4337 B9R1.147 CC1(NCC(=O)O)CC1 Amb27444501 [0,1,0,1,0,0|1,0,1]=4 4338 B9R1.147 CC1(OCC(=O)O)CC1 Amb26056469 [0,1,0,1,0,0|1,0,1]=4 4339 B9R1.147 CC1(\C=C\C(=O)O)CC1 Amb33313120 [0,1,0,1,0,0|0,0,2]=4 4340 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,1,0,1,0,0|0,0,2]=4 4341 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,1,0,1,0,0|0,0,2]=4 4342 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,1,0,1,0,0|0,0,2]=4 4343 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,1,0,1,0,0|0,0,2]=4 4344 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|0,0,2]=4 4345 B9R1.185 COC(=O)C1OC1(C)C Amb4418353 [0,1,0,1,0,0|1,0,1]=4 4346 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,1,0,1,0,0|0,0,2]=4 4347 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,1,0,1,0,0|0,0,2]=4 4348 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,1,0,1,0,0|0,0,2]=4 4349 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,1,0,1,0,0|0,0,2]=4 4350 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,1,0,1,0,0|0,0,2]=4 4351 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,1,0,1,0,0|0,0,2]=4 4352 B9R1.36 CC1=C(C)CS(=O)(=O)C1 Amb1420289 [0,1,0,1,0,0|1,0,1]=4 4353 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,1,0,1,0,0|0,0,2]=4 4354 B9R1.38 C=C1OC(=O)OC1(C)C Amb1033029 [0,1,0,1,0,0|1,0,1]=4 4355 B9R1.38 CC1(C)CC(=O)CC1=O Amb25993979 [0,1,0,1,0,0|1,0,1]=4 4356 B9R1.38 CC1(C)NC(=O)CC1=O Amb18832699 [0,1,0,1,0,0|1,0,1]=4 4357 B9R1.38 CC1(C)OC(=O)C=C1N Amb28193555 [0,1,0,1,0,0|0,0,2]=4 4358 B9R1.38 CC1(C)OC(=O)C=C1O Amb28060059 [0,1,0,1,0,0|0,0,2]=4 4359 B9R1.38 CC1(C)OC(=O)CC1=O Amb27838818 [0,1,0,1,0,0|0,0,1]=3 4360 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,1,0,1,0,0|0,0,2]=4 4361 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,1,0,1,0,0|1,0,1]=4 4362 B9R1.38 CC1(C)OC(=O)NC1=O Amb6296615 [0,1,0,1,0,0|1,0,1]=4 4363 B9R1.38 CC1=CC(=O)OC1(C)C Amb32664388 [0,1,0,1,0,0|0,0,2]=4 4364 B9R1.38 CC1=CC(C)S(=O)(=O)C1 Amb2813289 [0,1,0,1,0,0|1,0,1]=4 4365 B9R1.38 CC1CC(=O)OC1(C)C Amb28206444 [0,1,0,1,0,0|0,0,2]=4 4366 B9R1.44 CC(C)=CC1(C)OC1C Amb27255711 [0,1,0,1,0,0|1,0,1]=4 4367 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,1,0,1,0,0|0,0,2]=4 4368 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,1,0,1,0,0|0,0,2]=4 4369 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,1,0,1,0,0|0,0,2]=4 4370 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [0,1,0,1,0,0|0,0,2]=4 4371 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [0,1,0,1,0,0|0,0,2]=4 4372 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,1,0,1,0,0|0,0,2]=4 4373 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,1,0,1,0,0|0,0,2]=4 4374 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,1,0,1,0,0|0,0,2]=4 4375 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,1,0,1,0,0|0,0,2]=4 4376 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,1,0,1,0,0|0,0,2]=4 4377 