0 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.6 C=C(Br)CNC(N)=O Amb27956072 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.6 C=C(Br)\C=C\C(=O)O Amb26530913 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.6 C=C(C)C#CC(C)=O Amb28316172 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.6 C=C(C)CCB(O)O Amb28316164 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,0,0,0,0,0|3,0,0]=3 9 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [0,0,0,0,0,0|3,0,0]=3 13 B7R0.6 C=C(C)CNC(N)=S Amb19372825 [0,0,0,0,0,0|3,1,0]=4 14 B7R0.6 C=C(C)CNC(O)=S Amb28240718 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.6 C=C(C)CNS(C)=O Amb27245040 [0,0,0,0,0,0|3,0,0]=3 16 B7R0.6 C=C(C)COC(C)=O Amb16187121 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.6 C=C(C)COC(N)=O Amb4017509 [0,0,0,0,0,0|4,0,0]=4 18 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,0,0,0,0,0|1,0,0]=1 19 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.6 C=C(C)\C=C/C(C)=O Amb28061353 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,0|2,0,1]=3 22 B7R0.6 C=C(C)\C=C\C(C)=O Amb33172526 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,0,0,0,0,0|2,0,1]=3 24 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,0,0,0,0,0|3,0,0]=3 25 B7R0.6 C=C(Cl)CNC(N)=S Amb27985900 [0,0,0,0,0,0|3,1,0]=4 26 B7R0.6 C=C(Cl)COC(C)=O Amb24744447 [0,0,0,0,0,0|3,0,0]=3 27 B7R0.6 C=C(Cl)CSC(C)=O Amb21960981 [0,0,0,0,0,0|3,0,0]=3 28 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,0,0,0,0,0|2,0,1]=3 29 B7R0.6 C=C(O)\C=C\C(=O)O Amb26391061 [0,0,0,0,0,0|1,0,3]=4 30 B7R0.6 CC(=N)NCC(C)C Amb27865850 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [0,0,0,0,0,0|2,0,2]=4 33 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,0,0,0,0,0|3,0,0]=3 34 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,0,0,0,0,0|2,0,1]=3 35 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,0,0,0,0,0|1,0,0]=1 36 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,0,0,0,0,0|2,1,0]=3 37 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,0,0,0,0,0|2,0,0]=2 38 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,0,0,0,0,0|2,1,0]=3 39 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,0,0,0,0,0|3,0,1]=4 40 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,0,0,0,0,0|3,0,1]=4 41 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,0,0,0,0,0|2,0,1]=3 42 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,0,0,0,0,0|1,1,0]=2 45 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,0,0,0,0,0|4,0,0]=4 46 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,0,0,0,0,0|4,0,0]=4 47 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,0,0,0,0,0|2,0,1]=3 48 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,0,0,0,0,0|2,0,1]=3 49 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [0,0,0,0,0,0|1,0,0]=1 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|2,0,0]=2 53 B7R0.6 CC(=O)COC(C)=O Amb8517567 [0,0,0,0,0,0|2,0,0]=2 54 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,0,0,0,0,0|3,0,1]=4 56 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,0,0,0,0,0|3,0,0]=3 57 B7R0.6 CC(=O)NC=C(Cl)Cl Amb2793550 [0,0,0,0,0,0|2,0,1]=3 58 B7R0.6 CC(=O)NCB(O)O Amb8392097 [0,0,0,0,0,0|1,0,1]=2 59 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|0,0,0]=0 60 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,0,0,0,0,0|2,0,1]=3 61 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,0,0,0,0,0|2,0,1]=3 62 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,0,0,0,0,0|1,0,1]=2 63 B7R0.6 CC(=O)NCC(Cl)Cl Amb27978268 [0,0,0,0,0,0|2,0,1]=3 64 B7R0.6 CC(=O)NCC(F)F Amb27961410 [0,0,0,0,0,0|2,0,1]=3 65 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,0,0,0,0,0|1,0,0]=1 66 B7R0.6 CC(=O)NCC(N)=S Amb17231879 [0,0,0,0,0,0|1,1,0]=2 67 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.6 CC(=O)NN=C(C)C Amb1047247 [0,0,0,0,0,0|3,0,0]=3 69 B7R0.6 CC(=O)NNC(=N)N Amb26503440 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.6 CC(=O)NNC(C)=O Amb8516143 [0,0,0,0,0,0|2,0,0]=2 71 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,0,0,0,0,0|3,0,1]=4 72 B7R0.6 CC(=O)NNC(N)=S Amb2543737 [0,0,0,0,0,0|2,1,0]=3 73 B7R0.6 CC(=O)N\N=C(/C)N Amb26548898 [0,0,0,0,0,0|3,0,0]=3 74 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [0,0,0,0,0,0|2,0,0]=2 75 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|1,0,0]=1 76 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,0,0,0,0,0|2,0,1]=3 78 B7R0.6 CC(=O)OCC(F)F Amb10839327 [0,0,0,0,0,0|3,0,1]=4 79 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,0|2,0,0]=2 80 B7R0.6 CC(=O)OCC(N)=S Amb9677330 [0,0,0,0,0,0|2,1,0]=3 81 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,0,0,0,0,0|3,0,1]=4 82 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,0,0,0,0,0|2,0,1]=3 83 B7R0.6 CC(=O)ON=C(C)C Amb2781649 [0,0,0,0,0,0|3,0,1]=4 84 B7R0.6 CC(=O)ONC(N)=O Amb28456585 [0,0,0,0,0,0|3,0,0]=3 85 B7R0.6 CC(=O)O\N=C(/C)N Amb28145058 [0,0,0,0,0,0|3,0,1]=4 86 B7R0.6 CC(=O)SCB(O)O Amb27456620 [0,0,0,0,0,0|2,0,1]=3 87 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,0|2,0,0]=2 88 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,0,0,0,0,0|2,0,1]=3 89 B7R0.6 CC(=O)SCC(Cl)Cl Amb4012737 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,0|2,0,0]=2 91 B7R0.6 CC(=O)SSC(C)=O Amb24099405 [0,0,0,0,0,0|3,0,0]=3 92 B7R0.6 CC(=O)\C=C/C(O)O Amb27834325 [0,0,0,0,0,0|1,0,3]=4 93 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,0,0,0,0,0|1,0,1]=2 94 B7R0.6 CC(=O)\C=C\C(C)=O Amb22346013 [0,0,0,0,0,0|2,0,1]=3 95 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,0,0,0,0,0|2,0,1]=3 96 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [0,0,0,0,0,0|0,0,2]=2 97 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,0,0,0,0,0|1,0,3]=4 98 B7R0.6 CC(=S)NC=C(C)C Amb28397267 [0,0,0,0,0,0|2,1,1]=4 99 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,0,0,0,0,0|0,1,0]=1 100 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,0,0,0,0,0|1,1,0]=2 101 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [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|2,0,0]=2 103 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,0,0,0,0,0|2,0,1]=3 104 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,0,0,0,0,0|3,0,1]=4 105 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,0,0,0,0,0|2,0,1]=3 106 B7R0.6 CC(C)=NNC(N)=O Amb6366342 [0,0,0,0,0,0|3,0,1]=4 107 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,0,0,0,0,0|2,0,2]=4 108 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,0,0,0,0,0|2,0,1]=3 110 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,0,0,0,0,0|3,0,1]=4 111 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,0,0,0,0,0|3,0,1]=4 112 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,0,0,0,0,0|3,0,1]=4 113 B7R0.6 CC(C)NCC(=N)N Amb27186805 [0,0,0,0,0,0|3,0,1]=4 114 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,0,0,0,0,0|2,0,1]=3 115 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,0,0,0,0,0|1,0,1]=2 116 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,0,0,0,0,0|1,0,1]=2 117 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,0,0,0,0,0|2,0,1]=3 118 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,0,0,0,0,0|2,0,1]=3 119 B7R0.6 CC(C)NCC(N)=S Amb17231884 [0,0,0,0,0,0|2,1,1]=4 120 B7R0.6 CC(C)NC[C@@H](C)O Amb27641886 [0,0,0,0,0,0|2,0,2]=4 121 B7R0.6 CC(C)NNC(N)=O Amb27409411 [0,0,0,0,0,0|3,0,1]=4 122 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,0,0,0,0,0|3,0,1]=4 123 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,0,0,0,0,0|2,0,1]=3 124 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,0,0,0,0,0|3,0,1]=4 125 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,0,0,0,0,0|2,0,1]=3 126 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,0,0,0,0,0|2,0,2]=4 127 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,0,0,0,0,0|2,0,2]=4 128 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,0|3,0,1]=4 129 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,0,0,0,0,0|2,0,1]=3 130 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,0,0,0,0,0|2,0,2]=4 131 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,0,0,0,0,0|2,0,1]=3 132 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,0,0,0,0,0|2,0,1]=3 133 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,0,0,0,0,0|3,0,1]=4 134 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,0,0,0,0,0|3,0,1]=4 135 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,0|3,0,1]=4 136 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,0,0,0,0,0|2,0,1]=3 137 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,0,0,0,0,0|2,0,2]=4 138 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,0,0,0,0,0|1,0,3]=4 139 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,0,0,0,0,0|1,0,2]=3 140 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,0,0,0,0,0|1,0,3]=4 141 B7R0.6 CC(O)CNC(=N)N Amb27759521 [0,0,0,0,0,0|3,0,1]=4 142 B7R0.6 CC(O)CNC(C)C Amb9247472 [0,0,0,0,0,0|2,0,2]=4 143 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,0,0,0,0,0|3,0,1]=4 144 B7R0.6 CC(O)COS(C)=O Amb27982299 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,0,0,0,0,0|1,1,1]=3 146 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,0,0,0,0,0|2,1,1]=4 147 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,0,0,0,0,0|4,0,0]=4 148 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,0,0,0,0,0|4,0,0]=4 149 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,0,0,0,0,0|3,0,0]=3 150 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,0,0,0,0,0|3,0,0]=3 151 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,0,0,0,0,0|4,0,0]=4 152 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,0,0,0,0,0|3,0,0]=3 153 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,0,0,0,0,0|4,0,0]=4 154 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,0,0,0,0,0|3,0,1]=4 155 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,0,0,0,0,0|3,0,0]=3 156 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,0,0,0,0,0|3,0,1]=4 157 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,0,0,0,0,0|2,0,2]=4 158 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,0,0,0,0,0|2,0,0]=2 159 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [0,0,0,0,0,0|4,0,0]=4 160 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,0,0,0,0,0|1,0,0]=1 161 B7R0.6 CS(=O)\C=C/C(N)=O Amb27815054 [0,0,0,0,0,0|3,0,1]=4 162 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,0,0,0,0,0|2,0,1]=3 163 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,0,0,0,0,0|2,0,1]=3 164 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,0,0,0,0,0|2,0,1]=3 166 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,0,0,0,0,0|2,0,2]=4 167 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,0,0,0,0,0|2,0,1]=3 168 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,0,0,0,0,0|2,0,1]=3 169 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,0,0,0,0,0|1,0,2]=3 170 B7R0.6 C[C@H](O)CNC(=N)N Amb28135994 [0,0,0,0,0,0|3,0,1]=4 171 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,0,0,0,0,0|1,1,1]=3 172 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,0,0,0,0,0|3,0,0]=3 173 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,0,0,0,0,0|3,0,1]=4 174 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,0,0,0,0,0|3,0,0]=3 175 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,0,0,0,0,0|2,0,0]=2 176 B7R0.6 C\C(Cl)=N\OC(N)=O Amb27409950 [0,0,0,0,0,0|3,0,1]=4 177 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [0,0,0,0,0,0|2,0,2]=4 178 B7R0.6 C\C(O)=N\NC(N)=O Amb17777869 [0,0,0,0,0,0|3,0,0]=3 179 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,0,0,0,0,0|4,0,0]=4 180 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [0,0,0,0,0,0|2,0,0]=2 181 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [0,0,0,0,0,0|2,0,0]=2 182 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [0,0,0,0,0,0|3,0,0]=3 183 B7R0.6 N=C(N)SCC(N)=O Amb22261500 [0,0,0,0,0,0|4,0,0]=4 184 B7R0.6 NC(=O)C#CC(N)=O Amb6366606 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,0,0,0,0,0|3,0,0]=3 186 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,0,0,0,0,0|2,0,0]=2 187 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,0,0,0,0,0|3,0,0]=3 188 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,0,0,0,0,0|2,0,2]=4 189 B7R0.6 NC(=O)CNC(N)=S Amb9212104 [0,0,0,0,0,0|2,1,0]=3 190 B7R0.6 NC(=O)CO[PH](=O)O Amb27392553 [0,0,0,0,0,0|4,0,0]=4 191 B7R0.6 NC(=O)CSC(N)=S Amb27642551 [0,0,0,0,0,0|3,1,0]=4 192 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [0,0,0,0,0,0|1,0,0]=1 193 B7R0.6 NC(=O)NCC(Cl)Cl Amb27763808 [0,0,0,0,0,0|3,0,1]=4 194 B7R0.6 NC(=O)NCC(F)F Amb27827918 [0,0,0,0,0,0|3,0,1]=4 195 B7R0.6 NC(=O)NNC(N)=O Amb6366265 [0,0,0,0,0,0|3,0,0]=3 196 B7R0.6 NC(=O)NNC(N)=S Amb10558894 [0,0,0,0,0,0|3,1,0]=4 197 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.6 NC(=O)\C=C/C(N)=O Amb4292114 [0,0,0,0,0,0|3,0,1]=4 199 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [0,0,0,0,0,0|2,0,1]=3 200 B7R0.6 NC(=O)\C=C\C(N)=O Amb6334811 [0,0,0,0,0,0|3,0,1]=4 201 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [0,0,0,0,0,0|1,0,2]=3 202 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,0,0,0,0,0|2,1,0]=3 203 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [0,0,0,0,0,0|1,1,0]=2 204 B7R0.6 NC(=[NH2+])NCC(=O)[O-] Amb4244207 [0,0,0,0,0,0|2,0,1]=3 205 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,0,0,0,0,0|3,0,0]=3 206 B7R0.6 O=C(Cl)NCC(F)F Amb35625623 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.6 O=C(Cl)SSC(=O)Cl Amb33465476 [0,0,0,0,0,0|4,0,0]=4 208 B7R0.6 O=C(Cl)\C=C\C(=O)Cl Amb8513635 [0,0,0,0,0,0|3,0,1]=4 209 B7R0.6 O=C(O)C#CC(=O)O Amb6297768 [0,0,0,0,0,0|2,0,1]=3 210 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,0|3,0,0]=3 211 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,0,0,0,0,0|3,0,1]=4 212 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,0,0,0,0,0|2,0,0]=2 213 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,0,0,0,0,0|2,0,0]=2 214 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,0|3,0,1]=4 215 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,0,0,0,0,0|3,0,1]=4 216 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,0,0,0,0,0|4,0,0]=4 217 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,0,0,0,0,0|3,0,1]=4 218 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,0,0,0,0,0|3,0,0]=3 219 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,0,0,0,0,0|3,0,0]=3 220 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,0,0,0,0,0|3,0,0]=3 221 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [0,0,0,0,0,0|1,0,0]=1 222 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [0,0,0,0,0,0|2,0,0]=2 223 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [0,0,0,0,0,0|2,0,0]=2 224 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,0,0,0,0,0|3,0,1]=4 225 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,0,0,0,0,0|3,0,1]=4 226 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [0,0,0,0,0,0|2,0,1]=3 227 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [0,0,0,0,0,0|2,0,1]=3 228 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [0,0,0,0,0,0|2,0,1]=3 229 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [0,0,0,0,0,0|2,0,1]=3 230 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [0,0,0,0,0,0|2,0,1]=3 231 B7R0.6 O=C(O)\C=C\[N+](=O)[O-] Amb25736416 [0,0,0,0,0,0|3,0,1]=4 232 B7R0.6 O=C([O-])C#CC(=O)O Amb19748298 [0,0,0,0,0,0|2,0,1]=3 233 B7R0.6 O=C([O-])C#CC(=O)O Amb2721628 [0,0,0,0,0,0|2,0,1]=3 234 B7R0.6 O=C([O-])C#CC(=O)O Amb33620293 [0,0,0,0,0,0|2,0,1]=3 235 B7R0.6 O=C([O-])C#CC(=O)[O-] Amb29844449 [0,0,0,0,0,0|2,0,2]=4 236 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,0,0,0,0,0|2,0,1]=3 237 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,0,0,0,0,0|2,0,1]=3 238 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [0,0,0,0,0,0|2,0,1]=3 239 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [0,0,0,0,0,0|2,0,1]=3 240 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb20246799 [0,0,0,0,0,0|2,0,2]=4 241 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22002520 [0,0,0,0,0,0|2,0,2]=4 242 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22043369 [0,0,0,0,0,0|2,0,2]=4 243 B7R0.6 S=C(S)CNC(=S)S Amb27430277 [0,0,0,0,0,0|1,3,0]=4 244 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [0,0,0,0,0,0|1,0,0]=1 245 B6R0.4 C#CCCC(=O)O Amb33532622 [1,0,0,0,0,0|1,0,2]=4 246 B6R0.4 C#CCCC(C)=O Amb8869638 [1,0,0,0,0,0|2,0,1]=4 247 B6R0.4 C#CCNC(=O)Br Amb27792816 [1,0,0,0,0,0|2,0,1]=4 248 B6R0.4 C#CCNC(=O)I Amb27838254 [1,0,0,0,0,0|2,0,1]=4 249 B6R0.4 C#CCNC(C)=O Amb20623038 [1,0,0,0,0,0|1,0,1]=3 250 B6R0.4 C#CCNC(N)=O Amb2724225 [1,0,0,0,0,0|2,0,1]=4 251 B6R0.4 C#CCOC(C)=O Amb8517415 [1,0,0,0,0,0|2,0,1]=4 252 B6R0.4 C#CCSC(C)=O Amb32683409 [1,0,0,0,0,0|2,0,1]=4 253 B6R0.4 C=C(C)C#CC=O Amb28050124 [1,0,0,0,0,0|2,0,1]=4 254 B6R0.4 C=C(C)CCCO Amb22886814 [1,0,0,0,0,0|2,0,1]=4 255 B6R0.4 C=C(C)CNCC Amb3940049 [1,0,0,0,0,0|2,0,1]=4 256 B6R0.4 C=C(C)NCC#N Amb27193966 [1,0,0,0,0,0|2,0,1]=4 257 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [1,0,0,0,0,0|2,0,1]=4 258 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,0,0,0,0,0|1,0,2]=4 259 B6R0.4 C=CCCC(=C)C Amb22228883 [1,0,0,0,0,0|3,0,0]=4 260 B6R0.4 C=CCCC(=O)Cl Amb3939003 [1,0,0,0,0,0|2,0,1]=4 261 B6R0.4 C=CCCC(=O)O Amb3940112 [1,0,0,0,0,0|1,0,1]=3 