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,1,0,1,0,0|1,0,1]=4 4378 B9R1.112 CC(O)C(C)C=C1CC1 Amb27180609 [0,1,0,1,0,0|1,0,1]=4 4379 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,1,0,1,0,0|1,0,1]=4 4380 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,1,0,1,0,0|0,0,2]=4 4381 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,1,0,1,0,0|1,0,1]=4 4382 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,1,0,1,0,0|0,0,2]=4 4383 B9R1.112 C\C(=C/C1CC1)C(=O)O Amb25996000 [0,1,0,1,0,0|0,0,2]=4 4384 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,1,0,1,0,0|0,0,2]=4 4385 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,1,0,1,0,0|0,0,2]=4 4386 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,1,0,1,0,0|0,0,2]=4 4387 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,1,0,1,0,0|0,0,2]=4 4388 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,1,0,1,0,0|0,0,2]=4 4389 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,1,0,1,0,0|0,0,2]=4 4390 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|0,0,2]=4 4391 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,1,0,1,0,0|0,0,2]=4 4392 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,1,0,1,0,0|0,0,2]=4 4393 B9R1.112 O=C(O)\C(F)=C\C1CC1 Amb25102827 [0,1,0,1,0,0|0,0,2]=4 4394 B9R1.137 CC(=O)CC(=O)C1CC1 Amb9206108 [0,1,0,1,0,0|1,0,1]=4 4395 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,1,0,1,0,0|0,0,2]=4 4396 B9R1.137 CC(CC(C)O)=C1CC1 Amb28315518 [0,1,0,1,0,0|1,0,1]=4 4397 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,1,0,1,0,0|1,0,1]=4 4398 B9R1.137 C\C(=C/C(=O)O)C1CC1 Amb10609547 [0,1,0,1,0,0|0,0,2]=4 4399 B9R1.137 C\C(=C\C(=O)O)C1CC1 Amb10718081 [0,1,0,1,0,0|0,0,2]=4 4400 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,1,0,1,0,0|0,0,2]=4 4401 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,1,0,1,0,0|0,0,2]=4 4402 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,1,0,1,0,0|0,0,2]=4 4403 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,1,0,1,0,0|0,0,2]=4 4404 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,1,0,1,0,0|0,0,2]=4 4405 B9R1.137 O=C(O)CC(=O)C1CC1 Amb10576272 [0,1,0,1,0,0|0,0,1]=3 4406 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,1,0,1,0,0|0,0,2]=4 4407 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,1,0,1,0,0|0,0,2]=4 4408 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,1,0,1,0,0|0,0,2]=4 4409 B9R1.137 O=C(O)\C=C(\Cl)C1CC1 Amb25272142 [0,1,0,1,0,0|0,0,2]=4 4410 B9R1.139 C=C1C(C(C)=O)C1(C)C Amb27762509 [0,1,0,1,0,0|1,0,1]=4 4411 B9R1.139 CC1(C)C(Br)C1C(=O)O Amb28078793 [0,1,0,1,0,0|0,0,2]=4 4412 B9R1.139 CC1(C)C(C(=O)O)[C@H]1Cl Amb28043135 [0,1,0,1,0,0|0,0,2]=4 4413 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,1,0,1,0,0|0,0,2]=4 4414 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27247272 [0,1,0,1,0,0|0,0,2]=4 4415 B9R1.139 C[C@H]1[C@@H](C(=O)O)C1(C)C Amb28429827 [0,1,0,1,0,0|0,0,2]=4 4416 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [0,1,0,1,0,0|0,0,2]=4 4417 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,1,0,1,0,0|0,0,2]=4 4418 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [0,1,0,1,0,0|0,0,2]=4 4419 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [0,1,0,1,0,0|1,0,1]=4 4420 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,1,0,1,0,0|0,0,2]=4 4421 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,1,0,1,0,0|0,0,2]=4 4422 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,1,0,1,0,0|0,0,2]=4 4423 B9R1.152 CN1CC(C)(C(=O)O)C1 Amb27264651 [0,1,0,1,0,0|1,0,1]=4 4424 B9R1.152 CN1CC(N)(C(=O)O)C1 Amb28312895 [0,1,0,1,0,0|1,0,1]=4 4425 B9R1.152 CN1CC(O)(C(=O)O)C1 Amb28347279 [0,1,0,1,0,0|1,0,1]=4 4426 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [0,1,0,1,0,0|1,0,1]=4 4427 B9R1.164 CC1(C)C=C(C(=O)O)C1 Amb22405981 [0,1,0,1,0,0|0,0,2]=4 4428 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,1,0,1,0,0|0,0,2]=4 4429 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,1,0,1,0,0|0,0,2]=4 4430 B9R1.164 CC1(Cl)CC(C(=O)O)C1 Amb28364447 [0,1,0,1,0,0|0,0,2]=4 4431 B9R1.164 CC1(F)CC(C(=O)O)C1 Amb23439467 [0,1,0,1,0,0|0,0,2]=4 4432 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,1,0,1,0,0|0,0,2]=4 4433 B9R1.164 C[C@]1(Cl)C[C@@H](C(=O)O)C1 Amb27170444 [0,1,0,1,0,0|0,0,2]=4 4434 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 Amb26394027 [0,1,0,1,0,0|0,0,2]=4 4435 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 Amb28350729 [0,1,0,1,0,0|0,0,2]=4 4436 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,1,0,1,0,0|0,0,2]=4 4437 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,1,0,1,0,0|0,0,2]=4 4438 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,1,0,1,0,0|0,0,2]=4 4439 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,1,0,1,0,0|0,0,2]=4 4440 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,1,0,1,0,0|0,0,2]=4 4441 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,2,0,0|0,0,2]=4 4442 B9R2.35 CC1=C[C@@H]2C(=O)N[C@H]12 Amb28133669 [0,0,0,2,0,0|1,0,0]=3 4443 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|0,0,2]=4 4444 B9R2.145 O=C(O)C12CC(C1)C2 Amb22493631 [0,0,0,2,0,0|0,0,2]=4 4445 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|0,0,2]=4 4446 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|0,0,2]=4 4447 B5R0.5 C=C(Br)C(=O)O Amb20620403 [0,0,0,0,2,0|1,0,1]=4 4448 B5R0.5 C=C(C)C(=O)Cl Amb534203 [0,0,0,0,2,0|1,0,1]=4 4449 B5R0.5 C=C(C)C(=O)O Amb6608998 [0,0,0,0,2,0|0,0,1]=3 4450 B5R0.5 C=C(C)C(C)=O Amb17593021 [0,0,0,0,2,0|1,0,1]=4 4451 B5R0.5 C=C(C)C(N)=O Amb6609019 [0,0,0,0,2,0|1,0,1]=4 4452 B5R0.5 C=C(Cl)C(=O)O Amb17933971 [0,0,0,0,2,0|1,0,1]=4 4453 B5R0.5 C=C(F)C(=O)O Amb2688008 [0,0,0,0,2,0|1,0,1]=4 4454 B5R0.5 CC(=O)C(=O)Cl Amb17593107 [0,0,0,0,2,0|2,0,0]=4 4455 B5R0.5 CC(=O)C(=O)O Amb932807 [0,0,0,0,2,0|1,0,0]=3 4456 B5R0.5 CC(=O)C(=O)[O-] Amb22043412 [0,0,0,0,2,0|1,0,1]=4 4457 B5R0.5 CC(=O)C(C)=O Amb6608675 [0,0,0,0,2,0|2,0,0]=4 