262 B6R0.4 C=CCCC(C)=O Amb2721704 [1,0,0,0,0,0|2,0,0]=3 263 B6R0.4 C=CCCC(N)=O Amb28136349 [1,0,0,0,0,0|2,0,1]=4 264 B6R0.4 C=CCNC(=N)N Amb25043202 [1,0,0,0,0,0|3,0,0]=4 265 B6R0.4 C=CCNC(C)=N Amb24618156 [1,0,0,0,0,0|2,0,0]=3 266 B6R0.4 C=CCNC(C)=O Amb5797445 [1,0,0,0,0,0|1,0,0]=2 267 B6R0.4 C=CCNC(C)C Amb10609485 [1,0,0,0,0,0|2,0,1]=4 268 B6R0.4 C=CCNC(C)C Amb6683889 [1,0,0,0,0,0|2,0,1]=4 269 B6R0.4 C=CCNC(C)C Amb8428139 [1,0,0,0,0,0|2,0,1]=4 270 B6R0.4 C=CCNC(N)=O Amb6599864 [1,0,0,0,0,0|2,0,0]=3 271 B6R0.4 C=CCNC(N)=S Amb6599883 [1,0,0,0,0,0|2,1,0]=4 272 B6R0.4 C=CCOC(=O)Cl Amb6600570 [1,0,0,0,0,0|3,0,0]=4 273 B6R0.4 C=CCOC(N)=O Amb4017585 [1,0,0,0,0,0|3,0,0]=4 274 B6R0.4 C=CNCC(=O)O Amb28346027 [1,0,0,0,0,0|0,0,1]=2 275 B6R0.4 C=COCC(=O)O Amb27247261 [1,0,0,0,0,0|1,0,1]=3 276 B6R0.4 C=COCC(C)=O Amb27838258 [1,0,0,0,0,0|2,0,1]=4 277 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [1,0,0,0,0,0|2,0,1]=4 278 B6R0.4 CC#CCC(=O)O Amb17939740 [1,0,0,0,0,0|1,0,1]=3 279 B6R0.4 CC#CCC(C)=O Amb27648528 [1,0,0,0,0,0|2,0,1]=4 280 B6R0.4 CC(=N)NCCF Amb28123831 [1,0,0,0,0,0|2,0,1]=4 281 B6R0.4 CC(=O)CC#CO Amb27463647 [1,0,0,0,0,0|1,0,2]=4 282 B6R0.4 CC(=O)CCC#N Amb17334046 [1,0,0,0,0,0|2,0,1]=4 283 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,0]=2 284 B6R0.4 CC(=O)CCCBr Amb8394105 [1,0,0,0,0,0|2,0,1]=4 285 B6R0.4 CC(=O)CCCCl Amb3940272 [1,0,0,0,0,0|2,0,1]=4 286 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|2,0,1]=4 287 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|2,0,1]=4 288 B6R0.4 CC(=O)CCCN Amb32661221 [1,0,0,0,0,0|2,0,1]=4 289 B6R0.4 CC(=O)CCCN Amb32661286 [1,0,0,0,0,0|2,0,1]=4 290 B6R0.4 CC(=O)CCCO Amb3940340 [1,0,0,0,0,0|1,0,1]=3 291 B6R0.4 CC(=O)C\C=N\O Amb27750272 [1,0,0,0,0,0|2,0,1]=4 292 B6R0.4 CC(=O)NCC#N Amb3886527 [1,0,0,0,0,0|1,0,1]=3 293 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|0,0,0]=1 294 B6R0.4 CC(=O)NCCBr Amb4311522 [1,0,0,0,0,0|1,0,1]=3 295 B6R0.4 CC(=O)NCCCl Amb423758 [1,0,0,0,0,0|1,0,1]=3 296 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|1,0,1]=3 297 B6R0.4 CC(=O)NCCO Amb2720909 [1,0,0,0,0,0|0,0,1]=2 298 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|0,1,1]=3 299 B6R0.4 CC(=O)N\C=C/S Amb27246451 [1,0,0,0,0,0|0,1,1]=3 300 B6R0.4 CC(=O)N\C=C\Cl Amb28132682 [1,0,0,0,0,0|1,0,1]=3 301 B6R0.4 CC(=O)N\C=N\O Amb27255534 [1,0,0,0,0,0|1,0,1]=3 302 B6R0.4 CC(=O)OCC#N Amb9677308 [1,0,0,0,0,0|2,0,1]=4 303 B6R0.4 CC(=O)OCCBr Amb3940209 [1,0,0,0,0,0|2,0,1]=4 304 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.4 CC(=O)OCCN Amb28827650 [1,0,0,0,0,0|2,0,1]=4 306 B6R0.4 CC(=O)OCCO Amb3941004 [1,0,0,0,0,0|1,0,1]=3 307 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [1,0,0,0,0,0|2,0,1]=4 308 B6R0.4 CC(=O)SCC=O Amb27873378 [1,0,0,0,0,0|1,0,0]=2 309 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|2,0,1]=4 310 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|2,0,1]=4 311 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|2,0,1]=4 312 B6R0.4 CC(=O)SCCN Amb31291049 [1,0,0,0,0,0|2,0,1]=4 313 B6R0.4 CC(=O)SCCO Amb27481182 [1,0,0,0,0,0|1,0,1]=3 314 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [1,0,0,0,0,0|1,0,1]=3 315 B6R0.4 CC(=S)SCCO Amb28350218 [1,0,0,0,0,0|1,1,1]=4 316 B6R0.4 CC(C)=CCC=O Amb18120881 [1,0,0,0,0,0|2,0,0]=3 317 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|2,0,1]=4 318 B6R0.4 CC(C)=CNC=O Amb27973472 [1,0,0,0,0,0|2,0,1]=4 319 B6R0.4 CC(C)=NCCO Amb27612560 [1,0,0,0,0,0|1,0,2]=4 320 B6R0.4 CC(C)=NNC=O Amb2419224 [1,0,0,0,0,0|2,0,1]=4 321 B6R0.4 CC(C)CCC=O Amb17673735 [1,0,0,0,0,0|2,0,1]=4 322 B6R0.4 CC(C)NCCO Amb3939914 [1,0,0,0,0,0|1,0,2]=4 323 B6R0.4 CC(C)OCC=O Amb25820659 [1,0,0,0,0,0|2,0,1]=4 324 B6R0.4 CC(C)SCC=O Amb24479811 [1,0,0,0,0,0|2,0,1]=4 325 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,0,0,0,0,0|2,0,1]=4 326 B6R0.4 CC(N)NCCO Amb26442749 [1,0,0,0,0,0|1,0,2]=4 327 B6R0.4 CC(O)CCC=O Amb17593090 [1,0,0,0,0,0|1,0,2]=4 328 B6R0.4 CC(O)COC=O Amb27436963 [1,0,0,0,0,0|2,0,1]=4 329 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|1,0,1]=3 330 B6R0.4 CC=C=C[PH](=O)O Amb27430355 [1,0,0,0,0,0|2,0,1]=4 331 B6R0.4 CCC#CC(=O)O Amb6336503 [1,0,0,0,0,0|1,0,2]=4 332 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,0,0,0,0,0|2,0,1]=4 333 B6R0.4 CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|1,0,1]=3 334 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,0,0,0,0,0|1,0,2]=4 335 B6R0.4 CCCCC(C)=O Amb6608652 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.4 CCCCC(N)=O Amb6891958 [1,0,0,0,0,0|2,0,1]=4 337 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,0,0,0,0,0|2,0,1]=4 338 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,1]=4 339 B6R0.4 CCCNC(C)=O Amb5835710 [1,0,0,0,0,0|1,0,1]=3 340 B6R0.4 CCCNC(N)=O Amb1152241 [1,0,0,0,0,0|2,0,1]=4 341 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|2,0,1]=4 342 B6R0.4 CCNCC(=N)N Amb28050789 [1,0,0,0,0,0|2,0,1]=4 343 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,0,0,0,0,0|1,0,1]=3 344 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|0,0,1]=2 345 B6R0.4 CCNCC(=O)O Amb7764661 [1,0,0,0,0,0|0,0,1]=2 346 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|1,0,1]=3 347 B6R0.4 CCNCC(C)=O Amb32661185 [1,0,0,0,0,0|1,0,1]=3 348 B6R0.4 CCNCC(C)O Amb32666214 [1,0,0,0,0,0|1,0,2]=4 349 B6R0.4 CCNCC(C)O Amb9247475 [1,0,0,0,0,0|1,0,2]=4 350 B6R0.4 CCNCC(N)=O Amb1128676 [1,0,0,0,0,0|1,0,1]=3 351 B6R0.4 CCNCC(N)=O Amb4035424 [1,0,0,0,0,0|1,0,1]=3 352 B6R0.4 CCNC[C@@H](C)O Amb27827890 [1,0,0,0,0,0|1,0,2]=4 353 B6R0.4 CCNC[C@@H](C)O Amb32652513 [1,0,0,0,0,0|1,0,2]=4 354 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|1,0,2]=4 355 B6R0.4 CCNC[C@H](C)O Amb32652535 [1,0,0,0,0,0|1,0,2]=4 356 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,0,0,0,0,0|2,0,1]=4 357 B6R0.4 CCOCC(=O)O Amb3939880 [1,0,0,0,0,0|1,0,1]=3 358 B6R0.4 CCOCC(=O)S Amb27813482 [1,0,0,0,0,0|1,1,1]=4 359 B6R0.4 CCOCC(C)=O Amb9666086 [1,0,0,0,0,0|2,0,1]=4 360 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|2,0,1]=4 361 B6R0.4 CCPCC(=O)O Amb28321137 [1,0,0,0,0,0|0,1,1]=3 362 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,1]=3 363 B6R0.4 CCSCC(C)=O Amb4018179 [1,0,0,0,0,0|2,0,1]=4 364 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,0,0,0,0,0|1,0,2]=4 365 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,0,0,0,0,0|1,0,2]=4 366 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,0,0,0,0,0|0,0,3]=4 367 B6R0.4 CN(C)CCC=O Amb22001057 [1,0,0,0,0,0|3,0,0]=4 368 B6R0.4 CN(C)CNC=O Amb27216675 [1,0,0,0,0,0|3,0,0]=4 369 B6R0.4 CNCCC(=O)Cl Amb27422890 [1,0,0,0,0,0|3,0,0]=4 370 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|2,0,0]=3 371 B6R0.4 CNCCC(=O)O Amb7766400 [1,0,0,0,0,0|2,0,0]=3 372 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|3,0,0]=4 373 B6R0.4 CNCCC(C)=O Amb28827637 [1,0,0,0,0,0|3,0,0]=4 374 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|3,0,0]=4 375 B6R0.4 CNCCC(N)=O Amb33538309 [1,0,0,0,0,0|3,0,0]=4 376 B6R0.4 COCCC(=O)Cl Amb2689274 [1,0,0,0,0,0|3,0,0]=4 377 B6R0.4 COCCC(=O)O Amb3938990 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.4 COCCC(C)=O Amb7764907 [1,0,0,0,0,0|3,0,0]=4 379 B6R0.4 COCCC(N)=O Amb33538943 [1,0,0,0,0,0|3,0,0]=4 380 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 381 B6R0.4 CONCC(C)O Amb27607237 [1,0,0,0,0,0|2,0,1]=4 382 B6R0.4 CONCC(N)=O Amb28455463 [1,0,0,0,0,0|2,0,0]=3 383 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,0,0,0,0,0|2,0,1]=4 384 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|1,0,2]=4 385 B6R0.4 CS(=O)NCCN Amb25888549 [1,0,0,0,0,0|2,0,1]=4 386 B6R0.4 CSC#CC(=O)O Amb33309663 [1,0,0,0,0,0|2,0,1]=4 387 B6R0.4 CSCCC(=O)O Amb3939879 [1,0,0,0,0,0|2,0,0]=3 388 B6R0.4 CSCCC(C)=O Amb8392858 [1,0,0,0,0,0|3,0,0]=4 389 B6R0.4 CSCSC(C)=O Amb27876851 [1,0,0,0,0,0|3,0,0]=4 390 B6R0.4 CSSCC(=O)O Amb25378801 [1,0,0,0,0,0|2,0,0]=3 391 B6R0.4 CS\C=C\C(=O)O Amb30584688 [1,0,0,0,0,0|2,0,1]=4 392 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [1,0,0,0,0,0|2,0,1]=4 393 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [1,0,0,0,0,0|2,0,1]=4 394 B6R0.4 C[C@H](O)CCC=O Amb27188424 [1,0,0,0,0,0|1,0,2]=4 395 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.4 C\C(N)=N\CCO Amb26857579 [1,0,0,0,0,0|1,0,2]=4 397 B6R0.4 C\C(N)=N\OC=O Amb27655517 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.4 C\C=C/CB(O)O Amb27620496 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.4 C\C=C/NC(C)=S Amb28282715 [1,0,0,0,0,0|1,1,1]=4 400 B6R0.4 C\C=C\CC(=N)N Amb25176208 [1,0,0,0,0,0|3,0,0]=4 401 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,0,0,0,0,0|1,0,0]=2 402 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,0,0,0,0,0|2,0,0]=3 403 B6R0.4 C\C=C\CS(=O)[O-] Amb26887775 [1,0,0,0,0,0|2,0,1]=4 404 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [1,0,0,0,0,0|2,0,1]=4 405 B6R0.4 C\C=C\NC(C)=S Amb27881690 [1,0,0,0,0,0|1,1,1]=4 406 B6R0.4 C\C=N\NC(N)=O Amb24351023 [1,0,0,0,0,0|2,0,1]=4 407 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,0,0,0,0,0|3,0,0]=4 408 B6R0.4 N#CCCC(=O)O Amb2694975 [1,0,0,0,0,0|2,0,1]=4 409 B6R0.4 N#CCNC(N)=O Amb20622301 [1,0,0,0,0,0|2,0,1]=4 410 B6R0.4 N=C(N)NCCO Amb16231403 [1,0,0,0,0,0|2,0,1]=4 411 B6R0.4 N=C(N)NCCO Amb6429694 [1,0,0,0,0,0|2,0,1]=4 412 B6R0.4 N=C(N)NNC=O Amb20000948 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.4 N=CNCC(=O)Cl Amb27216499 [1,0,0,0,0,0|2,0,0]=3 414 B6R0.4 N=CNCC(=O)O Amb24670244 [1,0,0,0,0,0|1,0,0]=2 415 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,1]=4 416 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [1,0,0,0,0,0|3,0,0]=4 417 B6R0.4 NC(=O)NCCBr Amb28385599 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.4 NC(=O)NCCF Amb27446994 [1,0,0,0,0,0|2,0,1]=4 419 B6R0.4 NC(=O)NCCI Amb27454955 [1,0,0,0,0,0|2,0,1]=4 420 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|1,0,1]=3 421 B6R0.4 NC(=O)NNC=O Amb27874930 [1,0,0,0,0,0|2,0,0]=3 422 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|2,0,1]=4 423 B6R0.4 NC(=S)CNC=O Amb24479904 [1,0,0,0,0,0|1,1,0]=3 424 B6R0.4 NC(=S)NCCO Amb19515723 [1,0,0,0,0,0|1,1,1]=4 425 B6R0.4 NC(=S)NNC=O Amb1790065 [1,0,0,0,0,0|2,1,0]=4 426 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|2,0,1]=4 427 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|2,0,1]=4 428 B6R0.4 NCCNC(N)=O Amb32665340 [1,0,0,0,0,0|2,0,1]=4 429 B6R0.4 NCCNC(N)=O Amb6254968 [1,0,0,0,0,0|2,0,1]=4 430 B6R0.4 NNCCC(=O)O Amb33756816 [1,0,0,0,0,0|3,0,0]=4 431 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|3,0,0]=4 432 B6R0.4 NOCCC(=O)O Amb32693437 [1,0,0,0,0,0|3,0,0]=4 433 B6R0.4 O=C(Cl)NCCBr Amb28123956 [1,0,0,0,0,0|2,0,1]=4 434 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|2,0,1]=4 435 B6R0.4 O=C(Cl)NCCF Amb35633248 [1,0,0,0,0,0|2,0,1]=4 436 B6R0.4 O=C(O)CCCBr Amb8393276 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.4 O=C(O)CCCCl Amb3940333 [1,0,0,0,0,0|2,0,1]=4 438 B6R0.4 O=C(O)CCCF Amb17593104 [1,0,0,0,0,0|2,0,1]=4 439 B6R0.4 O=C(O)CCCI Amb22295911 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.4 O=C(O)CCCO Amb18640332 [1,0,0,0,0,0|1,0,2]=4 441 B6R0.4 O=C(O)CCCS Amb16185429 [1,0,0,0,0,0|1,1,1]=4 442 B6R0.4 O=C(O)CCNO Amb28067767 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.4 O=C(O)CCSCl Amb28387511 [1,0,0,0,0,0|3,0,0]=4 444 B6R0.4 O=C(O)COCF Amb33378705 [1,0,0,0,0,0|2,0,1]=4 445 B6R0.4 O=C(O)CPCO Amb28340565 [1,0,0,0,0,0|0,1,2]=4 446 B6R0.4 O=C(O)CSSCl Amb27477882 [1,0,0,0,0,0|3,0,0]=4 447 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,0,0,0,0,0|2,0,0]=3 448 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|2,0,0]=3 449 B6R0.4 O=C(S)NCCO Amb27430045 [1,0,0,0,0,0|1,0,1]=3 450 B6R0.4 O=C([O-])CCCO Amb3429667 [1,0,0,0,0,0|2,0,1]=4 451 B6R0.4 O=C([O-])CNCO Amb8383630 [1,0,0,0,0,0|0,0,3]=4 452 B6R0.4 O=CCCC(=O)O Amb17673897 [1,0,0,0,0,0|1,0,0]=2 453 B6R0.4 O=CCCC(O)O Amb27838257 [1,0,0,0,0,0|1,0,2]=4 454 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [1,0,0,0,0,0|2,0,1]=4 455 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|0,0,0]=1 456 B6R0.4 O=COCC(=O)O Amb26624011 [1,0,0,0,0,0|1,0,0]=2 457 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [1,0,0,0,0,0|1,0,1]=3 458 B6R0.4 O=[N+]([O-])NCCO Amb17618377 [1,0,0,0,0,0|2,0,1]=4 459 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,0,0,0,0,0|2,0,1]=4 460 B8R0.9 BO\C(O)=C/CC(=O)O Amb27797365 [0,1,0,0,0,0|2,0,1]=4 461 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,1,0,0,0,0|2,0,1]=4 462 B8R0.9 C#CC(=C)CCC(C)=O Amb27179805 [0,1,0,0,0,0|3,0,0]=4 463 B8R0.9 C#CC(=O)NCC(=C)Br Amb27833869 [0,1,0,0,0,0|2,0,1]=4 464 B8R0.9 C#CC(=O)NCC(=O)O Amb6270091 [0,1,0,0,0,0|0,0,1]=2 465 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,1,0,0,0,0|1,0,1]=3 466 B8R0.9 C#CC(C)NCC(N)=O Amb28352348 [0,1,0,0,0,0|2,0,1]=4 467 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,1,0,0,0,0|2,0,1]=4 468 B8R0.9 C=C(Br)CNC(=O)CBr Amb23570568 [0,1,0,0,0,0|2,0,0]=3 469 B8R0.9 C=C(Br)CNC(=O)CC Amb27424062 [0,1,0,0,0,0|2,0,0]=3 470 B8R0.9 C=C(Br)CNC(=O)CN Amb23570566 [0,1,0,0,0,0|2,0,0]=3 471 B8R0.9 C=C(Br)CNC(=O)CS Amb27867130 [0,1,0,0,0,0|2,0,0]=3 472 B8R0.9 C=C(Br)CNS(=O)CC Amb28053476 [0,1,0,0,0,0|3,0,0]=4 473 B8R0.9 C=C(Br)COC(=O)CO Amb27837568 [0,1,0,0,0,0|3,0,0]=4 474 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,1,0,0,0,0|3,0,0]=4 475 B8R0.9 C=C(C)CNC(=O)CCl Amb25178055 [0,1,0,0,0,0|2,0,0]=3 476 B8R0.9 C=C(C)CNC(=O)CN Amb27215165 [0,1,0,0,0,0|2,0,0]=3 477 B8R0.9 C=C(C)CNC(=O)CO Amb27866006 [0,1,0,0,0,0|2,0,0]=3 478 B8R0.9 C=C(C)CNC(=O)CS Amb28040754 [0,1,0,0,0,0|2,0,0]=3 479 B8R0.9 C=C(C)CNC(=O)OC Amb27473324 [0,1,0,0,0,0|2,0,0]=3 480 B8R0.9 C=C(C)COC(=O)CC Amb25345772 [0,1,0,0,0,0|3,0,0]=4 481 B8R0.9 C=C(C)COC(=O)CO Amb28280952 [0,1,0,0,0,0|3,0,0]=4 482 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,1,0,0,0,0|1,0,1]=3 483 B8R0.9 C=C(CC)CNC(C)=O Amb27985317 [0,1,0,0,0,0|2,0,0]=3 484 B8R0.9 C=C(CC)CNC(N)=O Amb28342560 [0,1,0,0,0,0|3,0,0]=4 485 B8R0.9 C=C(CC)OCC(C)=O Amb27227543 [0,1,0,0,0,0|3,0,0]=4 486 B8R0.9 C=C(CO)CC=C(C)C Amb27665270 [0,1,0,0,0,0|3,0,0]=4 487 B8R0.9 C=C(CS)SCC(C)=O Amb27844241 [0,1,0,0,0,0|3,0,0]=4 488 B8R0.9 C=C(Cl)CNC(=O)CO Amb27857427 [0,1,0,0,0,0|2,0,0]=3 489 B8R0.9 C=C(F)COC(=O)CCl Amb27945573 [0,1,0,0,0,0|3,0,0]=4 490 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,1,0,0,0,0|2,0,1]=4 491 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,1,0,0,0,0|2,0,1]=4 492 B8R0.9 C=CC(=O)CC=C(C)C Amb27838740 [0,1,0,0,0,0|3,0,0]=4 493 B8R0.9 C=CC(=O)COC(C)=O Amb17607380 [0,1,0,0,0,0|2,0,0]=3 494 B8R0.9 C=CC(=O)NCC(=C)Br Amb27978854 [0,1,0,0,0,0|2,0,1]=4 495 B8R0.9 C=CC(=O)NCC(=O)O Amb33532656 [0,1,0,0,0,0|0,0,1]=2 496 B8R0.9 C=CC(=O)NCC(C)O Amb9361385 [0,1,0,0,0,0|1,0,2]=4 497 B8R0.9 C=CC(=O)OCC(=O)O Amb27241348 [0,1,0,0,0,0|1,0,1]=3 498 B8R0.9 C=CC(=O)OCC(N)=O Amb27468552 [0,1,0,0,0,0|2,0,1]=4 499 B8R0.9 C=CC(=O)SCC(=O)O Amb27755823 [0,1,0,0,0,0|1,0,1]=3 500 B8R0.9 C=CC(=O)\C=C\C(C)=O Amb24061722 [0,1,0,0,0,0|2,0,1]=4 501 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,1,0,0,0,0|2,0,1]=4 502 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,1,0,0,0,0|2,0,0]=3 503 B8R0.9 CC(=N)SCC(=O)CCl Amb24113053 [0,1,0,0,0,0|3,0,0]=4 504 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,0]=3 505 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,1,0,0,0,0|1,0,0]=2 506 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [0,1,0,0,0,0|2,0,1]=4 507 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,1,0,0,0,0|2,0,1]=4 508 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,0|2,0,1]=4 509 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,1,0,0,0,0|2,0,1]=4 510 B8R0.9 CC(=O)CCN(C)C=O Amb27802453 [0,1,0,0,0,0|3,0,0]=4 511 B8R0.9 CC(=O)CCN(C)N=O Amb28364300 [0,1,0,0,0,0|3,0,0]=4 512 B8R0.9 CC(=O)CNC(=O)CCl Amb27880921 [0,1,0,0,0,0|1,0,0]=2 513 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,0|1,0,0]=2 514 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,1,0,0,0,0|1,0,2]=4 515 B8R0.9 CC(=O)COC(=O)CN Amb27168864 [0,1,0,0,0,0|2,0,0]=3 516 B8R0.9 CC(=O)NCC(=O)CN Amb35789045 [0,1,0,0,0,0|1,0,0]=2 517 B8R0.9 CC(=O)NCC(=O)CN Amb35789904 [0,1,0,0,0,0|1,0,0]=2 518 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,1,0,0,0,0|0,0,0]=1 519 B8R0.9 CC(=O)NCC(=O)NN Amb24524168 [0,1,0,0,0,0|1,0,0]=2 520 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,0|0,0,0]=1 521 B8R0.9 CC(=O)NCC(C)C=O Amb27485699 [0,1,0,0,0,0|1,0,1]=3 522 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,1,0,0,0,0|2,0,1]=4 523 B8R0.9 CC(=O)NCC(C)ON Amb17138377 [0,1,0,0,0,0|1,0,1]=3 524 B8R0.9 CC(=O)NCC(N)NO Amb27413098 [0,1,0,0,0,0|1,0,1]=3 525 B8R0.9 CC(=O)NCN(C)N=O Amb27154794 [0,1,0,0,0,0|2,0,0]=3 526 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,1,0,0,0,0|0,0,2]=3 527 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,0|1,0,1]=3 528 B8R0.9 CC(=O)NC\C(N)=N/O Amb19650814 [0,1,0,0,0,0|1,0,0]=2 529 B8R0.9 CC(=O)NC\C(N)=N\O Amb21912454 [0,1,0,0,0,0|1,0,0]=2 530 B8R0.9 CC(=O)NNC(=N)CN Amb27971258 [0,1,0,0,0,0|3,0,0]=4 531 B8R0.9 CC(=O)NNC(=N)NN Amb27655555 [0,1,0,0,0,0|3,0,0]=4 532 B8R0.9 CC(=O)NNC(=O)CBr Amb19957358 [0,1,0,0,0,0|2,0,0]=3 533 B8R0.9 CC(=O)NNC(=O)CCl Amb1154170 [0,1,0,0,0,0|2,0,0]=3 534 B8R0.9 CC(=O)NNC(=O)CN Amb17334122 [0,1,0,0,0,0|2,0,0]=3 535 B8R0.9 CC(=O)N\C=C(\C)C=O Amb18642508 [0,1,0,0,0,0|1,0,1]=3 536 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,1,0,0,0,0|2,0,0]=3 537 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,1,0,0,0,0|2,0,0]=3 538 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,1,0,0,0,0|1,0,0]=2 539 B8R0.9 CC(=O)OCC(=O)NN Amb27480937 [0,1,0,0,0,0|2,0,0]=3 540 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,1,0,0,0,0|2,0,1]=4 541 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,1,0,0,0,0|2,0,1]=4 542 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,1,0,0,0,0|2,0,1]=4 543 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,0|1,0,2]=4 544 B8R0.9 CC(=O)OCN(C)C=O Amb28285201 [0,1,0,0,0,0|3,0,0]=4 545 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,1,0,0,0,0|2,0,1]=4 546 B8R0.9 CC(=O)OC[C@H](C)C=O Amb27230590 [0,1,0,0,0,0|2,0,1]=4 547 B8R0.9 CC(=O)OC\C(C)=C/Cl Amb27793522 [0,1,0,0,0,0|3,0,0]=4 548 B8R0.9 CC(=O)OC\C(C)=C\Br Amb27803059 [0,1,0,0,0,0|3,0,0]=4 549 B8R0.9 CC(=O)OC\C(Cl)=C/Cl Amb27768652 [0,1,0,0,0,0|3,0,0]=4 550 B8R0.9 CC(=O)O\C=C(\C)C=O Amb27966540 [0,1,0,0,0,0|2,0,1]=4 551 B8R0.9 CC(=O)SCC(C)C=O Amb27827463 [0,1,0,0,0,0|2,0,1]=4 552 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,1,0,0,0,0|1,0,2]=4 553 B8R0.9 CC(=O)\C=C\C(O)C=O Amb27798118 [0,1,0,0,0,0|1,0,2]=4 554 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,1,0,0,0,0|1,0,1]=3 555 B8R0.9 CC(C)=CNC(=O)CCl Amb27880254 [0,1,0,0,0,0|2,0,1]=4 556 B8R0.9 CC(C)=NNC(=O)CCl Amb28119239 [0,1,0,0,0,0|3,0,0]=4 557 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,0|2,0,1]=4 558 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,1,0,0,0,0|2,0,1]=4 559 B8R0.9 CC(C)CNC(=O)CBr Amb10608023 [0,1,0,0,0,0|2,0,1]=4 560 B8R0.9 CC(C)CNC(=O)CCl Amb1160207 [0,1,0,0,0,0|2,0,1]=4 561 B8R0.9 CC(C)CNC(=O)CN Amb13951745 [0,1,0,0,0,0|2,0,1]=4 562 B8R0.9 CC(C)CNC(=O)CN Amb5783029 [0,1,0,0,0,0|2,0,1]=4 563 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,1,0,0,0,0|2,0,1]=4 564 B8R0.9 CC(C)NCC(=O)NN Amb27630359 [0,1,0,0,0,0|2,0,1]=4 565 B8R0.9 CC(C)NC\C(N)=N\O Amb27264292 [0,1,0,0,0,0|2,0,1]=4 566 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,1,0,0,0,0|1,0,2]=4 567 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,1,0,0,0,0|2,0,1]=4 568 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,1,0,0,0,0|2,0,1]=4 569 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,1,0,0,0,0|2,0,1]=4 570 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,1,0,0,0,0|2,0,1]=4 571 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,1,0,0,0,0|2,0,1]=4 572 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|2,0,1]=4 573 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,1,0,0,0,0|2,0,1]=4 574 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,1,0,0,0,0|2,0,1]=4 575 B8R0.9 CC(O)CNC(=O)CCl Amb17324265 [0,1,0,0,0,0|1,0,1]=3 576 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,1,0,0,0,0|2,0,1]=4 577 B8R0.9 CC(\C=C\C(=O)O)=C/Br Amb27650571 [0,1,0,0,0,0|2,0,1]=4 578 B8R0.9 CCC(=N)NCC(N)=O Amb28049684 [0,1,0,0,0,0|2,0,0]=3 579 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,1,0,0,0,0|2,0,0]=3 580 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,0]=2 581 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,1,0,0,0,0|2,0,0]=3 582 B8R0.9 CCC(=O)CNC(C)C Amb28341444 [0,1,0,0,0,0|2,0,1]=4 583 B8R0.9 CCC(=O)COC(C)=O Amb3940673 [0,1,0,0,0,0|2,0,0]=3 584 B8R0.9 CCC(=O)CSC(C)=O Amb27180933 [0,1,0,0,0,0|2,0,0]=3 585 B8R0.9 CCC(=O)C\C=C(/C)Cl Amb27838754 [0,1,0,0,0,0|3,0,0]=4 586 B8R0.9 CCC(=O)NC=C(Cl)Cl Amb2511066 [0,1,0,0,0,0|2,0,1]=4 587 B8R0.9 CCC(=O)NCB(O)O Amb8392098 [0,1,0,0,0,0|1,0,1]=3 588 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|0,0,0]=1 589 B8R0.9 CCC(=O)NCC(C)Br Amb28207756 [0,1,0,0,0,0|2,0,1]=4 590 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,1,0,0,0,0|2,0,1]=4 591 B8R0.9 CCC(=O)NCC(C)Cl Amb27836210 [0,1,0,0,0,0|2,0,1]=4 592 B8R0.9 CCC(=O)NCC(C)O Amb9275499 [0,1,0,0,0,0|1,0,1]=3 593 B8R0.9 CCC(=O)NCC(N)=O Amb17231864 [0,1,0,0,0,0|1,0,0]=2 594 B8R0.9 CCC(=O)NCC(N)=S Amb17232011 [0,1,0,0,0,0|1,1,0]=3 595 B8R0.9 CCC(=O)NN=C(C)C Amb27837620 [0,1,0,0,0,0|3,0,0]=4 596 B8R0.9 CCC(=O)NNC(N)=O Amb27769108 [0,1,0,0,0,0|2,0,0]=3 597 B8R0.9 CCC(=O)NNC(N)=S Amb2558752 [0,1,0,0,0,0|2,1,0]=4 598 B8R0.9 CCC(=O)OCC(C)=O Amb27662511 [0,1,0,0,0,0|2,0,0]=3 599 B8R0.9 CCC(=O)OCC(C)O Amb28184966 [0,1,0,0,0,0|2,0,1]=4 600 B8R0.9 CCC(=O)OCC(N)=O Amb26505774 [0,1,0,0,0,0|2,0,0]=3 601 B8R0.9 CCC(=O)OC[C@@H](C)O Amb28049124 [0,1,0,0,0,0|2,0,1]=4 602 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,1,0,0,0,0|1,0,1]=3 603 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,1,0,0,0,0|1,0,1]=3 604 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,1,0,0,0,0|2,0,1]=4 605 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,1,0,0,0,0|2,0,1]=4 606 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,1,0,0,0,0|2,0,1]=4 607 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,1,0,0,0,0|1,0,1]=3 608 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,1,0,0,0,0|1,0,1]=3 609 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,1,0,0,0,0|2,0,1]=4 610 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,1,0,0,0,0|2,0,1]=4 611 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,1,0,0,0,0|2,0,1]=4 612 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,1,0,0,0,0|2,0,1]=4 613 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,1,0,0,0,0|2,0,1]=4 614 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,1,0,0,0,0|2,0,1]=4 615 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,1,0,0,0,0|1,0,2]=4 616 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,1,0,0,0,0|2,0,1]=4 617 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,1,0,0,0,0|1,1,1]=4 618 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,1,0,0,0,0|3,0,0]=4 619 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,1,0,0,0,0|3,0,0]=4 620 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,1,0,0,0,0|2,0,0]=3 621 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,1,0,0,0,0|1,0,0]=2 622 B8R0.9 CCS(=O)NCC(N)=O Amb27433455 [0,1,0,0,0,0|2,0,0]=3 623 B8R0.9 CCS(=O)NC[C@H](C)O Amb28200821 [0,1,0,0,0,0|2,0,1]=4 624 B8R0.9 CCS(=O)\C=C\C(=O)O Amb28347741 [0,1,0,0,0,0|2,0,1]=4 625 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,1,0,0,0,0|2,0,1]=4 626 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,1,0,0,0,0|1,0,2]=4 627 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,1,0,0,0,0|1,0,1]=3 628 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,1,0,0,0,0|2,0,0]=3 629 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,1,0,0,0,0|3,0,0]=4 630 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,1,0,0,0,0|3,0,0]=4 631 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,1,0,0,0,0|2,0,0]=3 632 B8R0.9 CN(CCC(N)=O)N=O Amb27487572 [0,1,0,0,0,0|3,0,0]=4 633 B8R0.9 CNC(=N)NCC(C)O Amb27877381 [0,1,0,0,0,0|2,0,1]=4 634 B8R0.9 CNC(=N)NCC(N)=O Amb27865962 [0,1,0,0,0,0|2,0,0]=3 635 B8R0.9 CNC(=N)SCC(C)=O Amb27461473 [0,1,0,0,0,0|3,0,0]=4 636 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,1,0,0,0,0|1,0,0]=2 637 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,1,0,0,0,0|2,0,0]=3 638 B8R0.9 CNC(=O)CCC(C)O Amb17334125 [0,1,0,0,0,0|2,0,1]=4 639 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,1,0,0,0,0|2,0,0]=3 640 B8R0.9 CNC(=O)CC[C@H](C)O Amb27799232 [0,1,0,0,0,0|2,0,1]=4 641 B8R0.9 CNC(=O)CNC(C)=N Amb28043406 [0,1,0,0,0,0|2,0,0]=3 642 B8R0.9 CNC(=O)CNC(C)=O Amb4034777 [0,1,0,0,0,0|1,0,0]=2 643 B8R0.9 CNC(=O)COC(C)=O Amb26872495 [0,1,0,0,0,0|2,0,0]=3 644 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,0|0,0,0]=1 645 B8R0.9 CNC(=O)NCC(C)O Amb28326263 [0,1,0,0,0,0|1,0,1]=3 646 B8R0.9 CNC(=O)NCC(N)=S Amb27657337 [0,1,0,0,0,0|1,1,0]=3 647 B8R0.9 CNC(=O)NN=C(C)C Amb27145810 [0,1,0,0,0,0|3,0,0]=4 648 B8R0.9 CNC(=O)NNC(C)=O Amb26580329 [0,1,0,0,0,0|2,0,0]=3 649 B8R0.9 CNC(=O)NNC(N)=O Amb27784787 [0,1,0,0,0,0|2,0,0]=3 650 B8R0.9 CNC(=O)NNC(N)=S Amb25726192 [0,1,0,0,0,0|2,1,0]=4 651 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,1,0,0,0,0|1,0,0]=2 652 B8R0.9 CNC(=O)ONC(C)=O Amb27786025 [0,1,0,0,0,0|2,0,0]=3 653 B8R0.9 CNC(=O)\C=C/C(=O)O Amb2720469 [0,1,0,0,0,0|1,0,1]=3 654 B8R0.9 CNC(=O)\C=C\C(=O)O Amb9277097 [0,1,0,0,0,0|1,0,1]=3 655 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,1,0,0,0,0|0,1,0]=2 656 B8R0.9 CNC(=S)NCC(C)O Amb4303457 [0,1,0,0,0,0|1,1,1]=4 657 B8R0.9 CNC(=S)NNC(C)=O Amb6322686 [0,1,0,0,0,0|2,1,0]=4 658 B8R0.9 CNC(=S)NNC(N)=O Amb26494378 [0,1,0,0,0,0|2,1,0]=4 659 B8R0.9 COC(=O)C=C=C(C)C Amb32423562 [0,1,0,0,0,0|2,0,1]=4 660 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,1,0,0,0,0|2,0,1]=4 661 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,1,0,0,0,0|2,0,0]=3 662 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,1,0,0,0,0|1,0,0]=2 663 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,1,0,0,0,0|1,0,0]=2 664 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,0|2,0,1]=4 665 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,1,0,0,0,0|2,0,1]=4 666 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,0|2,0,1]=4 667 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,1,0,0,0,0|2,0,1]=4 668 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,0|2,0,1]=4 669 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,1,0,0,0,0|2,0,1]=4 670 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,1,0,0,0,0|1,0,2]=4 671 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,1,0,0,0,0|1,1,1]=4 672 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,1,0,0,0,0|1,0,2]=4 673 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,0]=3 674 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,1,0,0,0,0|2,1,0]=4 675 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,1,0,0,0,0|3,0,0]=4 676 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [0,1,0,0,0,0|3,0,0]=4 677 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,1,0,0,0,0|2,0,0]=3 678 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [0,1,0,0,0,0|2,0,1]=4 679 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [0,1,0,0,0,0|3,0,0]=4 680 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,0|2,0,1]=4 681 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,1,0,0,0,0|2,0,1]=4 682 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [0,1,0,0,0,0|2,0,1]=4 683 B8R0.9 COC(=O)CNC(=N)N Amb27259956 [0,1,0,0,0,0|2,0,0]=3 684 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,1,0,0,0,0|0,0,0]=1 685 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,1,0,0,0,0|1,0,1]=3 686 B8R0.9 COC(=O)CNC(N)=O Amb1126846 [0,1,0,0,0,0|1,0,0]=2 687 B8R0.9 COC(=O)CNC(N)=S Amb9212124 [0,1,0,0,0,0|1,1,0]=3 688 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,1,0,0,0,0|1,0,0]=2 689 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,1,0,0,0,0|2,0,1]=4 690 B8R0.9 COC(=O)CSC(=N)N Amb20676059 [0,1,0,0,0,0|3,0,0]=4 691 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,1,0,0,0,0|2,0,1]=4 692 B8R0.9 COC(=O)NCC(=O)Cl Amb28388481 [0,1,0,0,0,0|1,0,0]=2 693 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,1,0,0,0,0|0,0,0]=1 694 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,1,0,0,0,0|1,0,0]=2 695 B8R0.9 COC(=O)NCC(C)Cl Amb27401852 [0,1,0,0,0,0|2,0,1]=4 696 B8R0.9 COC(=O)NCC(C)O Amb9285615 [0,1,0,0,0,0|1,0,1]=3 697 B8R0.9 COC(=O)NCC(N)=O Amb27640170 [0,1,0,0,0,0|1,0,0]=2 698 B8R0.9 COC(=O)NC[C@@H](C)O Amb28204216 [0,1,0,0,0,0|1,0,1]=3 699 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,0|2,0,1]=4 700 B8R0.9 COC(=O)NNC(N)=O Amb27643836 [0,1,0,0,0,0|2,0,0]=3 701 B8R0.9 COC(=O)OCC(=O)Cl Amb8393900 [0,1,0,0,0,0|2,0,0]=3 702 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,1,0,0,0,0|1,0,0]=2 703 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [0,1,0,0,0,0|1,0,1]=3 704 B8R0.9 COC(=O)\C=C\C(=O)Cl Amb32664984 [0,1,0,0,0,0|2,0,1]=4 705 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [0,1,0,0,0,0|1,0,1]=3 706 B8R0.9 COC(=O)\C=C\C(C)=O Amb22336182 [0,1,0,0,0,0|1,0,1]=3 707 B8R0.9 COC(=O)\C=C\S(C)=O Amb28049230 [0,1,0,0,0,0|2,0,1]=4 708 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,1,0,0,0,0|1,1,0]=3 709 B8R0.9 COC(=S)SCC(N)=O Amb28325528 [0,1,0,0,0,0|2,1,0]=4 710 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,1,0,0,0,0|1,0,2]=4 711 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,1,0,0,0,0|2,0,1]=4 712 B8R0.9 COC(C)CNC(=O)Cl Amb35633401 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,1]=4 714 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,1,0,0,0,0|2,0,1]=4 715 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,1,0,0,0,0|1,0,2]=4 716 B8R0.9 CO[C@@H](C)CNC(C)=O Amb35605355 [0,1,0,0,0,0|1,0,1]=3 717 B8R0.9 CO[C@@H](C)CNC(N)=O Amb35641866 [0,1,0,0,0,0|2,0,1]=4 718 B8R0.9 CO[C@H](C)CNC(C)=O Amb30024558 [0,1,0,0,0,0|1,0,1]=3 719 B8R0.9 CO[C@H](C)CNC(N)=O Amb29883111 [0,1,0,0,0,0|2,0,1]=4 720 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,1,0,0,0,0|1,0,1]=3 721 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,1,0,0,0,0|2,0,0]=3 722 B8R0.9 CS(=O)CC\C(N)=N\O Amb27852254 [0,1,0,0,0,0|3,0,0]=4 723 B8R0.9 CS(=O)NCC(N)CO Amb27778086 [0,1,0,0,0,0|2,0,1]=4 724 B8R0.9 CS(=O)NCC(O)CO Amb27437774 [0,1,0,0,0,0|1,0,2]=4 725 B8R0.9 CSC(=O)CCC(C)O Amb28065144 [0,1,0,0,0,0|2,0,1]=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(=S)NNC(C)=O Amb4006848 [0,1,0,0,0,0|1,2,0]=4 728 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,1,0,0,0,0|1,1,1]=4 729 B8R0.9 C[C@@H](O)CNC(=O)CBr Amb28049185 [0,1,0,0,0,0|1,0,1]=3 730 B8R0.9 C[C@@H](O)CNC(=O)CN Amb27495538 [0,1,0,0,0,0|1,0,1]=3 731 B8R0.9 C[C@H](O)CNC(=O)CCl Amb28049186 [0,1,0,0,0,0|1,0,1]=3 732 B8R0.9 C[C@H](O)CNC(=O)CN Amb27399091 [0,1,0,0,0,0|1,0,1]=3 733 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,1,0,0,0,0|1,0,1]=3 734 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,1,0,0,0,0|2,0,0]=3 735 B8R0.9 C\C(C=O)=N/NC(N)=O Amb27769079 [0,1,0,0,0,0|2,0,1]=4 736 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,1,0,0,0,0|1,0,1]=3 737 B8R0.9 C\C=C(C)/C=C/C(=O)O Amb27838460 [0,1,0,0,0,0|2,0,1]=4 738 B8R0.9 C\C=C(C)\C=C\C(=O)O Amb18642399 [0,1,0,0,0,0|2,0,1]=4 739 B8R0.9 C\C=C(Cl)\C=C\C(=O)O Amb28137785 [0,1,0,0,0,0|2,0,1]=4 740 B8R0.9 C\C=C(F)\C=C\C(=O)O Amb27826588 [0,1,0,0,0,0|2,0,1]=4 741 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,1,0,0,0,0|3,0,0]=4 742 B8R0.9 C\C=C(\C)OCC(C)=O Amb27844138 [0,1,0,0,0,0|3,0,0]=4 743 B8R0.9 C\N=C(/N)NC[C@@H](C)O Amb27406662 [0,1,0,0,0,0|2,0,1]=4 744 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,1,0,0,0,0|1,0,0]=2 745 B8R0.9 N=C(CCl)NCC(N)=O Amb27483156 [0,1,0,0,0,0|2,0,0]=3 746 B8R0.9 NC(=O)CNC(=O)C=O Amb27236949 [0,1,0,0,0,0|1,0,1]=3 747 B8R0.9 NC(=O)NC\C(N)=N\O Amb27487653 [0,1,0,0,0,0|2,0,0]=3 748 B8R0.9 NC(=O)NNC(=O)CO Amb25328968 [0,1,0,0,0,0|2,0,0]=3 749 B8R0.9 NC(=O)NNC(=O)CS Amb27204540 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,1,0,0,0,0|2,0,1]=4 751 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,1,0,0,0,0|2,0,1]=4 752 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,1,0,0,0,0|2,0,1]=4 753 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,1,0,0,0,0|2,0,1]=4 754 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,1,0,0,0,0|2,0,1]=4 755 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,1,0,0,0,0|2,0,1]=4 756 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,1,0,0,0,0|1,0,0]=2 757 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,1,0,0,0,0|1,0,0]=2 758 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,0|0,0,0]=1 759 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,1,0,0,0,0|0,0,0]=1 760 B8R0.9 NCC(=O)NCC(Cl)Cl Amb28253996 [0,1,0,0,0,0|2,0,1]=4 761 B8R0.9 NCC(=O)NCC(F)F Amb24184081 [0,1,0,0,0,0|2,0,1]=4 762 B8R0.9 NCC(=O)NCC(F)F Amb27477913 [0,1,0,0,0,0|2,0,1]=4 763 B8R0.9 NCC(=O)NNC(N)=O Amb28340955 [0,1,0,0,0,0|2,0,0]=3 764 B8R0.9 NCC(=O)OCC(N)=O Amb27829178 [0,1,0,0,0,0|2,0,0]=3 765 B8R0.9 NCC(=S)NCC(N)=S Amb27463228 [0,1,0,0,0,0|1,2,0]=4 766 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,1,0,0,0,0|2,0,1]=4 767 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,1,0,0,0,0|2,0,1]=4 768 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,1,0,0,0,0|1,0,2]=4 769 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,1,0,0,0,0|2,0,1]=4 770 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,1,0,0,0,0|2,0,1]=4 771 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,1,0,0,0,0|1,0,2]=4 772 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,1,0,0,0,0|2,0,1]=4 773 B8R0.9 NNC(=O)CCC(N)=O Amb595603 [0,1,0,0,0,0|3,0,0]=4 774 B8R0.9 NNC(=O)CNC(N)=O Amb24477825 [0,1,0,0,0,0|2,0,0]=3 775 B8R0.9 NNC(=O)NCC(=O)O Amb27623574 [0,1,0,0,0,0|1,0,0]=2 776 B8R0.9 NNC(=O)NCC(N)=O Amb8854040 [0,1,0,0,0,0|2,0,0]=3 777 B8R0.9 NNC(=S)NCC(N)=O Amb7771588 [0,1,0,0,0,0|2,1,0]=4 778 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,1,0,0,0,0|2,0,1]=4 779 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,1,0,0,0,0|2,0,1]=4 780 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,1,0,0,0,0|2,0,1]=4 781 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,1,0,0,0,0|2,0,1]=4 782 B8R0.9 O=C(CBr)NCC(Cl)Cl Amb28201337 [0,1,0,0,0,0|2,0,1]=4 783 B8R0.9 O=C(CBr)NCC(F)F Amb22059775 [0,1,0,0,0,0|2,0,1]=4 784 B8R0.9 O=C(CCl)NCC(F)F Amb27622633 [0,1,0,0,0,0|2,0,1]=4 785 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|1,0,0]=2 786 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,1,0,0,0,0|1,0,2]=4 787 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,1,0,0,0,0|1,1,1]=4 788 