4458 B5R0.5 CC(=O)C(C)=S Amb27632834 [0,0,0,0,2,0|2,0,0]=4 4459 B5R0.5 CC(=O)C(C)C Amb4605987 [0,0,0,0,2,0|1,0,1]=4 4460 B5R0.5 CC(=O)C(N)=O Amb17593028 [0,0,0,0,2,0|2,0,0]=4 4461 B5R0.5 CC(=O)N(C)C Amb24323347 [0,0,0,0,2,0|2,0,0]=4 4462 B5R0.5 CC(=O)N(C)C Amb2793066 [0,0,0,0,2,0|2,0,0]=4 4463 B5R0.5 CC(=S)C(=O)O Amb27424126 [0,0,0,0,2,0|1,0,0]=3 4464 B5R0.5 CC(Br)C(=O)O Amb2795764 [0,0,0,0,2,0|1,0,1]=4 4465 B5R0.5 CC(C)=C(C)Br Amb22228669 [0,0,0,0,2,0|2,0,0]=4 4466 B5R0.5 CC(C)=C(C)C Amb8513520 [0,0,0,0,2,0|2,0,0]=4 4467 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,2,0|1,0,1]=4 4468 B5R0.5 CC(C)C(=O)Cl Amb3939052 [0,0,0,0,2,0|1,0,1]=4 4469 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,2,0|1,0,1]=4 4470 B5R0.5 CC(C)C(=O)I Amb26992316 [0,0,0,0,2,0|1,0,1]=4 4471 B5R0.5 CC(C)C(=O)O Amb3939822 [0,0,0,0,2,0|0,0,1]=3 4472 B5R0.5 CC(C)C(=O)S Amb33482574 [0,0,0,0,2,0|0,1,1]=4 4473 B5R0.5 CC(C)C(N)=O Amb1153145 [0,0,0,0,2,0|1,0,1]=4 4474 B5R0.5 CC(C)N(=O)O Amb33789630 [0,0,0,0,2,0|1,0,1]=4 4475 B5R0.5 CC(C)S(=O)O Amb27245066 [0,0,0,0,2,0|1,0,1]=4 4476 B5R0.5 CC(Cl)C(=O)O Amb3940363 [0,0,0,0,2,0|1,0,1]=4 4477 B5R0.5 CC(F)C(=O)O Amb10605770 [0,0,0,0,2,0|1,0,1]=4 4478 B5R0.5 CC(I)C(=O)O Amb26450528 [0,0,0,0,2,0|1,0,1]=4 4479 B5R0.5 CC(N)C(=O)O Amb32724352 [0,0,0,0,2,0|1,0,1]=4 4480 B5R0.5 CC(N)C(=O)O Amb5716847 [0,0,0,0,2,0|1,0,1]=4 4481 B5R0.5 CC(O)C(=O)O Amb9703100 [0,0,0,0,2,0|1,0,1]=4 4482 B5R0.5 CC(S)C(=O)O Amb6608753 [0,0,0,0,2,0|1,0,1]=4 4483 B5R0.5 CN(C)C(=O)Cl Amb2793056 [0,0,0,0,2,0|2,0,0]=4 4484 B5R0.5 CN(C)C(=O)O Amb22348477 [0,0,0,0,2,0|1,0,0]=3 4485 B5R0.5 CN(C)C(N)=O Amb2604398 [0,0,0,0,2,0|2,0,0]=4 4486 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [0,0,0,0,2,0|1,0,1]=4 4487 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [0,0,0,0,2,0|1,0,1]=4 4488 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [0,0,0,0,2,0|1,0,1]=4 4489 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [0,0,0,0,2,0|1,0,1]=4 4490 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [0,0,0,0,2,0|1,0,1]=4 4491 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [0,0,0,0,2,0|1,0,1]=4 4492 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [0,0,0,0,2,0|1,0,1]=4 4493 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [0,0,0,0,2,0|1,0,1]=4 4494 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [0,0,0,0,2,0|1,0,1]=4 4495 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [0,0,0,0,2,0|1,0,1]=4 4496 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [0,0,0,0,2,0|1,0,1]=4 4497 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [0,0,0,0,2,0|1,0,1]=4 4498 B5R0.5 N=C(S)C(=O)O Amb18640468 [0,0,0,0,2,0|2,0,0]=4 4499 B5R0.5 NC(=O)C(=O)O Amb32666615 [0,0,0,0,2,0|2,0,0]=4 4500 B5R0.5 NC(=O)C(=O)O Amb3940455 [0,0,0,0,2,0|2,0,0]=4 4501 B5R0.5 O=C(O)C(=O)Br Amb27863598 [0,0,0,0,2,0|2,0,0]=4 4502 B5R0.5 O=C(O)C(=O)O Amb10608980 [0,0,0,0,2,0|2,0,0]=4 4503 B5R0.5 O=C(O)C(=O)O Amb19374136 [0,0,0,0,2,0|2,0,0]=4 4504 B5R0.5 O=C(O)C(=O)O Amb22231343 [0,0,0,0,2,0|2,0,0]=4 4505 B5R0.5 O=C(O)C(=O)O Amb22394874 [0,0,0,0,2,0|2,0,0]=4 4506 B5R0.5 O=C(O)C(=O)O Amb22436461 [0,0,0,0,2,0|2,0,0]=4 4507 B5R0.5 O=C(O)C(=O)O Amb7755827 [0,0,0,0,2,0|2,0,0]=4 4508 B5R0.5 O=C(O)C(=O)O Amb8513282 [0,0,0,0,2,0|2,0,0]=4 4509 B9R0.55 C=C(Br)CNCC=C(C)C Amb27251654 [0,0,0,0,0,2|2,0,0]=4 4510 B9R0.55 C=C(C)C#C\C=C/C(=O)O Amb27630707 [0,0,0,0,0,2|0,0,2]=4 4511 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [0,0,0,0,0,2|0,0,2]=4 4512 B9R0.55 C=C(C)COCCC(=O)O Amb27882463 [0,0,0,0,0,2|0,0,2]=4 4513 B9R0.55 C=C(C)CONCC(=O)O Amb27969663 [0,0,0,0,0,2|0,0,2]=4 4514 B9R0.55 C=C(C)CO\C=C\C(=O)O Amb18643826 [0,0,0,0,0,2|0,0,2]=4 4515 B9R0.55 C=C(C)\C=C\CCC(C)=O Amb26484309 [0,0,0,0,0,2|1,0,1]=4 4516 B9R0.55 CC(=O)CCCC=C(C)C Amb28053965 [0,0,0,0,0,2|1,0,0]=3 4517 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [0,0,0,0,0,2|1,0,1]=4 4518 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,0,0,0,0,2|1,0,1]=4 4519 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,0,0,0,0,2|1,0,1]=4 4520 B9R0.55 CC(=O)CCSCC(=O)O Amb24443138 [0,0,0,0,0,2|1,0,1]=4 4521 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,0,0,0,0,2|1,0,1]=4 4522 B9R0.55 CC(=O)COCC=C(C)C Amb27951594 [0,0,0,0,0,2|1,0,0]=3 4523 B9R0.55 CC(=O)CSCC=C(C)C Amb28340640 [0,0,0,0,0,2|1,0,0]=3 4524 B9R0.55 CC(=O)C\C=C\C=C(C)C Amb24646499 [0,0,0,0,0,2|1,0,0]=3 4525 B9R0.55 CC(=O)NCCCC(=O)O Amb2778749 [0,0,0,0,0,2|1,0,1]=4 4526 B9R0.55 CC(=O)NC\C=C\C(=O)O Amb27259093 [0,0,0,0,0,2|1,0,1]=4 4527 B9R0.55 CC(=O)NOCCC(=O)O Amb27252126 [0,0,0,0,0,2|1,0,1]=4 4528 B9R0.55 CC(=O)N\C=C/CC(N)=O Amb27214099 [0,0,0,0,0,2|2,0,0]=4 4529 B9R0.55 CC(=O)OCC#CC(=O)O Amb28411497 [0,0,0,0,0,2|2,0,0]=4 4530 B9R0.55 CC(=O)OCCCC(=O)O Amb24480808 [0,0,0,0,0,2|1,0,1]=4 4531 B9R0.55 CC(=O)OC\C=C\C(=O)O Amb24454652 [0,0,0,0,0,2|1,0,1]=4 4532 B9R0.55 CC(=O)SCCCC(=O)O Amb26356321 [0,0,0,0,0,2|1,0,1]=4 4533 B9R0.55 CC(=O)\C=C\C=C\C(=O)O Amb27205327 [0,0,0,0,0,2|1,0,1]=4 4534 B9R0.55 CC(C)=CCCCC(N)=O Amb27390535 [0,0,0,0,0,2|1,0,0]=3 4535 B9R0.55 CC(C)=CCCNC(=N)N Amb28196994 [0,0,0,0,0,2|2,0,0]=4 4536 B9R0.55 CC(C)=CCCNC(N)=O Amb27596311 [0,0,0,0,0,2|1,0,0]=3 4537 B9R0.55 CC(C)=CCOCC(=O)O Amb18644115 [0,0,0,0,0,2|0,0,0]=2 4538 B9R0.55 CC(C)=CCOCC(C)O Amb27839572 [0,0,0,0,0,2|1,0,1]=4 4539 B9R0.55 CC(C)=CCSCC(N)=O Amb27832078 [0,0,0,0,0,2|1,0,0]=3 4540 B9R0.55 CC(C)=CC\C=C\[C@H](C)O Amb27197150 [0,0,0,0,0,2|1,0,1]=4 4541 B9R0.55 CC(C)=COCCC(C)O Amb28281210 [0,0,0,0,0,2|1,0,1]=4 4542 B9R0.55 CC(C)=C\C=C\CC(=O)O Amb27473342 [0,0,0,0,0,2|0,0,0]=2 4543 B9R0.55 CC(C)=NOCCC(=O)O Amb27596064 [0,0,0,0,0,2|0,0,1]=3 4544 B9R0.55 CC(C)=NOCNC(N)=O Amb27262325 [0,0,0,0,0,2|2,0,0]=4 4545 B9R0.55 CC(C)C#C\C=C/C(=O)O Amb27392234 [0,0,0,0,0,2|0,0,2]=4 4546 B9R0.55 CC(C)C=C=CCC(=O)O Amb27952365 [0,0,0,0,0,2|0,0,1]=3 4547 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,0,0,0,0,2|0,0,2]=4 