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,1,0,0,0,0|2,0,1]=4 789 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,0|0,0,0]=1 790 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,1,0,0,0,0|0,0,0]=1 791 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,1,0,0,0,0|1,0,0]=2 792 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,1,0,0,0,0|1,0,0]=2 793 B8R0.9 O=C(O)CS\C(Cl)=C\Cl Amb27858758 [0,1,0,0,0,0|2,0,1]=4 794 B8R0.9 O=C(O)\C=C\C(=O)NO Amb28060797 [0,1,0,0,0,0|2,0,1]=4 795 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,1,0,0,0,0|1,0,1]=3 796 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,1,0,0,0,0|3,0,0]=4 797 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,1,0,0,0,0|2,0,0]=3 798 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,1,0,0,0,0|2,0,1]=4 799 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,1,0,0,0,0|2,0,1]=4 800 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,1,0,0,0,0|2,0,1]=4 801 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,1,0,0,0,0|2,0,1]=4 802 B8R0.23 C=C(C)C(=C)CC(C)=O Amb28324025 [0,1,0,0,0,0|3,0,0]=4 803 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,1,0,0,0,0|2,0,0]=3 804 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,1,0,0,0,0|3,0,0]=4 805 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,1,0,0,0,0|2,0,0]=3 806 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,0|3,0,0]=4 807 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,1,0,0,0,0|2,0,0]=3 808 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [0,1,0,0,0,0|3,0,0]=4 809 B8R0.23 C=C(C)CC(=C)C(C)=O Amb27215898 [0,1,0,0,0,0|3,0,0]=4 810 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,1,0,0,0,0|2,0,1]=4 811 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,1,0,0,0,0|2,0,0]=3 812 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [0,1,0,0,0,0|3,0,0]=4 813 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [0,1,0,0,0,0|3,0,0]=4 814 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,1,0,0,0,0|2,0,0]=3 815 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,1,0,0,0,0|3,0,0]=4 816 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,1,0,0,0,0|2,0,0]=3 817 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,1,0,0,0,0|2,0,0]=3 818 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,1,0,0,0,0|2,0,0]=3 819 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,1,0,0,0,0|2,0,0]=3 820 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,1,0,0,0,0|2,0,0]=3 821 B8R0.23 C=C(C)OC(C)C(C)=O Amb27838756 [0,1,0,0,0,0|3,0,0]=4 822 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,1,0,0,0,0|2,0,0]=3 823 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [0,1,0,0,0,0|3,0,0]=4 824 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,1,0,0,0,0|2,0,0]=3 825 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,1,0,0,0,0|2,0,0]=3 826 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [0,1,0,0,0,0|3,0,0]=4 827 B8R0.23 C=C(C)\C(C)=C\C(=O)O Amb17593311 [0,1,0,0,0,0|2,0,1]=4 828 B8R0.23 C=C(CC(=O)Cl)C(=O)Cl Amb17938995 [0,1,0,0,0,0|3,0,0]=4 829 B8R0.23 C=C(CC(=O)O)C(=O)O Amb6608656 [0,1,0,0,0,0|2,0,0]=3 830 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,1,0,0,0,0|1,0,0]=2 831 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [0,1,0,0,0,0|2,0,0]=3 832 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,1,0,0,0,0|2,0,1]=4 833 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,1,0,0,0,0|2,0,1]=4 834 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,1,0,0,0,0|2,0,1]=4 835 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,1,0,0,0,0|2,0,1]=4 836 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,1,0,0,0,0|2,0,1]=4 837 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,1,0,0,0,0|2,0,1]=4 838 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,1,0,0,0,0|2,0,1]=4 839 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,1,0,0,0,0|2,0,1]=4 840 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,1,0,0,0,0|2,0,1]=4 841 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [0,1,0,0,0,0|0,0,1]=2 842 B8R0.23 C=C(NC(C)=O)C(N)=O Amb27984135 [0,1,0,0,0,0|1,0,1]=3 843 B8R0.23 C=C(OC(C)=O)C(C)=O Amb27838658 [0,1,0,0,0,0|2,0,1]=4 844 B8R0.23 CC(=N)NC(C)C(N)=O Amb27412520 [0,1,0,0,0,0|2,0,0]=3 845 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,1,0,0,0,0|1,0,0]=2 846 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,1,0,0,0,0|1,0,0]=2 847 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,1,0,0,0,0|1,0,0]=2 848 B8R0.23 CC(=O)C(C)NC(N)=O Amb27778024 [0,1,0,0,0,0|2,0,0]=3 849 B8R0.23 CC(=O)C(C)SC(=O)Cl Amb32679654 [0,1,0,0,0,0|3,0,0]=4 850 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,1,0,0,0,0|2,0,1]=4 851 B8R0.23 CC(=O)C(Cl)C[N+](=O)[O-] Amb27954705 [0,1,0,0,0,0|2,0,1]=4 852 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,1,0,0,0,0|1,0,0]=2 853 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|2,0,0]=3 854 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,1,0,0,0,0|1,0,0]=2 855 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,1,0,0,0,0|1,0,1]=3 856 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [0,1,0,0,0,0|2,0,0]=3 857 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,1,0,0,0,0|1,0,0]=2 858 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,1,0,0,0,0|2,0,0]=3 859 B8R0.23 CC(=O)CC(C)[N+](=O)[O-] Amb27210764 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,1,0,0,0,0|3,0,0]=4 861 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,1,0,0,0,0|1,0,0]=2 862 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,1,0,0,0,0|1,0,0]=2 863 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,1,0,0,0,0|2,0,0]=3 864 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,1,0,0,0,0|1,0,0]=2 865 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [0,1,0,0,0,0|1,0,0]=2 866 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,1,0,0,0,0|2,0,1]=4 867 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,1,0,0,0,0|1,0,0]=2 868 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,1,0,0,0,0|1,0,0]=2 869 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,1,0,0,0,0|1,0,0]=2 870 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,1,0,0,0,0|2,0,0]=3 871 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,1,0,0,0,0|1,0,0]=2 872 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,1,0,0,0,0|1,0,0]=2 873 B8R0.23 CC(=O)N(C)CB(O)O Amb8392106 [0,1,0,0,0,0|1,0,1]=3 874 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,1,0,0,0,0|0,0,0]=1 875 B8R0.23 CC(=O)N(C)CC(F)F Amb27761824 [0,1,0,0,0,0|2,0,1]=4 876 B8R0.23 CC(=O)N(C)CC(N)=O Amb8999134 [0,1,0,0,0,0|1,0,0]=2 877 B8R0.23 CC(=O)N(C)CC(N)=S Amb17232013 [0,1,0,0,0,0|1,1,0]=3 878 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,1,0,0,0,0|0,0,0]=1 879 B8R0.23 CC(=O)NC(=O)C(C)=O Amb28245557 [0,1,0,0,0,0|1,0,1]=3 880 B8R0.23 CC(=O)NC(Br)C(C)=O Amb28285135 [0,1,0,0,0,0|1,0,0]=2 881 B8R0.23 CC(=O)NC(C)B(O)O Amb25125858 [0,1,0,0,0,0|1,0,1]=3 882 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,1,0,0,0,0|0,0,0]=1 883 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [0,1,0,0,0,0|1,0,0]=2 884 B8R0.23 CC(=O)NC(C)C(F)F Amb27634551 [0,1,0,0,0,0|2,0,1]=4 885 B8R0.23 CC(=O)NC(C)C(N)=O Amb4018750 [0,1,0,0,0,0|1,0,0]=2 886 B8R0.23 CC(=O)NC(O)C(Cl)Cl Amb3978808 [0,1,0,0,0,0|2,0,1]=4 887 B8R0.23 CC(=O)NN(C)C(N)=S Amb28126743 [0,1,0,0,0,0|2,1,0]=4 888 B8R0.23 CC(=O)N[C@@H](C)B(O)O Amb28397356 [0,1,0,0,0,0|1,0,1]=3 889 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,1,0,0,0,0|0,0,0]=1 890 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,1,0,0,0,0|1,0,0]=2 891 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,1,0,0,0,0|0,0,0]=1 892 B8R0.23 CC(=O)N\C(C)=C(\C)[S-] Amb28285580 [0,1,0,0,0,0|1,1,1]=4 893 B8R0.23 CC(=O)OC(=O)C(C)=O Amb26528827 [0,1,0,0,0,0|2,0,1]=4 894 B8R0.23 CC(=O)OC(C)C(=O)Cl Amb25920188 [0,1,0,0,0,0|2,0,0]=3 895 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,1,0,0,0,0|1,0,0]=2 896 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [0,1,0,0,0,0|2,0,0]=3 897 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [0,1,0,0,0,0|2,0,1]=4 898 B8R0.23 CC(=O)OC(C)C(N)=O Amb27179906 [0,1,0,0,0,0|2,0,0]=3 899 B8R0.23 CC(=O)ON(C)C(C)=O Amb4017292 [0,1,0,0,0,0|2,0,0]=3 900 B8R0.23 CC(=O)ON(Cl)C(C)=O Amb27872417 [0,1,0,0,0,0|2,0,0]=3 901 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl Amb3939242 [0,1,0,0,0,0|2,0,0]=3 902 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,1,0,0,0,0|1,0,0]=2 903 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [0,1,0,0,0,0|2,0,0]=3 904 B8R0.23 CC(=O)O[C@@H](C)C(N)=S Amb28067714 [0,1,0,0,0,0|2,1,0]=4 905 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl Amb27411067 [0,1,0,0,0,0|2,0,0]=3 907 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,1,0,0,0,0|1,0,0]=2 908 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [0,1,0,0,0,0|2,0,1]=4 909 B8R0.23 CC(=O)O[C@H](C)C(N)=O Amb27227531 [0,1,0,0,0,0|2,0,0]=3 910 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,1,0,0,0,0|1,0,0]=2 911 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,1,0,0,0,0|1,0,0]=2 912 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,1,0,0,0,0|2,0,0]=3 913 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,1,0,0,0,0|1,0,0]=2 914 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,1,0,0,0,0|1,0,0]=2 915 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,1,0,0,0,0|1,0,1]=3 916 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,1,0,0,0,0|1,0,1]=3 917 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,1,0,0,0,0|1,0,1]=3 918 B8R0.23 CC(=O)\C=C(/C)[PH](=O)O Amb27838812 [0,1,0,0,0,0|2,0,1]=4 919 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,1,0,0,0,0|1,0,1]=3 920 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [0,1,0,0,0,0|1,0,1]=3 921 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [0,1,0,0,0,0|1,0,1]=3 922 B8R0.23 CC(=O)\C=C(\C)[PH](=O)O Amb28248338 [0,1,0,0,0,0|2,0,1]=4 923 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [0,1,0,0,0,0|1,0,1]=3 924 B8R0.23 CC(=O)\N=C(/C)C(C)=O Amb26476592 [0,1,0,0,0,0|1,0,2]=4 925 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,1,0,0,0,0|0,1,0]=2 926 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,1,0,0,0,0|2,0,0]=3 928 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,1,0,0,0,0|2,0,0]=3 929 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,1,0,0,0,0|2,0,0]=3 931 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,0|2,0,1]=4 932 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,1,0,0,0,0|2,0,1]=4 935 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,1,0,0,0,0|2,0,1]=4 936 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,1,0,0,0,0|2,0,1]=4 937 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,1,0,0,0,0|2,0,1]=4 940 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,1,0,0,0,0|2,0,1]=4 941 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,1,0,0,0,0|2,0,1]=4 942 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,1,0,0,0,0|2,0,1]=4 943 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,1,0,0,0,0|2,0,1]=4 944 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,1,0,0,0,0|2,0,1]=4 946 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,1,0,0,0,0|2,0,1]=4 948 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,1,0,0,0,0|2,0,1]=4 949 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,1,0,0,0,0|2,0,1]=4 950 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,1,0,0,0,0|2,0,1]=4 951 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,1,0,0,0,0|2,0,1]=4 952 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,1,0,0,0,0|2,0,1]=4 953 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,1,0,0,0,0|2,0,1]=4 954 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,1,0,0,0,0|2,0,1]=4 955 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,1,0,0,0,0|1,0,1]=3 956 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,1,0,0,0,0|1,0,1]=3 957 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,1,0,0,0,0|1,0,2]=4 958 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,1,0,0,0,0|1,0,1]=3 959 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,1,0,0,0,0|1,0,1]=3 960 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,1,0,0,0,0|1,0,1]=3 961 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,1,0,0,0,0|2,0,1]=4 962 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,1,0,0,0,0|2,0,1]=4 963 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,1,0,0,0,0|2,0,1]=4 964 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,1,0,0,0,0|2,0,1]=4 965 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,0|2,0,1]=4 966 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,1,0,0,0,0|2,0,1]=4 967 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,1,0,0,0,0|2,0,1]=4 968 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,1,0,0,0,0|2,0,1]=4 969 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,1,0,0,0,0|2,0,1]=4 970 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,1,0,0,0,0|2,0,1]=4 971 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,1,0,0,0,0|2,0,1]=4 972 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,1,0,0,0,0|3,0,0]=4 973 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,1,0,0,0,0|2,0,0]=3 974 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,1,0,0,0,0|2,0,0]=3 975 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,1,0,0,0,0|3,0,0]=4 976 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,1,0,0,0,0|3,0,0]=4 977 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,1,0,0,0,0|2,0,1]=4 978 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,1,0,0,0,0|2,0,0]=3 979 B8R0.23 CC(CC(N)=O)C(N)=O Amb2720769 [0,1,0,0,0,0|3,0,0]=4 980 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,1,0,0,0,0|3,0,0]=4 981 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,1,0,0,0,0|3,0,0]=4 982 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,1,0,0,0,0|3,0,0]=4 983 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,1,0,0,0,0|3,0,0]=4 984 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,1,0,0,0,0|2,0,0]=3 985 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [0,1,0,0,0,0|3,0,0]=4 986 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,1,0,0,0,0|3,0,0]=4 987 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,1,0,0,0,0|2,0,1]=4 988 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,1,0,0,0,0|2,0,1]=4 989 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,1,0,0,0,0|2,0,1]=4 990 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,1,0,0,0,0|2,0,1]=4 991 B8R0.23 CC(NC(=N)N)C(=O)Cl Amb27960711 [0,1,0,0,0,0|3,0,0]=4 992 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [0,1,0,0,0,0|2,0,0]=3 993 B8R0.23 CC(NC(=S)S)C(=O)O Amb25336384 [0,1,0,0,0,0|1,1,0]=3 994 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [0,1,0,0,0,0|1,0,0]=2 995 B8R0.23 CC(N[N+](=O)[O-])C(=O)O Amb27873513 [0,1,0,0,0,0|2,0,0]=3 996 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [0,1,0,0,0,0|2,0,1]=4 997 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,1,0,0,0,0|1,0,2]=4 998 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,1,0,0,0,0|1,0,2]=4 999 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,1,0,0,0,0|1,0,2]=4 1000 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,1,0,0,0,0|1,0,2]=4 1001 B8R0.23 CC(OC(=O)Cl)C(=O)O Amb27241520 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.23 CC(O[N+](=O)[O-])C(=O)O Amb27947983 [0,1,0,0,0,0|3,0,0]=4 1003 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [0,1,0,0,0,0|1,1,1]=4 1004 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,1,0,0,0,0|3,0,0]=4 1005 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,1,0,0,0,0|3,0,0]=4 1006 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,1,0,0,0,0|3,0,0]=4 1007 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,1,0,0,0,0|3,0,0]=4 1008 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,1,0,0,0,0|3,0,0]=4 1009 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,1,0,0,0,0|3,0,0]=4 1010 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,1,0,0,0,0|3,0,0]=4 1011 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,1,0,0,0,0|3,0,0]=4 1012 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,1,0,0,0,0|3,0,0]=4 1013 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [0,1,0,0,0,0|2,0,0]=3 1014 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [0,1,0,0,0,0|2,0,0]=3 1015 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [0,1,0,0,0,0|2,0,0]=3 1016 B8R0.23 CN(CC(=O)O)C(=O)Cl Amb27484119 [0,1,0,0,0,0|1,0,0]=2 1017 B8R0.23 CN(CC(=O)O)C(=S)S Amb1042470 [0,1,0,0,0,0|1,1,0]=3 1018 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [0,1,0,0,0,0|1,0,0]=2 1019 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,1,0,0,0,0|1,0,0]=2 1020 B8R0.23 CN(CC(=O)O)[N+](=O)[O-] Amb27154042 [0,1,0,0,0,0|2,0,0]=3 1021 B8R0.23 CN(CC(=O)[O-])C(=S)[S-] Amb6342403 [0,1,0,0,0,0|1,1,1]=4 1022 B8R0.23 CN(CC(N)=O)C(=N)N Amb25072715 [0,1,0,0,0,0|3,0,0]=4 1023 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,1,0,0,0,0|3,0,0]=4 1024 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,1,0,0,0,0|3,0,0]=4 1025 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,1,0,0,0,0|2,0,0]=3 1026 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,1,0,0,0,0|3,0,0]=4 1027 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,1,0,0,0,0|2,0,0]=3 1028 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,1,0,0,0,0|2,0,0]=3 1029 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,1,0,0,0,0|2,0,0]=3 1030 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,1,0,0,0,0|2,0,1]=4 1031 B8R0.23 C[C@@H](NC(=N)N)C(N)=O Amb28121974 [0,1,0,0,0,0|3,0,0]=4 1032 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [0,1,0,0,0,0|1,0,0]=2 1033 B8R0.23 C[C@@H](NC(N)=O)C(N)=O Amb27394390 [0,1,0,0,0,0|2,0,0]=3 1034 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,1,0,0,0,0|1,0,2]=4 1035 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,1,0,0,0,0|1,0,2]=4 1036 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [0,1,0,0,0,0|2,0,0]=3 1037 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,1,0,0,0,0|2,0,0]=3 1038 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,1,0,0,0,0|2,0,0]=3 1039 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,1,0,0,0,0|2,0,0]=3 1040 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,1,0,0,0,0|2,0,1]=4 1041 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,1,0,0,0,0|2,0,1]=4 1042 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,1,0,0,0,0|2,0,1]=4 1043 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,1,0,0,0,0|2,0,1]=4 1044 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,1,0,0,0,0|2,0,1]=4 1045 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [0,1,0,0,0,0|2,0,0]=3 1046 B8R0.23 C[C@H](NC(=N)N)C(N)=O Amb27484450 [0,1,0,0,0,0|3,0,0]=4 1047 B8R0.23 C[C@H](NC(=O)Cl)C(=O)Cl Amb28292733 [0,1,0,0,0,0|2,0,0]=3 1048 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [0,1,0,0,0,0|1,0,0]=2 1049 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,1,0,0,0,0|1,0,0]=2 1050 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,1,0,0,0,0|1,0,2]=4 1051 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,1,0,0,0,0|2,0,0]=3 1052 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,1,0,0,0,0|2,0,0]=3 1053 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,1,0,0,0,0|2,0,0]=3 1054 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [0,1,0,0,0,0|2,0,1]=4 1055 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [0,1,0,0,0,0|2,0,1]=4 1056 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [0,1,0,0,0,0|2,0,1]=4 1057 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [0,1,0,0,0,0|2,0,1]=4 1058 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,1,0,0,0,0|2,0,0]=3 1059 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,1,0,0,0,0|2,0,0]=3 1060 B8R0.23 C\C(N)=N/[C@H](C)C(N)=O Amb28049817 [0,1,0,0,0,0|2,0,1]=4 1061 B8R0.23 C\C(N)=[N+](\C)CC(=O)[O-] Amb25339595 [0,1,0,0,0,0|1,0,2]=4 1062 B8R0.23 NC(=O)C(=S)CC(O)=S Amb28323012 [0,1,0,0,0,0|2,1,0]=4 1063 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,1,0,0,0,0|2,0,0]=3 1064 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,1,0,0,0,0|2,0,0]=3 1065 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,1,0,0,0,0|2,0,0]=3 1066 B8R0.23 NC(=O)C(O)CC(=O)[O-] Amb33068981 [0,1,0,0,0,0|2,0,1]=4 1067 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,1,0,0,0,0|2,0,0]=3 1068 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,1,0,0,0,0|2,0,0]=3 1069 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,1,0,0,0,0|2,0,0]=3 1070 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.23 NC(=O)CC(N)C(N)=O Amb18289248 [0,1,0,0,0,0|3,0,0]=4 1072 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,1,0,0,0,0|2,0,0]=3 1073 B8R0.23 NC(=O)CC(O)C(N)=O Amb27961515 [0,1,0,0,0,0|3,0,0]=4 1074 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,1,0,0,0,0|2,0,0]=3 1075 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,1,0,0,0,0|2,0,0]=3 1077 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,1,0,0,0,0|2,0,0]=3 1078 B8R0.23 NC(=O)C[C@@H](N)C(N)=O Amb28423711 [0,1,0,0,0,0|3,0,0]=4 1079 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,1,0,0,0,0|2,0,0]=3 1080 B8R0.23 NC(=O)C[C@@H](O)C(N)=O Amb27258074 [0,1,0,0,0,0|3,0,0]=4 1081 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,1,0,0,0,0|2,0,0]=3 1082 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,1,0,0,0,0|2,0,0]=3 1083 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,1,0,0,0,0|2,0,0]=3 1084 B8R0.23 NC(=O)C[C@H](N)C(N)=O Amb16183882 [0,1,0,0,0,0|3,0,0]=4 1085 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,1,0,0,0,0|2,0,0]=3 1086 B8R0.23 NC(=O)N(N)CC(=O)O Amb6296397 [0,1,0,0,0,0|1,0,0]=2 1087 B8R0.23 NC(=O)NC(=O)C(=O)O Amb18124345 [0,1,0,0,0,0|1,0,1]=3 1088 B8R0.23 NC(=O)NC(=O)C(N)=O Amb27173126 [0,1,0,0,0,0|2,0,1]=4 1089 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [0,1,0,0,0,0|1,0,0]=2 1090 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [0,1,0,0,0,0|1,0,0]=2 1091 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,1,0,0,0,0|2,0,0]=3 1092 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,1,0,0,0,0|2,0,0]=3 1093 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,1,0,0,0,0|2,0,0]=3 1094 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,1,0,0,0,0|2,0,0]=3 1095 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [0,1,0,0,0,0|2,0,1]=4 1096 B8R0.23 NC(=O)\C=C(/Cl)C(=O)O Amb27815058 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.23 NC(=O)\C=C(\F)C(=O)O Amb27447226 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,1,0,0,0,0|2,1,0]=4 1099 B8R0.23 NC(C=C(Cl)Cl)C(=O)O Amb22350718 [0,1,0,0,0,0|3,0,0]=4 1100 B8R0.23 NC(C=S(=O)=O)C(=O)O Amb27231764 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,1,0,0,0,0|2,0,0]=3 1102 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,1,0,0,0,0|2,0,0]=3 1104 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,1,0,0,0,0|3,0,0]=4 1105 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,1,0,0,0,0|2,0,0]=3 1106 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,1,0,0,0,0|2,0,0]=3 1107 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,1,0,0,0,0|2,0,0]=3 1108 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,1,0,0,0,0|2,0,0]=3 1109 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,1,0,0,0,0|2,0,0]=3 1110 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] Amb22757383 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,1,0,0,0,0|3,0,0]=4 1112 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,1,0,0,0,0|3,0,0]=4 1113 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,1,0,0,0,0|3,0,0]=4 1114 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,1,0,0,0,0|2,0,0]=3 1115 B8R0.23 O=C(Cl)CC(Cl)C(=O)Cl Amb28122555 [0,1,0,0,0,0|3,0,0]=4 1116 B8R0.23 O=C(O)C(=O)C[PH](=O)O Amb27218009 [0,1,0,0,0,0|3,0,0]=4 1117 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [0,1,0,0,0,0|3,0,0]=4 1118 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.23 O=C(O)CC(=S)C(=O)O Amb25304511 [0,1,0,0,0,0|2,0,0]=3 1120 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,1,0,0,0,0|2,0,0]=3 1121 B8R0.23 O=C(O)CC(Cl)=C(Cl)Cl Amb2227973 [0,1,0,0,0,0|3,0,0]=4 1122 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,1,0,0,0,0|2,0,0]=3 1123 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,1,0,0,0,0|2,0,0]=3 1124 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,1,0,0,0,0|2,0,0]=3 1125 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,1,0,0,0,0|2,0,0]=3 1126 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,1,0,0,0,0|2,0,0]=3 1127 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,1,0,0,0,0|2,0,0]=3 1128 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,1,0,0,0,0|2,0,0]=3 1129 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,1,0,0,0,0|2,0,0]=3 1130 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,1,0,0,0,0|2,0,0]=3 1131 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,1,0,0,0,0|2,0,0]=3 1132 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,1,0,0,0,0|2,0,0]=3 1133 B8R0.23 O=C(O)\C=C(/Br)C(=O)O Amb31275762 [0,1,0,0,0,0|2,0,1]=4 1134 B8R0.23 O=C(O)\C=C(/Cl)C(=O)O Amb4007497 [0,1,0,0,0,0|2,0,1]=4 1135 B8R0.23 O=C(O)\C=C(/F)C(=O)O Amb26860064 [0,1,0,0,0,0|2,0,1]=4 1136 B8R0.23 O=C(O)\C=C(/I)C(=O)O Amb10755055 [0,1,0,0,0,0|2,0,1]=4 1137 B8R0.23 O=C(O)\C=C(\Br)C(=O)O Amb25746120 [0,1,0,0,0,0|2,0,1]=4 1138 B8R0.23 O=C(O)\C=C(\F)C(=O)O Amb18124397 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.23 O=C([O-])CC(O)C(=O)[O-] Amb30876864 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.23 O=C([O-])C[C@H](O)C(=O)[O-] Amb22351833 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.29 C=C(Br)CNS(C)(=N)=O Amb29851295 [0,1,0,0,0,0|3,0,0]=4 1142 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [0,1,0,0,0,0|3,0,0]=4 1143 B8R0.29 C=C(C)CNS(C)(=N)=O Amb35715509 [0,1,0,0,0,0|3,0,0]=4 1144 B8R0.29 C=C(Cl)CNS(C)(=N)=O Amb30012954 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.29 C=C(Cl)CNS(C)(=O)=O Amb27615703 [0,1,0,0,0,0|3,0,0]=4 1146 B8R0.29 CC(=N)NCS(=O)(=O)O Amb27238670 [0,1,0,0,0,0|2,0,0]=3 1147 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,1,0,0,0,0|2,0,1]=4 1148 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,1,0,0,0,0|2,0,1]=4 1149 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,0|2,0,1]=4 1150 B8R0.29 CC(=O)COP(C)(C)=O Amb27749793 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.29 CC(=O)COS(C)(=O)=O Amb24737069 [0,1,0,0,0,0|3,0,0]=4 1152 B8R0.29 CC(=O)CSS(=O)(=O)O Amb27256676 [0,1,0,0,0,0|3,0,0]=4 1153 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,1,0,0,0,0|2,0,1]=4 1154 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,0|1,0,1]=3 1155 B8R0.29 CC(=O)NCC(C)(C)S Amb27489471 [0,1,0,0,0,0|1,1,1]=4 1156 B8R0.29 CC(=O)NCC(C)(F)F Amb29855696 [0,1,0,0,0,0|2,0,1]=4 1157 B8R0.29 CC(=O)NCC(F)(F)F Amb33544939 [0,1,0,0,0,0|2,0,1]=4 1158 B8R0.29 CC(=O)NCC(O)(O)O Amb27817621 [0,1,0,0,0,0|0,0,2]=3 1159 B8R0.29 CC(=O)NCP(=O)(O)O Amb26515978 [0,1,0,0,0,0|1,0,0]=2 1160 B8R0.29 CC(=O)NC[B-](F)(F)F Amb28138893 [0,1,0,0,0,0|3,0,0]=4 1161 B8R0.29 CC(=O)NC[Si](C)(C)C Amb27461438 [0,1,0,0,0,0|2,1,0]=4 1162 B8R0.29 CC(=O)NC[Si](C)(C)O Amb27837682 [0,1,0,0,0,0|1,1,0]=3 1163 B8R0.29 CC(=O)SCC(C)(C)O Amb27397144 [0,1,0,0,0,0|2,0,1]=4 1164 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,1,0,0,0,0|2,0,1]=4 1165 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.29 CC(C)(C)NCC(=O)Cl Amb26459118 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,1,0,0,0,0|1,0,1]=3 1169 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,1,0,0,0,0|1,0,1]=3 1170 B8R0.29 CC(C)(C)NCC(N)=O Amb6714542 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,1,0,0,0,0|2,0,1]=4 1172 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,1,0,0,0,0|1,0,2]=4 1174 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,1,0,0,0,0|2,0,1]=4 1178 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,1,0,0,0,0|2,0,1]=4 1179 B8R0.29 CC(C)(O)CNC(N)=O Amb27175271 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,1,0,0,0,0|1,1,1]=4 1181 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,1,0,0,0,0|2,0,1]=4 1182 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,1,0,0,0,0|2,0,1]=4 1183 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,1,0,0,0,0|2,0,1]=4 1184 B8R0.29 CC(O)CNS(C)(=N)=O Amb29849344 [0,1,0,0,0,0|2,0,1]=4 1185 B8R0.29 CC(O)CNS(C)(=O)=O Amb9362687 [0,1,0,0,0,0|2,0,1]=4 1186 B8R0.29 CC(O)NCP(=O)(O)O Amb27201283 [0,1,0,0,0,0|1,0,2]=4 1187 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [0,1,0,0,0,0|2,0,0]=3 1188 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [0,1,0,0,0,0|2,0,0]=3 1189 B8R0.29 CS(=N)(=O)NCC(=O)O Amb35687837 [0,1,0,0,0,0|1,0,0]=2 1190 B8R0.29 CS(=N)(=O)NCC(N)=O Amb30019446 [0,1,0,0,0,0|2,0,0]=3 1191 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [0,1,0,0,0,0|2,0,0]=3 1192 B8R0.29 CS(=O)(=O)NCC(=O)Cl Amb5742077 [0,1,0,0,0,0|2,0,0]=3 1193 B8R0.29 CS(=O)(=O)NCC(=O)O Amb1120433 [0,1,0,0,0,0|1,0,0]=2 1194 B8R0.29 CS(=O)(=O)NCC(=O)[O-] Amb7969413 [0,1,0,0,0,0|1,0,1]=3 1195 B8R0.29 CS(=O)(=O)NCC(N)=O Amb17232098 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.29 CS(=O)(=O)NCC(N)=S Amb17232675 [0,1,0,0,0,0|2,1,0]=4 1197 B8R0.29 CS(=O)(=O)OCC(=O)O Amb25783884 [0,1,0,0,0,0|2,0,0]=3 1198 B8R0.29 CS(=O)(=O)OCC(N)=O Amb24601490 [0,1,0,0,0,0|3,0,0]=4 1199 B8R0.29 CS(=O)(=O)SCC(=O)O Amb17610576 [0,1,0,0,0,0|2,0,0]=3 1200 B8R0.29 CS(=O)(=O)\C=C\C(=O)O Amb23511152 [0,1,0,0,0,0|2,0,1]=4 1201 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [0,1,0,0,0,0|1,0,1]=3 1202 B8R0.29 C[C@@H](O)CNS(C)(=N)=O Amb29850777 [0,1,0,0,0,0|2,0,1]=4 1203 B8R0.29 C[C@@H](O)CNS(C)(=O)=O Amb25921177 [0,1,0,0,0,0|2,0,1]=4 1204 B8R0.29 C[C@H](O)CNS(C)(=N)=O Amb29850982 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,1,0,0,0,0|3,0,0]=4 1206 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,1,0,0,0,0|3,0,0]=4 1207 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,1,0,0,0,0|3,0,0]=4 1208 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [0,1,0,0,0,0|3,0,0]=4 1209 B8R0.29 NS(=O)(=O)NCC(=O)O Amb6277125 [0,1,0,0,0,0|2,0,0]=3 1210 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [0,1,0,0,0,0|3,0,0]=4 1211 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [0,1,0,0,0,0|3,0,0]=4 1212 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [0,1,0,0,0,0|3,0,0]=4 1213 B8R0.29 O=C(O)COP(=O)(O)O Amb24442945 [0,1,0,0,0,0|3,0,0]=4 1214 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,0,0,1,0,0|3,0,0]=4 1215 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,0|3,0,0]=4 1216 B8R1.3 CC1=CNC(=O)CO1 Amb27390806 [0,0,0,1,0,0|1,0,1]=3 1217 B8R1.3 CC1=COC(=O)C=C1 Amb27595539 [0,0,0,1,0,0|2,0,1]=4 1218 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,0,0,1,0,0|3,0,0]=4 1219 B8R1.3 CC1=NNC(=O)NC1 Amb3777345 [0,0,0,1,0,0|3,0,0]=4 1220 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,0,0,1,0,0|2,0,1]=4 1221 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,0,0,1,0,0|2,0,1]=4 1222 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,0|2,0,1]=4 1223 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,0|2,0,1]=4 1224 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,0,0,1,0,0|2,0,1]=4 1225 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,0|2,0,1]=4 1226 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,0,0,1,0,0|2,0,1]=4 1227 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,0|1,0,1]=3 1228 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,0|2,0,1]=4 1229 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,0,0,1,0,0|2,0,1]=4 1230 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,0|2,0,1]=4 1231 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,0|2,0,1]=4 1232 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,0,0,1,0,0|1,0,1]=3 1233 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,0,0,1,0,0|2,0,1]=4 1234 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,0|2,0,1]=4 1235 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,0|2,0,1]=4 1236 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,0|1,0,1]=3 1237 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,0,0,1,0,0|2,0,1]=4 1238 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,0,0,1,0,0|2,0,1]=4 1239 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,0,0,1,0,0|2,0,1]=4 1240 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,0,0,1,0,0|2,0,1]=4 1241 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,0,0,1,0,0|2,0,1]=4 1242 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,0,0,1,0,0|2,0,1]=4 1243 B8R1.3 O=C1C=CC(=O)NN1 Amb19651991 [0,0,0,1,0,0|2,0,1]=4 1244 B8R1.3 O=C1C=CC(O)=CN1 Amb19889905 [0,0,0,1,0,0|1,0,2]=4 1245 B8R1.3 O=C1C=CC(O)=NN1 Amb22058718 [0,0,0,1,0,0|2,0,1]=4 1246 B8R1.3 O=C1C=NC(=O)NN1 Amb27245613 [0,0,0,1,0,0|2,0,1]=4 1247 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,0,0,1,0,0|2,0,0]=3 1248 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,0,0,1,0,0|1,0,0]=2 1249 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,0,0,1,0,0|2,0,0]=3 1250 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,0,0,1,0,0|1,0,0]=2 1251 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,0,0,1,0,0|2,0,1]=4 1252 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,0,0,1,0,0|1,0,1]=3 1253 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,0,0,1,0,0|1,0,2]=4 1254 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [0,0,0,1,0,0|3,0,0]=4 1255 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,0,0,1,0,0|1,0,1]=3 1256 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,0,0,1,0,0|1,0,1]=3 1257 B8R1.3 O=C1CNC(=O)C=N1 Amb27838363 [0,0,0,1,0,0|1,0,1]=3 1258 B8R1.3 O=C1CNC(=O)CN1 Amb1011605 [0,0,0,1,0,0|1,0,0]=2 1259 B8R1.3 O=C1CNC(=O)NN1 Amb27655538 [0,0,0,1,0,0|2,0,0]=3 1260 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [0,0,0,1,0,0|0,0,0]=1 1261 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [0,0,0,1,0,0|1,0,0]=2 1262 B8R1.3 O=C1CSC(=O)SC1 Amb28074747 [0,0,0,1,0,0|2,1,0]=4 1263 B8R1.3 O=C1NCC(O)CN1 Amb19516674 [0,0,0,1,0,0|2,0,1]=4 1264 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,0,0,1,0,0|2,0,1]=4 1265 B8R1.3 S=C1CNC(=S)CN1 Amb22363607 [0,0,0,1,0,0|1,2,0]=4 1266 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,0,0,1,0,0|2,0,0]=3 1267 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,0,0,1,0,0|3,0,0]=4 1268 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|3,0,0]=4 1269 B8R1.20 C=C1CC1NC(N)=O Amb27246174 [0,0,0,1,0,0|3,0,0]=4 1270 B8R1.20 CC(=O)CC1OC1C Amb27767850 [0,0,0,1,0,0|2,0,1]=4 1271 B8R1.20 CC(=O)NC1CC1N Amb32663550 [0,0,0,1,0,0|2,0,1]=4 1272 B8R1.20 CC(=O)NC1CC1N Amb9457357 [0,0,0,1,0,0|2,0,1]=4 1273 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664511 [0,0,0,1,0,0|2,0,1]=4 1274 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664512 [0,0,0,1,0,0|2,0,1]=4 1275 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,0|2,0,1]=4 1276 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,0|2,0,1]=4 1277 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,0|2,0,1]=4 1278 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,0|2,0,1]=4 1279 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,0|1,0,2]=4 1280 B8R1.23 C=C(C)C1CC(=O)N1 Amb27858929 [0,0,0,1,0,0|2,0,0]=3 1281 B8R1.23 C=C(C)[C@@H]1CC(=O)N1 Amb28251769 [0,0,0,1,0,0|2,0,0]=3 1282 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [0,0,0,1,0,0|3,0,0]=4 1283 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,0,0,1,0,0|2,0,0]=3 1284 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [0,0,0,1,0,0|3,0,0]=4 1285 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [0,0,0,1,0,0|3,0,0]=4 1286 B8R1.23 C=C1CN(C(C)=O)C1 Amb35608821 [0,0,0,1,0,0|2,0,0]=3 1287 B8R1.23 C=C1CN(C(N)=O)C1 Amb35642027 [0,0,0,1,0,0|3,0,0]=4 1288 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,0,0,1,0,0|3,0,0]=4 1289 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [0,0,0,1,0,0|3,0,0]=4 1290 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,1,0,0|2,0,1]=4 1291 B8R1.23 CC(=O)N1CC(=O)C1 Amb22896668 [0,0,0,1,0,0|1,0,0]=2 1292 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,1,0,0|2,0,1]=4 1293 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,1,0,0|2,0,1]=4 1294 B8R1.23 CC(=O)N1CC(N)C1 Amb33339040 [0,0,0,1,0,0|2,0,1]=4 1295 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,1,0,0|1,0,1]=3 1296 B8R1.23 CC(=O)N1CC(S)C1 Amb27433776 [0,0,0,1,0,0|1,1,1]=4 1297 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,0,0,1,0,0|2,0,1]=4 1298 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,0,0,1,0,0|2,0,1]=4 1299 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,0,0,1,0,0|2,0,1]=4 1300 B8R1.23 CC(O)C1CC(=O)C1 Amb34159488 [0,0,0,1,0,0|2,0,1]=4 1301 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,0,0,1,0,0|2,0,1]=4 1302 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,0,0,1,0,0|1,0,1]=3 1303 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,0,0,1,0,0|1,0,1]=3 1304 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,0,0,1,0,0|3,0,0]=4 1305 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,0,0,1,0,0|1,0,1]=3 1306 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,0,0,1,0,0|1,0,1]=3 1307 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,0,0,1,0,0|1,0,1]=3 1308 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,0,0,1,0,0|1,0,1]=3 1309 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,0,0,1,0,0|2,0,1]=4 1310 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,0,0,1,0,0|2,0,1]=4 1311 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [0,0,0,1,0,0|1,0,0]=2 1312 B8R1.23 NC(=O)N1CC(O)C1 Amb28068660 [0,0,0,1,0,0|2,0,1]=4 1313 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,0,0,1,0,0|2,0,1]=4 1314 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,0,0,1,0,0|2,0,1]=4 1315 B8R1.23 NS(=O)C1CC(=O)C1 Amb32720658 [0,0,0,1,0,0|3,0,0]=4 1316 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,0,0,1,0,0|2,0,1]=4 1317 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,0,0,1,0,0|2,0,1]=4 1318 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,0,0,1,0,0|2,0,1]=4 1319 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,0,0,1,0,0|2,0,1]=4 1320 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,0,0,1,0,0|2,0,1]=4 1321 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,0,0,1,0,0|2,0,1]=4 1322 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,0|2,0,1]=4 1323 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,0,0,1,0,0|1,0,2]=4 1324 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,0,0,1,0,0|2,0,0]=3 1325 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,0,0,1,0,0|2,0,1]=4 1326 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,0,0,1,0,0|2,0,1]=4 1327 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,0,0,1,0,0|2,0,1]=4 1328 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,0,0,1,0,0|1,0,2]=4 1329 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,0,0,1,0,0|2,0,1]=4 1330 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,0,0,1,0,0|2,0,1]=4 1331 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,0,0,1,0,0|2,0,1]=4 1332 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,0,0,1,0,0|1,0,2]=4 1333 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [0,0,0,1,0,0|2,0,0]=3 1334 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,0,0,1,0,0|1,0,0]=2 1335 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,0,0,1,0,0|0,0,0]=1 1336 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,0,0,1,0,0|1,0,0]=2 1337 B8R1.23 O=C1CC(S(=O)Cl)C1 Amb32720949 [0,0,0,1,0,0|3,0,0]=4 1338 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [0,0,0,1,0,0|1,0,0]=2 1339 B8R1.23 O=C1CN(C(=O)Cl)C1 Amb32864114 [0,0,0,1,0,0|2,0,0]=3 1340 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,0,0,1,0,0|0,0,0]=1 1341 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,0,0,1,0,0|0,0,0]=1 1342 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [0,0,0,1,0,0|2,0,1]=4 1343 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,0,0,1,0,0|2,0,1]=4 1344 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,0,0,1,0,0|2,0,1]=4 1345 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,0|1,0,1]=3 1346 B8R1.35 CC(=O)NC[C@@H]1CO1 Amb27871512 [0,0,0,1,0,0|1,0,1]=3 1347 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,0|1,0,1]=3 1348 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,0|2,0,1]=4 1349 B8R1.35 CC(=O)OC[C@@H]1CO1 Amb27391694 [0,0,0,1,0,0|2,0,1]=4 1350 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,1]=4 1351 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,0,0,1,0,0|2,0,1]=4 1352 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,0,0,1,0,0|2,0,0]=3 1353 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,0,0,1,0,0|2,0,1]=4 1354 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,0,0,1,0,0|1,0,2]=4 1355 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,0,0,1,0,0|1,0,1]=3 1356 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,0,0,1,0,0|1,0,1]=3 1357 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,0,0,1,0,0|2,0,1]=4 1358 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,0,0,1,0,0|2,0,1]=4 1359 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,0|2,0,1]=4 1360 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,0,0,1,0,0|2,0,1]=4 1361 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,0,0,1,0,0|2,0,1]=4 1362 B8R1.51 CC1(C)CNC(=O)C1 Amb6752004 [0,0,0,1,0,0|2,0,1]=4 1363 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,0,0,1,0,0|2,0,1]=4 1364 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,0,0,1,0,0|2,0,1]=4 1365 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,0,0,1,0,0|1,0,1]=3 1366 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,0,0,1,0,0|2,0,1]=4 1367 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,0,0,1,0,0|2,0,1]=4 1368 B8R1.51 CC1(O)CNC(=O)C1 Amb2722777 [0,0,0,1,0,0|1,0,1]=3 1369 B8R1.51 CS1(=O)=NC(=O)CC1 Amb33483218 [0,0,0,1,0,0|3,0,0]=4 1370 B8R1.51 C[C@]1(O)CNC(=O)C1 Amb28253160 [0,0,0,1,0,0|1,0,1]=3 1371 B8R1.51 O=C1CC(F)(F)CN1 Amb26403154 [0,0,0,1,0,0|2,0,1]=4 1372 B8R1.51 O=C1CCS(=O)(=O)C1 Amb2373731 [0,0,0,1,0,0|2,0,1]=4 1373 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,0,0,1,0,0|3,0,0]=4 1374 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,0,0,1,0,0|2,0,1]=4 1375 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|2,0,1]=4 1376 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|2,0,1]=4 1377 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|2,0,1]=4 1378 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|2,0,1]=4 1379 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|2,0,1]=4 1380 B6R0.2 C=C(C)CC(=C)C Amb25887934 [0,0,0,0,1,0|3,0,0]=4 1381 B6R0.2 C=C(C)CC(=N)N Amb33199196 [0,0,0,0,1,0|3,0,0]=4 1382 B6R0.2 C=C(C)CC(=O)O Amb6278832 [0,0,0,0,1,0|1,0,0]=2 1383 B6R0.2 C=C(C)CC(C)=O Amb17593075 [0,0,0,0,1,0|2,0,0]=3 1384 B6R0.2 C=C(C)CC(C)O Amb17593083 [0,0,0,0,1,0|2,0,1]=4 1385 B6R0.2 C=C(C)CC(N)=S Amb33199195 [0,0,0,0,1,0|2,1,0]=4 1386 B6R0.2 C=C(C)CN(C)O Amb33199952 [0,0,0,0,1,0|3,0,0]=4 1387 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [0,0,0,0,1,0|2,0,1]=4 1388 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [0,0,0,0,1,0|2,0,1]=4 1389 B6R0.2 C=C(C)C[N+](=O)[O-] Amb33199532 [0,0,0,0,1,0|2,0,1]=4 1390 B6R0.2 C=C(C)OC(C)=O Amb6608981 [0,0,0,0,1,0|3,0,0]=4 1391 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [0,0,0,0,1,0|1,0,1]=3 1392 B6R0.2 C=C(Cl)NC(C)=N Amb28050130 [0,0,0,0,1,0|3,0,0]=4 1393 B6R0.2 C=C(I)CC(=O)O Amb27598435 [0,0,0,0,1,0|1,0,1]=3 1394 B6R0.2 C=C(N)NC(C)=O Amb27949916 [0,0,0,0,1,0|2,0,0]=3 1395 B6R0.2 CC(=O)C=C(C)C Amb2793052 [0,0,0,0,1,0|2,0,1]=4 1396 B6R0.2 CC(=O)C=C(N)N Amb27788295 [0,0,0,0,1,0|2,0,1]=4 1397 B6R0.2 CC(=O)CC(=O)F Amb28122452 [0,0,0,0,1,0|1,0,0]=2 1398 B6R0.2 CC(=O)CC(=O)O Amb377432 [0,0,0,0,1,0|0,0,0]=1 1399 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [0,0,0,0,1,0|0,0,1]=2 1400 B6R0.2 CC(=O)CC(C)=O Amb2716228 [0,0,0,0,1,0|1,0,0]=2 1401 B6R0.2 CC(=O)CC(C)=S Amb28381251 [0,0,0,0,1,0|1,1,0]=3 1402 B6R0.2 CC(=O)CC(C)C Amb4605990 [0,0,0,0,1,0|2,0,1]=4 1403 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [0,0,0,0,1,0|2,0,1]=4 1404 B6R0.2 CC(=O)CC(C)N Amb22587050 [0,0,0,0,1,0|2,0,1]=4 1405 B6R0.2 CC(=O)CC(C)N Amb2583230 [0,0,0,0,1,0|2,0,1]=4 1406 B6R0.2 CC(=O)CC(C)O Amb17593091 [0,0,0,0,1,0|1,0,1]=3 1407 B6R0.2 CC(=O)CC(C)S Amb24600676 [0,0,0,0,1,0|1,1,1]=4 1408 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,1,0|1,0,2]=4 1409 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,0,0,0,1,0|2,0,1]=4 1410 B6R0.2 CC(=O)CC(N)=O Amb6608777 [0,0,0,0,1,0|1,0,0]=2 1411 B6R0.2 CC(=O)CN(C)C Amb9217324 [0,0,0,0,1,0|3,0,0]=4 1412 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [0,0,0,0,1,0|2,0,1]=4 1413 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [0,0,0,0,1,0|2,0,1]=4 1414 B6R0.2 CC(=O)C[N+](=O)[O-] Amb18833135 [0,0,0,0,1,0|1,0,1]=3 1415 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [0,0,0,0,1,0|1,0,0]=2 1416 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [0,0,0,0,1,0|3,0,0]=4 1417 B6R0.2 CC(=O)NC(=N)N Amb2236591 [0,0,0,0,1,0|2,0,0]=3 1418 B6R0.2 CC(=O)NC(=N)N Amb22754056 [0,0,0,0,1,0|2,0,0]=3 1419 B6R0.2 CC(=O)NC(=S)S Amb27464461 [0,0,0,0,1,0|0,2,0]=3 1420 B6R0.2 CC(=O)NC(C)=O Amb4066511 [0,0,0,0,1,0|1,0,0]=2 1421 B6R0.2 CC(=O)NC(C)=S Amb28246616 [0,0,0,0,1,0|1,1,0]=3 1422 B6R0.2 CC(=O)NC(C)Br Amb27444682 [0,0,0,0,1,0|2,0,1]=4 1423 B6R0.2 CC(=O)NC(C)C Amb3366263 [0,0,0,0,1,0|2,0,1]=4 1424 B6R0.2 CC(=O)NC(C)N Amb27468729 [0,0,0,0,1,0|2,0,1]=4 1425 B6R0.2 CC(=O)NC(N)=O Amb6891959 [0,0,0,0,1,0|1,0,0]=2 1426 B6R0.2 CC(=O)NC(N)=S Amb10068733 [0,0,0,0,1,0|1,1,0]=3 1427 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,1,0|3,0,0]=4 1428 B6R0.2 CC(=O)OC(C)=O Amb2793035 [0,0,0,0,1,0|2,0,0]=3 1429 B6R0.2 CC(=O)OC(C)O Amb27457187 [0,0,0,0,1,0|2,0,1]=4 1430 B6R0.2 CC(=O)OC(N)=O Amb28283882 [0,0,0,0,1,0|2,0,0]=3 1431 B6R0.2 CC(=O)O[N+](=O)[O-] Amb27188405 [0,0,0,0,1,0|2,0,1]=4 1432 B6R0.2 CC(=O)SC(=O)Cl Amb32679653 [0,0,0,0,1,0|2,0,0]=3 1433 B6R0.2 CC(=O)SC(C)=O Amb4025813 [0,0,0,0,1,0|2,0,0]=3 1434 B6R0.2 CC(=O)SC(N)=S Amb27235614 [0,0,0,0,1,0|2,1,0]=4 1435 B6R0.2 CC(=O)[CH-]C(C)=O Amb34196937 [0,0,0,0,1,0|1,0,1]=3 1436 B6R0.2 CC(=O)[CH-]C(C)=O Amb9787378 [0,0,0,0,1,0|1,0,1]=3 1437 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [0,0,0,0,1,0|2,0,1]=4 1438 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [0,0,0,0,1,0|1,1,1]=4 1439 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [0,0,0,0,1,0|2,0,1]=4 1440 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [0,0,0,0,1,0|2,0,1]=4 1441 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [0,0,0,0,1,0|2,0,1]=4 1442 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [0,0,0,0,1,0|1,0,1]=3 1443 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [0,0,0,0,1,0|1,1,1]=4 1444 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [0,0,0,0,1,0|1,0,2]=4 1445 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [0,0,0,0,1,0|1,0,2]=4 1446 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [0,0,0,0,1,0|1,0,2]=4 1447 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [0,0,0,0,1,0|1,0,2]=4 1448 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [0,0,0,0,1,0|1,0,2]=4 1449 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [0,0,0,0,1,0|1,0,2]=4 1450 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [0,0,0,0,1,0|1,0,2]=4 1451 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [0,0,0,0,1,0|1,0,2]=4 1452 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [0,0,0,0,1,0|1,0,2]=4 1453 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [0,0,0,0,1,0|1,0,2]=4 1454 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [0,0,0,0,1,0|1,0,2]=4 1455 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [0,0,0,0,1,0|1,0,2]=4 1456 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [0,0,0,0,1,0|1,0,2]=4 1457 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [0,0,0,0,1,0|1,0,2]=4 1458 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [0,0,0,0,1,0|1,0,2]=4 1459 B6R0.2 CC(=O)\N=C(/C)N Amb27796085 [0,0,0,0,1,0|2,0,1]=4 1460 B6R0.2 CC(=S)CC(=O)O Amb28067768 [0,0,0,0,1,0|0,1,0]=2 1461 B6R0.2 CC(Br)CC(=O)O Amb8517108 [0,0,0,0,1,0|1,0,1]=3 1462 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [0,0,0,0,1,0|2,0,1]=4 1463 B6R0.2 CC(C)=CC(=O)O Amb1485519 [0,0,0,0,1,0|1,0,1]=3 1464 B6R0.2 CC(C)=CC(N)=O Amb10561758 [0,0,0,0,1,0|2,0,1]=4 1465 B6R0.2 CC(C)CC(=O)Br Amb26486664 [0,0,0,0,1,0|2,0,1]=4 1466 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [0,0,0,0,1,0|2,0,1]=4 1467 B6R0.2 CC(C)CC(=O)F Amb32667643 [0,0,0,0,1,0|2,0,1]=4 1468 B6R0.2 CC(C)CC(=O)O Amb3939848 [0,0,0,0,1,0|1,0,1]=3 1469 B6R0.2 CC(C)CC(N)=O Amb2722931 [0,0,0,0,1,0|2,0,1]=4 1470 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [0,0,0,0,1,0|2,0,1]=4 1471 B6R0.2 CC(C)NC(=O)S Amb27817487 [0,0,0,0,1,0|1,1,1]=4 1472 B6R0.2 CC(C)NC(N)=O Amb1104587 [0,0,0,0,1,0|2,0,1]=4 1473 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [0,0,0,0,1,0|2,0,1]=4 1474 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [0,0,0,0,1,0|1,0,1]=3 1475 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [0,0,0,0,1,0|2,0,1]=4 1476 B6R0.2 CC(I)CC(=O)O Amb28398380 [0,0,0,0,1,0|1,0,1]=3 1477 B6R0.2 CC(N)CC(=O)O Amb8379759 [0,0,0,0,1,0|1,0,1]=3 1478 B6R0.2 CC(N)CC(=O)S Amb27413857 [0,0,0,0,1,0|1,1,1]=4 1479 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,1]=4 1480 B6R0.2 CC(N)CC(N)=O Amb33532770 [0,0,0,0,1,0|2,0,1]=4 1481 B6R0.2 CC(O)CC(=O)O Amb8513187 [0,0,0,0,1,0|0,0,2]=3 1482 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [0,0,0,0,1,0|0,0,3]=4 1483 B6R0.2 CC(O)CC(N)=O Amb26394320 [0,0,0,0,1,0|1,0,2]=4 1484 B6R0.2 CC(O)CS(C)=O Amb28137235 [0,0,0,0,1,0|2,0,1]=4 1485 B6R0.2 CC(S)CC(=O)O Amb33538201 [0,0,0,0,1,0|0,1,1]=3 1486 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,1,0|3,0,0]=4 1487 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [0,0,0,0,1,0|3,0,0]=4 1488 B6R0.2 CN(C)CC(=O)O Amb3319051 [0,0,0,0,1,0|2,0,0]=3 1489 B6R0.2 CN(C)CC(=O)O Amb3940366 [0,0,0,0,1,0|2,0,0]=3 1490 B6R0.2 CN(C)CC(N)=O Amb17231806 [0,0,0,0,1,0|3,0,0]=4 1491 B6R0.2 CN(C)CC(N)=O Amb33321491 [0,0,0,0,1,0|3,0,0]=4 1492 B6R0.2 CN(C)NC(=O)Cl Amb35637051 [0,0,0,0,1,0|3,0,0]=4 1493 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,1,0|3,0,0]=4 1494 B6R0.2 CN(N)CC(=O)O Amb23592296 [0,0,0,0,1,0|2,0,0]=3 1495 B6R0.2 CN(O)CC(=O)O Amb29838290 [0,0,0,0,1,0|1,0,1]=3 1496 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,1,0|2,0,0]=3 1497 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [0,0,0,0,1,0|1,0,1]=3 1498 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [0,0,0,0,1,0|1,0,1]=3 1499 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [0,0,0,0,1,0|1,0,1]=3 1500 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [0,0,0,0,1,0|1,0,1]=3 1501 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [0,0,0,0,1,0|0,0,2]=3 1502 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [0,0,0,0,1,0|0,0,3]=4 1503 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [0,0,0,0,1,0|2,0,1]=4 1504 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [0,0,0,0,1,0|1,0,1]=3 1505 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [0,0,0,0,1,0|1,0,1]=3 1506 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [0,0,0,0,1,0|1,0,1]=3 1507 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [0,0,0,0,1,0|2,0,1]=4 1508 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [0,0,0,0,1,0|0,0,2]=3 1509 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,1,0|3,0,0]=4 1510 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [0,0,0,0,1,0|2,0,0]=3 1511 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [0,0,0,0,1,0|2,0,0]=3 1512 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [0,0,0,0,1,0|2,0,1]=4 1513 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [0,0,0,0,1,0|1,0,1]=3 1514 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [0,0,0,0,1,0|1,0,1]=3 1515 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [0,0,0,0,1,0|1,0,1]=3 