4548 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [0,0,0,0,0,2|0,0,2]=4 4549 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,0,0,0,0,2|0,0,2]=4 4550 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,0,0,0,0,2|0,0,2]=4 4551 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,0,0,0,0,2|0,0,2]=4 4552 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,0,0,0,0,2|0,0,2]=4 4553 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [0,0,0,0,0,2|0,0,2]=4 4554 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,0,0,0,0,2|0,0,2]=4 4555 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,0,0,0,0,2|0,0,2]=4 4556 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,0,0,0,0,2|0,0,2]=4 4557 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,0,0,0,0,2|0,0,2]=4 4558 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,0,0,0,0,2|0,0,2]=4 4559 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,0,0,0,0,2|0,0,2]=4 4560 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,0,0,0,0,2|0,0,2]=4 4561 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [0,0,0,0,0,2|0,0,2]=4 4562 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,0,0,0,0,2|0,0,2]=4 4563 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,0,0,0,0,2|0,0,2]=4 4564 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,0,0,0,0,2|0,0,2]=4 4565 B9R0.55 CC(C)OC\C=C\C(=O)O Amb33475206 [0,0,0,0,0,2|0,0,2]=4 4566 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,0,0,0,0,2|0,0,2]=4 4567 B9R0.55 CC(C)SC\C=C\C(=O)O Amb19020662 [0,0,0,0,0,2|0,0,2]=4 4568 B9R0.55 CC(C)\C=C\C=C\C(=O)O Amb25367977 [0,0,0,0,0,2|0,0,2]=4 4569 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,0,0,0,0,2|0,0,1]=3 4570 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,0,0,0,0,2|1,0,1]=4 4571 B9R0.55 CN(C)CCC#CC(=O)O Amb27948335 [0,0,0,0,0,2|1,0,1]=4 4572 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [0,0,0,0,0,2|1,0,1]=4 4573 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [0,0,0,0,0,2|1,0,1]=4 4574 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,0,0,0,0,2|1,0,1]=4 4575 B9R0.55 CN(C)CCOCC(=O)O Amb20667765 [0,0,0,0,0,2|1,0,1]=4 4576 B9R0.55 CN(C)CCOCC(=O)O Amb22059502 [0,0,0,0,0,2|1,0,1]=4 4577 B9R0.55 CN(C)CCSCC(=O)O Amb1138164 [0,0,0,0,0,2|1,0,1]=4 4578 B9R0.55 CN(C)CCSCC(=O)O Amb33329916 [0,0,0,0,0,2|1,0,1]=4 4579 B9R0.55 CN(C)CC\C=C/C(=O)O Amb27815066 [0,0,0,0,0,2|1,0,1]=4 4580 B9R0.55 CN(C)CC\C=C\C(=O)O Amb32954654 [0,0,0,0,0,2|1,0,1]=4 4581 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [0,0,0,0,0,2|1,0,0]=3 4582 B9R0.55 C\C(Cl)=C/CSCC(=O)O Amb27865640 [0,0,0,0,0,2|1,0,0]=3 4583 B9R0.55 NC(=O)N\N=C\CC(=O)O Amb28366218 [0,0,0,0,0,2|2,0,0]=4 4584 B9R0.55 O=C(O)CCCC=C(F)F Amb27831187 [0,0,0,0,0,2|2,0,0]=4 4585 B9R0.55 O=C(O)C\C=C\CC(=O)O Amb4037278 [0,0,0,0,0,2|2,0,0]=4 4586 B9R0.55 O=C(O)\C=C\CCC(=O)O Amb20622952 [0,0,0,0,0,2|2,0,0]=4 4587 B9R0.55 O=C(O)\C=C\SCC(=O)O Amb18645625 [0,0,0,0,0,2|2,0,0]=4