1516 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [0,0,0,0,1,0|1,0,1]=3 1517 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [0,0,0,0,1,0|1,0,1]=3 1518 B6R0.2 C\C(I)=C\C(N)=O Amb28058366 [0,0,0,0,1,0|2,0,1]=4 1519 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [0,0,0,0,1,0|1,0,1]=3 1520 B6R0.2 C\C(N)=C/C(N)=O Amb26600164 [0,0,0,0,1,0|2,0,1]=4 1521 B6R0.2 C\C(S)=C\C(N)=O Amb27596108 [0,0,0,0,1,0|1,1,1]=4 1522 B6R0.2 N=C(N)CC(N)=O Amb1981332 [0,0,0,0,1,0|3,0,0]=4 1523 B6R0.2 N=C(N)CC(N)=O Amb5719691 [0,0,0,0,1,0|3,0,0]=4 1524 B6R0.2 N=C(N)NC(N)=O Amb33551043 [0,0,0,0,1,0|3,0,0]=4 1525 B6R0.2 N=C(N)NC(N)=O Amb6366465 [0,0,0,0,1,0|3,0,0]=4 1526 B6R0.2 N=C([NH3+])CC(N)=O Amb2439350 [0,0,0,0,1,0|3,0,0]=4 1527 B6R0.2 NC(=O)CC(=O)O Amb4034884 [0,0,0,0,1,0|1,0,0]=2 1528 B6R0.2 NC(=O)CC(=O)[O-] Amb22263088 [0,0,0,0,1,0|1,0,1]=3 1529 B6R0.2 NC(=O)CC(N)=O Amb1971463 [0,0,0,0,1,0|2,0,0]=3 1530 B6R0.2 NC(=O)CC(N)=S Amb1155422 [0,0,0,0,1,0|2,1,0]=4 1531 B6R0.2 NC(=O)C[N+](=O)[O-] Amb1101925 [0,0,0,0,1,0|2,0,1]=4 1532 B6R0.2 NC(=O)NC(N)=O Amb6346179 [0,0,0,0,1,0|2,0,0]=3 1533 B6R0.2 NC(=O)N[N+](=O)[O-] Amb17672280 [0,0,0,0,1,0|2,0,1]=4 1534 B6R0.2 NC(=S)CC(=O)O Amb17465742 [0,0,0,0,1,0|1,1,0]=3 1535 B6R0.2 NC(N)=CC(=O)O Amb27618962 [0,0,0,0,1,0|2,0,1]=4 1536 B6R0.2 NC(S)CC(=O)O Amb27391244 [0,0,0,0,1,0|1,1,1]=4 1537 B6R0.2 O=C(Cl)CC(=O)Cl Amb3940237 [0,0,0,0,1,0|2,0,0]=3 1538 B6R0.2 O=C(O)C=C(Br)Br Amb24435008 [0,0,0,0,1,0|2,0,1]=4 1539 B6R0.2 O=C(O)C=C(Cl)Cl Amb33544334 [0,0,0,0,1,0|2,0,1]=4 1540 B6R0.2 O=C(O)C=C(F)F Amb24116995 [0,0,0,0,1,0|2,0,1]=4 1541 B6R0.2 O=C(O)CB(O)O Amb24053058 [0,0,0,0,1,0|2,0,1]=4 1542 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [0,0,0,0,1,0|1,0,0]=2 1543 B6R0.2 O=C(O)CC(=O)O Amb2689065 [0,0,0,0,1,0|1,0,0]=2 1544 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [0,0,0,0,1,0|2,0,1]=4 1545 B6R0.2 O=C(O)CC(F)F Amb22001551 [0,0,0,0,1,0|2,0,1]=4 1546 B6R0.2 O=C(O)CS(=O)O Amb27788997 [0,0,0,0,1,0|2,0,0]=3 1547 B6R0.2 O=C(O)\C=C(\Cl)Br Amb27955839 [0,0,0,0,1,0|2,0,1]=4 1548 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516686 [0,0,0,0,1,0|1,0,1]=3 1549 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516816 [0,0,0,0,1,0|1,0,1]=3 1550 B6R0.2 O=C([O-])C[N+](=O)[O-] Amb28990930 [0,0,0,0,1,0|2,0,1]=4 1551 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,0,0,0,0,1|2,0,0]=3 1552 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,0,0,0,0,1|3,0,0]=4 1553 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,0,0,0,0,1|3,0,0]=4 1554 B8R0.28 C=C(C)CCNC(C)=O Amb27780923 [0,0,0,0,0,1|2,0,0]=3 1555 B8R0.28 C=C(C)CCOC(C)=O Amb4035107 [0,0,0,0,0,1|3,0,0]=4 1556 B8R0.28 C=C(C)CNCC(=C)Br Amb28422635 [0,0,0,0,0,1|3,0,0]=4 1557 B8R0.28 C=C(C)CNCC(=C)C Amb4032914 [0,0,0,0,0,1|3,0,0]=4 1558 B8R0.28 C=C(C)CNC[C@H](C)O Amb27852384 [0,0,0,0,0,1|2,0,1]=4 1559 B8R0.28 C=C(C)CNN=C(C)C Amb27768685 [0,0,0,0,0,1|3,0,0]=4 1560 B8R0.28 C=C(C)CONC(C)=O Amb27813952 [0,0,0,0,0,1|2,0,0]=3 1561 B8R0.28 C=C(C)CONC(N)=O Amb27956555 [0,0,0,0,0,1|3,0,0]=4 1562 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,0,0,0,0,1|2,0,0]=3 1563 B8R0.28 C=C(C)CSCC(C)=O Amb27877304 [0,0,0,0,0,1|3,0,0]=4 1564 B8R0.28 C=C(C)C\C=C\C(=O)O Amb27602149 [0,0,0,0,0,1|2,0,1]=4 1565 B8R0.28 C=C(C)\C=C\CC(=O)O Amb18642409 [0,0,0,0,0,1|2,0,0]=3 1566 B8R0.28 C=C(C)\C=C\CC(C)=O Amb24744667 [0,0,0,0,0,1|3,0,0]=4 1567 B8R0.28 C=C(Cl)CSCC(C)=O Amb28205790 [0,0,0,0,0,1|3,0,0]=4 1568 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,0,0,0,0,1|2,0,1]=4 1569 B8R0.28 CC(=N)NCCC(N)=O Amb28049611 [0,0,0,0,0,1|2,0,0]=3 1570 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,1|3,0,0]=4 1571 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,0,0,0,0,1|3,0,0]=4 1572 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,1|1,0,0]=2 1573 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,0,0,0,0,1|2,0,0]=3 1574 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,1|2,0,0]=3 1575 B8R0.28 CC(=O)CCC[N+](=O)[O-] Amb18203187 [0,0,0,0,0,1|2,0,1]=4 1576 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [0,0,0,0,0,1|1,0,0]=2 1577 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,0,0,0,0,1|2,0,1]=4 1578 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,0,0,0,0,1|3,0,0]=4 1579 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [0,0,0,0,0,1|2,0,0]=3 1580 B8R0.28 CC(=O)CC\C=C(\C)Cl Amb17593664 [0,0,0,0,0,1|3,0,0]=4 1581 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,0,0,0,0,1|2,0,1]=4 1582 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,0,0,0,0,1|2,0,1]=4 1583 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,0,0,0,0,1|1,0,1]=3 1584 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,0,0,0,0,1|1,0,0]=2 1585 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [0,0,0,0,0,1|1,0,1]=3 1586 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,0,0,0,0,1|2,0,1]=4 1587 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,0,0,0,0,1|2,0,0]=3 1588 B8R0.28 CC(=O)NCC=C(C)C Amb26606550 [0,0,0,0,0,1|2,0,0]=3 1589 B8R0.28 CC(=O)NCC=C(Cl)Cl Amb30011085 [0,0,0,0,0,1|2,0,0]=3 1590 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,0,0,0,0,1|0,0,0]=1 1591 B8R0.28 CC(=O)NCCC(C)Cl Amb27952422 [0,0,0,0,0,1|2,0,1]=4 1592 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,0,0,0,0,1|1,0,0]=2 1593 B8R0.28 CC(=O)NCCC(N)=S Amb17232012 [0,0,0,0,0,1|1,1,0]=3 1594 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [0,0,0,0,0,1|1,0,0]=2 1595 B8R0.28 CC(=O)NCNC(C)=O Amb8485453 [0,0,0,0,0,1|1,0,0]=2 1596 B8R0.28 CC(=O)NCOC(C)=O Amb27810126 [0,0,0,0,0,1|1,0,0]=2 1597 B8R0.28 CC(=O)NOCC(=O)O Amb25921073 [0,0,0,0,0,1|0,0,0]=1 1598 B8R0.28 CC(=O)N\C=C/C(C)=S Amb27472902 [0,0,0,0,0,1|1,1,1]=4 1599 B8R0.28 CC(=O)N\C=C\C(C)=S Amb27229569 [0,0,0,0,0,1|1,1,1]=4 1600 B8R0.28 CC(=O)OCC=C(C)C Amb22002433 [0,0,0,0,0,1|3,0,0]=4 1601 B8R0.28 CC(=O)OCC=C(F)F Amb16186005 [0,0,0,0,0,1|3,0,0]=4 1602 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,0,0,0,0,1|1,0,0]=2 1603 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,0,0,0,0,1|2,0,1]=4 1604 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,0,0,0,0,1|2,0,0]=3 1605 B8R0.28 CC(=O)OCCS(=O)Cl Amb32720402 [0,0,0,0,0,1|3,0,0]=4 1606 B8R0.28 CC(=O)OCCS(=O)[O-] Amb32754519 [0,0,0,0,0,1|2,0,1]=4 1607 B8R0.28 CC(=O)OCCS(N)=O Amb32720403 [0,0,0,0,0,1|3,0,0]=4 1608 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,0,0,0,0,1|2,0,1]=4 1609 B8R0.28 CC(=O)OCOC(=O)Cl Amb26908239 [0,0,0,0,0,1|2,0,0]=3 1610 B8R0.28 CC(=O)OCOC(C)=O Amb9787622 [0,0,0,0,0,1|2,0,0]=3 1611 B8R0.28 CC(=O)O[Cd]OC(C)=O Amb22350451 [0,0,0,0,0,1|3,0,0]=4 1612 B8R0.28 CC(=O)O[Cu]OC(C)=O Amb22052496 [0,0,0,0,0,1|3,0,0]=4 1613 B8R0.28 CC(=O)O[Cu]OC(C)=O Amb22338197 [0,0,0,0,0,1|3,0,0]=4 1614 B8R0.28 CC(=O)O[Fe]OC(C)=O Amb22338217 [0,0,0,0,0,1|3,0,0]=4 1615 B8R0.28 CC(=O)O[Ni]OC(C)=O Amb22051702 [0,0,0,0,0,1|3,0,0]=4 1616 B8R0.28 CC(=O)O[Pd]OC(C)=O Amb13890307 [0,0,0,0,0,1|3,0,0]=4 1617 B8R0.28 CC(=O)O[Sr]OC(C)=O Amb22348499 [0,0,0,0,0,1|3,0,0]=4 1618 B8R0.28 CC(=O)O[Zn]OC(C)=O Amb22351898 [0,0,0,0,0,1|3,0,0]=4 1619 B8R0.28 CC(=O)O\N=C/C(=O)O Amb27593741 [0,0,0,0,0,1|0,0,2]=3 1620 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,1|3,0,0]=4 1621 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [0,0,0,0,0,1|2,0,0]=3 1622 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,0,0,0,0,1|1,0,0]=2 1623 B8R0.28 CC(=O)S\C=C\C(=O)O Amb26969288 [0,0,0,0,0,1|1,0,1]=3 1624 B8R0.28 CC(=O)\C=C/C[N+](=O)[O-] Amb28322797 [0,0,0,0,0,1|2,0,1]=4 1625 B8R0.28 CC(=O)\C=C/OC(C)=O Amb28364680 [0,0,0,0,0,1|2,0,1]=4 1626 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [0,0,0,0,0,1|1,0,0]=2 1627 B8R0.28 CC(=O)\C=C\C[N+](=O)[O-] Amb27444805 [0,0,0,0,0,1|2,0,1]=4 1628 B8R0.28 CC(=O)\C=N\OC(C)=O Amb27788385 [0,0,0,0,0,1|1,0,2]=4 1629 B8R0.28 CC(=O)\N=C\NC(C)=O Amb24541273 [0,0,0,0,0,1|1,0,1]=3 1630 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,0,0,0,0,1|2,0,0]=3 1631 B8R0.28 CC(C)=C\C=C\C(=O)O Amb18642414 [0,0,0,0,0,1|2,0,1]=4 1632 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,0,0,0,0,1|1,0,0]=2 1633 B8R0.28 CC(C)=NOCC(=O)Cl Amb27466545 [0,0,0,0,0,1|2,0,1]=4 1634 B8R0.28 CC(C)=NOCC(N)=O Amb27613522 [0,0,0,0,0,1|2,0,1]=4 1635 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,0,0,0,0,1|2,0,1]=4 1636 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,0,0,0,0,1|2,0,1]=4 1637 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,0,0,0,0,1|1,0,1]=3 1638 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,0,0,0,0,1|1,0,1]=3 1639 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,0,0,0,0,1|2,0,1]=4 1640 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,0,0,0,0,1|2,0,1]=4 1641 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,0,0,0,0,1|2,0,1]=4 1642 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,0,0,0,0,1|2,0,1]=4 1643 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,0,0,0,0,1|1,0,1]=3 1644 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,0,0,0,0,1|1,0,1]=3 1645 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,0,0,0,0,1|2,0,1]=4 1646 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,0,0,0,0,1|2,0,1]=4 1647 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,0,0,0,0,1|2,0,1]=4 1648 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,0,0,0,0,1|2,0,1]=4 1649 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,0,0,0,0,1|2,0,1]=4 1650 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,0,0,0,0,1|2,0,1]=4 1651 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,0,0,0,0,1|2,0,1]=4 1652 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,0,0,0,0,1|2,0,1]=4 1653 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,0,0,0,0,1|2,0,1]=4 1654 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,0,0,0,0,1|1,0,2]=4 1655 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,0,0,0,0,1|0,0,2]=3 1656 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,0,0,0,0,1|0,0,3]=4 1657 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,0,0,0,0,1|1,0,2]=4 1658 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,0,0,0,0,1|1,0,2]=4 1659 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,0,0,0,0,1|3,0,0]=4 1660 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,0,0,0,0,1|3,0,0]=4 1661 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,0,0,0,0,1|3,0,0]=4 1662 B8R0.28 CS(=O)CCNC(=O)Cl Amb35633190 [0,0,0,0,0,1|3,0,0]=4 1663 B8R0.28 CS(=O)NCC=C(Cl)Cl Amb35690526 [0,0,0,0,0,1|3,0,0]=4 1664 B8R0.28 CS(=O)NOCC(N)=O Amb28075566 [0,0,0,0,0,1|2,0,0]=3 1665 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,0,0,0,0,1|2,0,1]=4 1666 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,0,0,0,0,1|1,0,2]=4 1667 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,0,0,0,0,1|3,0,0]=4 1668 B8R0.28 C\C(Cl)=C/CNC(N)=O Amb27252067 [0,0,0,0,0,1|3,0,0]=4 1669 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [0,0,0,0,0,1|3,0,0]=4 1670 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [0,0,0,0,0,1|2,0,0]=3 1671 B8R0.28 N=C(N)NCCC(N)=O Amb27215299 [0,0,0,0,0,1|3,0,0]=4 1672 B8R0.28 N=C(N)NCCS(=O)O Amb25103204 [0,0,0,0,0,1|3,0,0]=4 1673 B8R0.28 N=C(N)NNCC(=O)O Amb27394477 [0,0,0,0,0,1|2,0,0]=3 1674 B8R0.28 N=C(N)NOCC(=O)O Amb27165927 [0,0,0,0,0,1|2,0,0]=3 1675 B8R0.28 N=C(N)N\N=C\C(=O)O Amb33755273 [0,0,0,0,0,1|2,0,1]=4 1676 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [0,0,0,0,0,1|3,0,0]=4 1677 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,0,0,0,0,1|2,0,0]=3 1678 B8R0.28 NC(=O)CCSC(N)=O Amb28045967 [0,0,0,0,0,1|3,0,0]=4 1679 B8R0.28 NC(=O)CNCC(N)=O Amb6714597 [0,0,0,0,0,1|2,0,0]=3 1680 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [0,0,0,0,0,1|2,0,0]=3 1681 B8R0.28 NC(=O)COCC(N)=O Amb4442013 [0,0,0,0,0,1|3,0,0]=4 1682 B8R0.28 NC(=O)CONC(N)=O Amb27172154 [0,0,0,0,0,1|2,0,0]=3 1683 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,1|2,0,0]=3 1684 B8R0.28 NC(=O)CSCC(N)=O Amb6374270 [0,0,0,0,0,1|3,0,0]=4 1685 B8R0.28 NC(=O)NCC=C(Cl)Cl Amb35690706 [0,0,0,0,0,1|3,0,0]=4 1686 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [0,0,0,0,0,1|1,0,0]=2 1687 B8R0.28 NC(=O)NOCC(=O)O Amb28285979 [0,0,0,0,0,1|1,0,0]=2 1688 B8R0.28 NC(=O)N\C=C/C(=O)O Amb28437236 [0,0,0,0,0,1|1,0,1]=3 1689 B8R0.28 NC(=O)N\C=C\C(=O)O Amb541061 [0,0,0,0,0,1|1,0,1]=3 1690 B8R0.28 NC(=O)N\N=C\C(=O)O Amb10552378 [0,0,0,0,0,1|1,0,1]=3 1691 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [0,0,0,0,0,1|2,0,0]=3 1692 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,0,0,0,0,1|2,1,0]=4 1693 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [0,0,0,0,0,1|1,1,0]=3 1694 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [0,0,0,0,0,1|2,1,0]=4 1695 B8R0.28 O=C(Cl)CCCC(=O)Cl Amb3940242 [0,0,0,0,0,1|3,0,0]=4 1696 B8R0.28 O=C(Cl)COCC(=O)Cl Amb22228240 [0,0,0,0,0,1|3,0,0]=4 1697 B8R0.28 O=C(O)C=C=CC(=O)O Amb17593335 [0,0,0,0,0,1|2,0,1]=4 1698 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,0,0,0,0,1|2,0,0]=3 1699 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [0,0,0,0,0,1|3,0,0]=4 1700 B8R0.28 O=C(O)CCO[N+](=O)[O-] Amb21953424 [0,0,0,0,0,1|3,0,0]=4 1701 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,0,0,0,0,1|1,0,0]=2 1702 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,0,0,0,0,1|2,0,0]=3 1703 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,0,0,0,0,1|2,0,0]=3 1704 B8R0.28 O=C(O)\C=C/CC(=O)O Amb27882014 [0,0,0,0,0,1|2,0,0]=3 1705 B8R0.28 O=C(O)\C=C\CC(=O)O Amb1154189 [0,0,0,0,0,1|2,0,0]=3 1706 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [0,0,0,0,0,1|2,0,0]=3 1707 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|1,0,1]=4 1708 B5R0.1 C#CCC(=O)O Amb33532662 [2,0,0,0,0,0|0,0,2]=4 1709 B5R0.1 C=C(Br)CNC Amb18950247 [2,0,0,0,0,0|2,0,0]=4 1710 B5R0.1 C=C(C)CC=O Amb28202583 [2,0,0,0,0,0|1,0,0]=3 1711 B5R0.1 C=C(C)CCO Amb34916534 [2,0,0,0,0,0|1,0,1]=4 1712 B5R0.1 C=C(C)CCO Amb8513522 [2,0,0,0,0,0|1,0,1]=4 1713 B5R0.1 C=C(C)CNC Amb30625043 [2,0,0,0,0,0|2,0,0]=4 1714 B5R0.1 C=C(C)CNC Amb3941317 [2,0,0,0,0,0|2,0,0]=4 1715 B5R0.1 C=C(C)CNO Amb33199864 [2,0,0,0,0,0|2,0,0]=4 1716 B5R0.1 C=C(F)CNC Amb28194424 [2,0,0,0,0,0|2,0,0]=4 1717 B5R0.1 C=CCC(=C)C Amb22347764 [2,0,0,0,0,0|2,0,0]=4 1718 B5R0.1 C=CCC(=O)Cl Amb33543701 [2,0,0,0,0,0|1,0,1]=4 1719 B5R0.1 C=CCC(=O)O Amb3940098 [2,0,0,0,0,0|0,0,1]=3 1720 B5R0.1 C=CCC(C)=O Amb8396482 [2,0,0,0,0,0|1,0,0]=3 1721 B5R0.1 C=CCC(N)=O Amb17610156 [2,0,0,0,0,0|1,0,1]=4 1722 B5R0.1 C=CCS(=O)O Amb33534190 [2,0,0,0,0,0|1,0,1]=4 1723 B5R0.1 C=CC[PH](=O)O Amb8391287 [2,0,0,0,0,0|1,0,1]=4 1724 B5R0.1 C=CNC(C)=O Amb24323579 [2,0,0,0,0,0|0,0,1]=3 1725 B5R0.1 C=CNC(N)=O Amb25082241 [2,0,0,0,0,0|1,0,1]=4 1726 B5R0.1 C=COC(C)=O Amb8513382 [2,0,0,0,0,0|1,0,1]=4 1727 B5R0.1 C=NCC(N)=O Amb26548445 [2,0,0,0,0,0|1,0,1]=4 1728 B5R0.1 C=NNC(C)=O Amb29626225 [2,0,0,0,0,0|1,0,0]=3 1729 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 1730 B5R0.1 CC(=O)C=C=O Amb10603952 [2,0,0,0,0,0|0,0,2]=4 1731 B5R0.1 CC(=O)CC#N Amb1102132 [2,0,0,0,0,0|1,0,1]=4 1732 B5R0.1 CC(=O)CC=N Amb28285098 [2,0,0,0,0,0|1,0,0]=3 1733 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|1,0,1]=4 1734 B5R0.1 CC(=O)CCCl Amb2720823 [2,0,0,0,0,0|1,0,1]=4 1735 B5R0.1 CC(=O)CCF Amb26427773 [2,0,0,0,0,0|1,0,1]=4 1736 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|1,0,1]=4 1737 B5R0.1 CC(=O)CCN Amb33544540 [2,0,0,0,0,0|1,0,1]=4 1738 B5R0.1 CC(=O)CCO Amb836357 [2,0,0,0,0,0|0,0,1]=3 1739 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [2,0,0,0,0,0|1,0,1]=4 1740 B5R0.1 CC(=O)CNO Amb28049954 [2,0,0,0,0,0|1,0,0]=3 1741 B5R0.1 CC(=O)CSN Amb28430346 [2,0,0,0,0,0|2,0,0]=4 1742 B5R0.1 CC(=O)N=C=O Amb17231800 [2,0,0,0,0,0|0,0,2]=4 1743 B5R0.1 CC(=O)N=S=O Amb9786964 [2,0,0,0,0,0|1,0,1]=4 1744 B5R0.1 CC(=O)NC=O Amb27850191 [2,0,0,0,0,0|0,0,0]=2 1745 B5R0.1 CC(=O)NCO Amb8516057 [2,0,0,0,0,0|0,0,0]=2 1746 B5R0.1 CC(=O)OC=O Amb25283525 [2,0,0,0,0,0|1,0,0]=3 1747 B5R0.1 CC(=O)OCBr Amb3941481 [2,0,0,0,0,0|2,0,0]=4 1748 B5R0.1 CC(=O)OCCl Amb33542858 [2,0,0,0,0,0|2,0,0]=4 1749 B5R0.1 CC(=O)OCI Amb25226851 [2,0,0,0,0,0|2,0,0]=4 1750 B5R0.1 CC(=O)SCBr Amb25349900 [2,0,0,0,0,0|2,0,0]=4 1751 B5R0.1 CC(=O)SCI Amb33339258 [2,0,0,0,0,0|2,0,0]=4 1752 B5R0.1 CC(=O)SCO Amb27255261 [2,0,0,0,0,0|1,0,0]=3 1753 B5R0.1 CC(=O)\C=C/N Amb25147403 [2,0,0,0,0,0|1,0,1]=4 1754 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [2,0,0,0,0,0|0,0,2]=4 1755 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [2,0,0,0,0,0|1,0,1]=4 1756 B5R0.1 CC(=O)\C=C\N Amb8395283 [2,0,0,0,0,0|1,0,1]=4 1757 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [2,0,0,0,0,0|0,0,2]=4 1758 B5R0.1 CC(=O)\C=N/O Amb26474151 [2,0,0,0,0,0|1,0,1]=4 1759 B5R0.1 CC(=O)\C=N\O Amb33719017 [2,0,0,0,0,0|1,0,1]=4 1760 B5R0.1 CC(=O)\C=N\O Amb8395285 [2,0,0,0,0,0|1,0,1]=4 1761 B5R0.1 CC(C)=CC=O Amb8385061 [2,0,0,0,0,0|1,0,1]=4 1762 B5R0.1 CC(C)=CCO Amb4605830 [2,0,0,0,0,0|2,0,0]=4 1763 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|1,0,1]=4 1764 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|1,0,1]=4 1765 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,1]=4 1766 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|0,0,2]=4 1767 B5R0.1 CC(O)NC=O Amb28049622 [2,0,0,0,0,0|0,0,2]=4 1768 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,1]=4 1769 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,1]=4 1770 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,1]=3 1771 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,2]=4 1772 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,1]=4 1773 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,1]=4 1774 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,1]=4 1775 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|1,0,1]=4 1776 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|0,0,1]=3 1777 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|1,0,1]=4 1778 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,1]=4 1779 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|1,0,1]=4 1780 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|2,0,0]=4 1781 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|2,0,0]=4 1782 B5R0.1 CN(C)NC=O Amb1930732 [2,0,0,0,0,0|2,0,0]=4 1783 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|0,0,0]=2 1784 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|0,0,0]=2 1785 B5R0.1 CNCC(=O)[O-] Amb20246714 [2,0,0,0,0,0|0,0,1]=3 1786 B5R0.1 CNCC(C)=O Amb17621974 [2,0,0,0,0,0|1,0,0]=3 1787 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|1,0,0]=3 1788 B5R0.1 CNCC(C)O Amb32666238 [2,0,0,0,0,0|1,0,1]=4 1789 B5R0.1 CNCC(C)O Amb9247471 [2,0,0,0,0,0|1,0,1]=4 1790 B5R0.1 CNCC(N)=O Amb19134307 [2,0,0,0,0,0|1,0,0]=3 1791 B5R0.1 CNCC(N)=O Amb3940074 [2,0,0,0,0,0|1,0,0]=3 1792 B5R0.1 CNCC(N)=O Amb9151172 [2,0,0,0,0,0|1,0,0]=3 1793 B5R0.1 CNC[C@@H](C)O Amb26972484 [2,0,0,0,0,0|1,0,1]=4 1794 B5R0.1 CNC[C@@H](C)O Amb32652763 [2,0,0,0,0,0|1,0,1]=4 1795 B5R0.1 CNC[C@H](C)O Amb27596614 [2,0,0,0,0,0|1,0,1]=4 1796 B5R0.1 CNC[C@H](C)O Amb32652861 [2,0,0,0,0,0|1,0,1]=4 1797 B5R0.1 CNOC(N)=O Amb28341734 [2,0,0,0,0,0|2,0,0]=4 1798 B5R0.1 COCC(=O)Cl Amb3939326 [2,0,0,0,0,0|2,0,0]=4 1799 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,0]=3 1800 B5R0.1 COCC(C)=O Amb8513767 [2,0,0,0,0,0|2,0,0]=4 1801 B5R0.1 COCC(N)=O Amb1153776 [2,0,0,0,0,0|2,0,0]=4 1802 B5R0.1 CONC(C)=O Amb25046114 [2,0,0,0,0,0|1,0,1]=4 1803 B5R0.1 CONC(N)=O Amb2417193 [2,0,0,0,0,0|2,0,0]=4 1804 B5R0.1 CS(=O)CCO Amb28075364 [2,0,0,0,0,0|1,0,1]=4 1805 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 1806 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 1807 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 1808 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 1809 B5R0.1 CSNC(C)=O Amb22500292 [2,0,0,0,0,0|1,0,1]=4 1810 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|0,0,2]=4 1811 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [2,0,0,0,0,0|1,0,1]=4 1812 B5R0.1 C\C(Br)=C/C=O Amb27202112 [2,0,0,0,0,0|1,0,1]=4 1813 B5R0.1 C\C(Br)=C/CO Amb30621790 [2,0,0,0,0,0|2,0,0]=4 1814 B5R0.1 C\C(Br)=C\C=O Amb27201671 [2,0,0,0,0,0|1,0,1]=4 1815 B5R0.1 C\C(Cl)=C\CO Amb25663061 [2,0,0,0,0,0|2,0,0]=4 1816 B5R0.1 C\C(I)=C/CO Amb17616110 [2,0,0,0,0,0|2,0,0]=4 1817 B5R0.1 C\C(I)=C\CO Amb30621783 [2,0,0,0,0,0|2,0,0]=4 1818 B5R0.1 C\C(N)=C/C=O Amb2612039 [2,0,0,0,0,0|1,0,1]=4 1819 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,1]=3 1820 B5R0.1 C\C=C/C(C)=O Amb28351405 [2,0,0,0,0,0|1,0,1]=4 1821 B5R0.1 C\C=C\C(=O)Br Amb25026006 [2,0,0,0,0,0|1,0,1]=4 1822 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [2,0,0,0,0,0|1,0,1]=4 1823 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,1]=3 1824 B5R0.1 C\C=C\C(C)=O Amb33941980 [2,0,0,0,0,0|1,0,1]=4 1825 B5R0.1 C\C=C\C(N)=O Amb4025906 [2,0,0,0,0,0|1,0,1]=4 1826 B5R0.1 N#CCC(=O)O Amb2609022 [2,0,0,0,0,0|1,0,1]=4 1827 B5R0.1 N=C(N)NC=O Amb4020732 [2,0,0,0,0,0|2,0,0]=4 1828 B5R0.1 NC(=O)CC=O Amb25777522 [2,0,0,0,0,0|1,0,0]=3 1829 B5R0.1 NC(=O)CCO Amb9421407 [2,0,0,0,0,0|1,0,1]=4 1830 B5R0.1 NC(=O)CNCl Amb28315673 [2,0,0,0,0,0|2,0,0]=4 1831 B5R0.1 NC(=O)NC=O Amb8514974 [2,0,0,0,0,0|1,0,0]=3 1832 B5R0.1 NC(=O)NCO Amb17674341 [2,0,0,0,0,0|1,0,0]=3 1833 B5R0.1 NC(=S)NCO Amb27461395 [2,0,0,0,0,0|1,1,0]=4 1834 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,1]=4 1835 B5R0.1 NNCC(=O)O Amb32751165 [2,0,0,0,0,0|1,0,0]=3 1836 B5R0.1 NNCC(=O)O Amb6740299 [2,0,0,0,0,0|1,0,0]=3 1837 B5R0.1 NNCC(N)=O Amb32990162 [2,0,0,0,0,0|2,0,0]=4 1838 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 1839 B5R0.1 NOCC(=O)O Amb4324355 [2,0,0,0,0,0|2,0,0]=4 1840 B5R0.1 NOCC(=O)O Amb8513076 [2,0,0,0,0,0|2,0,0]=4 1841 B5R0.1 N\C=C\C(=O)O Amb27217920 [2,0,0,0,0,0|1,0,1]=4 1842 B5R0.1 O=C(Cl)CCO Amb27270014 [2,0,0,0,0,0|1,0,1]=4 1843 B5R0.1 O=C(Cl)NCCl Amb28315820 [2,0,0,0,0,0|2,0,0]=4 1844 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,1]=4 1845 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,1]=4 1846 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,1]=4 1847 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,1]=4 1848 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|0,0,2]=4 1849 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|0,1,1]=4 1850 B5R0.1 O=C(O)CNO Amb24120360 [2,0,0,0,0,0|0,0,1]=3 1851 B5R0.1 O=C(O)\C=C/Br Amb18644453 [2,0,0,0,0,0|1,0,1]=4 1852 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [2,0,0,0,0,0|1,0,1]=4 1853 B5R0.1 O=C(O)\C=C/I Amb28315824 [2,0,0,0,0,0|1,0,1]=4 1854 B5R0.1 O=C(O)\C=C\Br Amb27423608 [2,0,0,0,0,0|1,0,1]=4 1855 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [2,0,0,0,0,0|1,0,1]=4 1856 B5R0.1 O=C(O)\C=C\I Amb30584673 [2,0,0,0,0,0|1,0,1]=4 1857 B5R0.1 O=C(O)\C=C\O Amb26055842 [2,0,0,0,0,0|0,0,2]=4 1858 B5R0.1 O=C(O)\C=C\S Amb28401590 [2,0,0,0,0,0|0,1,1]=4 1859 B5R0.1 O=C([O-])CCO Amb22055495 [2,0,0,0,0,0|1,0,1]=4 1860 B5R0.1 O=C([O-])NCCl Amb27777248 [2,0,0,0,0,0|2,0,0]=4 1861 B5R0.1 O=CCB(O)O Amb27449470 [2,0,0,0,0,0|1,0,1]=4 1862 B5R0.1 O=CCC(=O)O Amb22169407 [2,0,0,0,0,0|0,0,0]=2 1863 B5R0.1 O=CCC(=O)[Na] Amb27949540 [2,0,0,0,0,0|1,0,0]=3 1864 B5R0.1 O=CC[N+](=O)[O-] Amb28049659 [2,0,0,0,0,0|1,0,1]=4 1865 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|1,0,1]=4 1866 B5R0.2 C=CCNC=C Amb28134893 [2,0,0,0,0,0|1,0,1]=4 1867 B5R0.2 C=CCNC=O Amb2781857 [2,0,0,0,0,0|1,0,0]=3 1868 B5R0.2 C=CCNCC Amb13951161 [2,0,0,0,0,0|1,0,1]=4 1869 B5R0.2 C=CCNCC Amb6683951 [2,0,0,0,0,0|1,0,1]=4 1870 B5R0.2 C=CC\C=C/C Amb26426294 [2,0,0,0,0,0|2,0,0]=4 1871 B5R0.2 CC#CCC=O Amb27850282 [2,0,0,0,0,0|1,0,1]=4 1872 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|1,0,1]=4 1873 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|0,0,2]=4 1874 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|0,0,2]=4 1875 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,1]=4 1876 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|2,0,0]=4 1877 B5R0.2 COCNC=O Amb28049834 [2,0,0,0,0,0|2,0,0]=4 1878 B5R0.2 CONCCO Amb27658816 [2,0,0,0,0,0|1,0,1]=4 1879 B5R0.2 CSCCC=O Amb3939952 [2,0,0,0,0,0|2,0,0]=4 1880 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|1,0,1]=4 1881 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|1,0,0]=3 1882 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|1,0,1]=4 1883 B5R0.2 O=CCCC=O Amb8395090 [2,0,0,0,0,0|1,0,0]=3 1884 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,1]=4 1885 B5R0.2 O=CCNC=O Amb26370295 [2,0,0,0,0,0|0,0,0]=2 1886 B5R0.2 O=CC\C=C\Cl Amb24571938 [2,0,0,0,0,0|2,0,0]=4 1887 B5R0.2 O=CNCCF Amb28205988 [2,0,0,0,0,0|1,0,1]=4 1888 B5R0.2 O=CNNC=O Amb6298322 [2,0,0,0,0,0|1,0,0]=3 1889 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|1,0,1]=4 1890 B5R0.2 O=C\C=C/C=O Amb28146767 [2,0,0,0,0,0|1,0,1]=4 1891 B5R0.2 O=C\C=C\C=O Amb17593019 [2,0,0,0,0,0|1,0,1]=4 1892 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [1,1,0,0,0,0|2,0,0]=4 1893 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|1,0,1]=4 1894 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,1,0,0,0,0|1,0,1]=4 1895 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [1,1,0,0,0,0|2,0,0]=4 1896 B7R0.2 C=CC(C)NC(C)=O Amb27236925 [1,1,0,0,0,0|1,0,0]=3 1897 B7R0.2 C=CC(C)NC(C)=S Amb28042545 [1,1,0,0,0,0|1,1,0]=4 1898 B7R0.2 C=CC(C)OC(C)=O Amb4016456 [1,1,0,0,0,0|2,0,0]=4 1899 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [1,1,0,0,0,0|1,0,1]=4 1900 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [1,1,0,0,0,0|1,0,1]=4 1901 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [1,1,0,0,0,0|1,0,1]=4 1902 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,1,0,0,0,0|1,0,1]=4 1903 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [1,1,0,0,0,0|1,0,1]=4 1904 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,1,0,0,0,0|1,0,1]=4 1905 B7R0.2 CC(=O)CC(N)CO Amb27240210 [1,1,0,0,0,0|1,0,1]=4 1906 B7R0.2 CC(=O)CN(C)N=O Amb27488722 [1,1,0,0,0,0|2,0,0]=4 1907 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,1,0,0,0,0|1,0,0]=3 1908 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,1,0,0,0,0|1,0,0]=3 1909 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [1,1,0,0,0,0|1,0,1]=4 1910 B7R0.2 CC(=O)NC(C)C#N Amb17399792 [1,1,0,0,0,0|1,0,1]=4 1911 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [1,1,0,0,0,0|1,0,1]=4 1912 B7R0.2 CC(=O)NC(C)CO Amb9276356 [1,1,0,0,0,0|0,0,1]=3 1913 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [1,1,0,0,0,0|1,0,1]=4 1914 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [1,1,0,0,0,0|0,0,1]=3 1915 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [1,1,0,0,0,0|0,0,0]=2 1916 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [1,1,0,0,0,0|0,0,1]=3 1917 B7R0.2 CC(=O)N\C(C)=C/S Amb27437872 [1,1,0,0,0,0|0,1,1]=4 1918 B7R0.2 CC(=O)N\C(C)=C\S Amb28384532 [1,1,0,0,0,0|0,1,1]=4 1919 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [1,1,0,0,0,0|1,0,0]=3 1920 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [1,1,0,0,0,0|1,0,0]=3 1921 B7R0.2 CC(=O)\C=C(/C)C=O Amb27607120 [1,1,0,0,0,0|1,0,1]=4 1922 B7R0.2 CC(=O)\C=C(\C)C=O Amb18641689 [1,1,0,0,0,0|1,0,1]=4 1923 B7R0.2 CC(CO)NS(C)=O Amb28286003 [1,1,0,0,0,0|1,0,1]=4 1924 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|1,0,1]=4 1925 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|1,0,1]=4 1926 B7R0.2 CCC(C)NC(C)=O Amb3358085 [1,1,0,0,0,0|1,0,1]=4 1927 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|1,0,1]=4 1928 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|1,0,1]=4 1929 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|1,0,1]=4 1930 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|0,0,1]=3 1931 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|0,0,1]=3 1932 B7R0.2 CCN(C)CC(C)=O Amb8427987 [1,1,0,0,0,0|1,0,1]=4 1933 B7R0.2 CCN(C)CC(C)=O Amb9173327 [1,1,0,0,0,0|1,0,1]=4 1934 B7R0.2 CCN(C)CC(N)=O Amb27639873 [1,1,0,0,0,0|1,0,1]=4 1935 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|0,0,1]=3 1936 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,1]=4 1937 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|1,0,1]=4 1938 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|1,0,1]=4 1939 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|1,0,1]=4 1940 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|1,0,1]=4 1941 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|1,0,1]=4 1942 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|1,0,1]=4 1943 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|1,0,1]=4 1944 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|1,0,1]=4 1945 B7R0.2 CN(C=O)CB(O)O Amb8392107 [1,1,0,0,0,0|1,0,1]=4 1946 B7R0.2 CN(C=O)CC(N)=O Amb27471534 [1,1,0,0,0,0|1,0,0]=3 1947 B7R0.2 CN(C=O)CC(N)=S Amb27963784 [1,1,0,0,0,0|1,1,0]=4 1948 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [1,1,0,0,0,0|1,0,0]=3 1949 B7R0.2 CN(CO)CC(=O)O Amb27663224 [1,1,0,0,0,0|0,0,2]=4 1950 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [1,1,0,0,0,0|2,0,0]=4 1951 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|2,0,0]=4 1952 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|2,0,0]=4 1953 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|2,0,0]=4 1954 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|2,0,0]=4 1955 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|2,0,0]=4 1956 B7R0.2 COC(C)NC(C)=O Amb27839138 [1,1,0,0,0,0|2,0,0]=4 1957 B7R0.2 CON(C)CC(=O)O Amb8010467 [1,1,0,0,0,0|1,0,0]=3 1958 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|2,0,0]=4 1959 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|2,0,0]=4 1960 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|2,0,0]=4 1961 B7R0.2 C[C@H](CO)NS(C)=O Amb27226913 [1,1,0,0,0,0|1,0,1]=4 1962 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [1,1,0,0,0,0|2,0,0]=4 1963 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [1,1,0,0,0,0|2,0,0]=4 1964 B7R0.2 C\C=C(\C)NC(C)=O Amb24468210 [1,1,0,0,0,0|1,0,1]=4 1965 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,1,0,0,0,0|1,0,0]=3 1966 B7R0.2 NC(=O)NC(=O)C=O Amb27964563 [1,1,0,0,0,0|1,0,1]=4 1967 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,1,0,0,0,0|1,0,0]=3 1968 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,1,0,0,0,0|1,0,0]=3 1969 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [1,1,0,0,0,0|2,0,0]=4 1970 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [1,1,0,0,0,0|0,0,0]=2 1971 B7R0.2 O=C\C(Cl)=C/C(=O)O Amb27852924 [1,1,0,0,0,0|1,0,1]=4 1972 B7R0.3 C#CC(=O)NCC=C Amb27838413 [1,1,0,0,0,0|1,0,1]=4 1973 B7R0.3 C#CC(=O)NCCO Amb9361227 [1,1,0,0,0,0|0,0,2]=4 1974 B7R0.3 C#CCNC(=O)CBr Amb22896612 [1,1,0,0,0,0|1,0,1]=4 1975 B7R0.3 C#CCNC(=O)CC Amb24271081 [1,1,0,0,0,0|1,0,1]=4 1976 B7R0.3 C#CCNC(=O)CCl Amb1157331 [1,1,0,0,0,0|1,0,1]=4 1977 B7R0.3 C#CCNC(=O)CI Amb24701966 [1,1,0,0,0,0|1,0,1]=4 1978 B7R0.3 C#CCNC(=O)CN Amb13951829 [1,1,0,0,0,0|1,0,1]=4 1979 B7R0.3 C#CCNC(=O)CN Amb6269640 [1,1,0,0,0,0|1,0,1]=4 1980 B7R0.3 C#CCNC(=O)NC Amb27631511 [1,1,0,0,0,0|1,0,1]=4 1981 B7R0.3 C#CCNC(=O)OC Amb26516332 [1,1,0,0,0,0|1,0,1]=4 1982 B7R0.3 C=C(C=O)C\C=C\C Amb26441086 [1,1,0,0,0,0|2,0,0]=4 1983 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,1,0,0,0,0|2,0,0]=4 1984 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [1,1,0,0,0,0|2,0,0]=4 1985 B7R0.3 C=CC(=O)NCCO Amb9361225 [1,1,0,0,0,0|0,0,2]=4 1986 B7R0.3 C=CCCC(=O)CBr Amb22059627 [1,1,0,0,0,0|2,0,0]=4 1987 B7R0.3 C=CCCC(=O)CC Amb9031676 [1,1,0,0,0,0|2,0,0]=4 1988 B7R0.3 C=CCCC(=O)CCl Amb22059504 [1,1,0,0,0,0|2,0,0]=4 1989 B7R0.3 C=CCCC(=O)CF Amb28074643 [1,1,0,0,0,0|2,0,0]=4 1990 B7R0.3 C=CCCC(=O)NC Amb25041195 [1,1,0,0,0,0|2,0,0]=4 1991 B7R0.3 C=CCCC(=O)NO Amb28205003 [1,1,0,0,0,0|1,0,1]=4 1992 B7R0.3 C=CCCC(=O)OC Amb2369959 [1,1,0,0,0,0|1,0,1]=4 1993 B7R0.3 C=CCNC(=N)NC Amb27461337 [1,1,0,0,0,0|2,0,0]=4 1994 B7R0.3 C=CCNC(=N)SC Amb26381808 [1,1,0,0,0,0|2,0,0]=4 1995 B7R0.3 C=CCNC(=O)C=C Amb9480567 [1,1,0,0,0,0|1,0,1]=4 1996 B7R0.3 C=CCNC(=O)CBr Amb2089072 [1,1,0,0,0,0|1,0,0]=3 1997 B7R0.3 C=CCNC(=O)CCl Amb1151297 [1,1,0,0,0,0|1,0,0]=3 1998 B7R0.3 C=CCNC(=O)CI Amb26023441 [1,1,0,0,0,0|1,0,0]=3 1999 B7R0.3 C=CCNC(=O)CN Amb21958702 [1,1,0,0,0,0|1,0,0]=3 2000 B7R0.3 C=CCNC(=O)CN Amb5783027 [1,1,0,0,0,0|1,0,0]=3 2001 B7R0.3 C=CCNC(=O)CO Amb33531863 [1,1,0,0,0,0|1,0,0]=3 2002 B7R0.3 C=CCNC(=O)NN Amb18559722 [1,1,0,0,0,0|2,0,0]=4 2003 B7R0.3 C=CCNC(=O)NO Amb28134073 [1,1,0,0,0,0|2,0,0]=4 2004 B7R0.3 C=CCNC(=O)OC Amb17794125 [1,1,0,0,0,0|1,0,0]=3 2005 B7R0.3 C=CCNC(=S)NC Amb6876259 [1,1,0,0,0,0|1,1,0]=4 2006 B7R0.3 C=CCNC(=S)OC Amb28250523 [1,1,0,0,0,0|1,1,0]=4 2007 B7R0.3 C=CCOC(=O)CC Amb22050537 [1,1,0,0,0,0|2,0,0]=4 2008 B7R0.3 C=CCOC(=O)CCl Amb8515844 [1,1,0,0,0,0|2,0,0]=4 2009 B7R0.3 C=CCOC(=O)CI Amb26593247 [1,1,0,0,0,0|2,0,0]=4 2010 B7R0.3 C=CCOC(=O)CN Amb18641828 [1,1,0,0,0,0|2,0,0]=4 2011 B7R0.3 C=CCOC(=O)CN Amb33734248 [1,1,0,0,0,0|2,0,0]=4 2012 B7R0.3 C=CCOC(=O)CS Amb27815024 [1,1,0,0,0,0|2,0,0]=4 2013 B7R0.3 C=CCOC(=O)OC Amb8515646 [1,1,0,0,0,0|2,0,0]=4 2014 B7R0.3 C=CCSC(=O)CC Amb22043318 [1,1,0,0,0,0|2,0,0]=4 2015 B7R0.3 C=CC\C=C(/C)C=O Amb18123725 [1,1,0,0,0,0|2,0,0]=4 2016 B7R0.3 CC#CCC(=O)OC Amb6336504 [1,1,0,0,0,0|1,0,1]=4 2017 B7R0.3 CC(CO)CNC=O Amb27482480 [1,1,0,0,0,0|1,0,1]=4 2018 B7R0.3 CC=C=CC(=O)OC Amb26575881 [1,1,0,0,0,0|1,0,1]=4 2019 B7R0.3 CCC(=O)NCC=O Amb17102054 [1,1,0,0,0,0|0,0,0]=2 2020 B7R0.3 CCC(=O)NCCCl Amb17103188 [1,1,0,0,0,0|1,0,1]=4 2021 B7R0.3 CCC(=O)NCCF Amb27972779 [1,1,0,0,0,0|1,0,1]=4 2022 B7R0.3 CCC(=O)NCCN Amb1137732 [1,1,0,0,0,0|1,0,1]=4 2023 B7R0.3 CCC(=O)NCCN Amb32434788 [1,1,0,0,0,0|1,0,1]=4 2024 B7R0.3 CCC(=O)NCCN Amb33741516 [1,1,0,0,0,0|1,0,1]=4 2025 B7R0.3 CCC(=O)NCCO Amb5797470 [1,1,0,0,0,0|0,0,1]=3 2026 B7R0.3 CCC(=O)NCCS Amb24505089 [1,1,0,0,0,0|0,1,1]=4 2027 B7R0.3 CCC(=O)NNC=O Amb27835377 [1,1,0,0,0,0|1,0,0]=3 2028 B7R0.3 CCC(=O)OCCO Amb27217859 [1,1,0,0,0,0|1,0,1]=4 2029 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [1,1,0,0,0,0|1,0,1]=4 2030 B7R0.3 CCC(=S)NCCO Amb27203312 [1,1,0,0,0,0|0,1,1]=4 2031 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|1,0,1]=4 2032 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|1,0,1]=4 2033 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|1,0,1]=4 2034 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|1,0,1]=4 2035 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|1,0,1]=4 2036 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|1,0,1]=4 2037 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|1,0,1]=4 2038 B7R0.3 CCCNC(=O)CN Amb426858 [1,1,0,0,0,0|1,0,1]=4 2039 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|1,0,1]=4 2040 B7R0.3 CCNCC(=O)NC Amb32680747 [1,1,0,0,0,0|1,0,1]=4 2041 B7R0.3 CCNCC(=O)NC Amb6251820 [1,1,0,0,0,0|1,0,1]=4 2042 B7R0.3 CCNCC(=O)NO Amb27755137 [1,1,0,0,0,0|0,0,1]=3 2043 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|0,0,1]=3 2044 B7R0.3 CCNCC(=O)OC Amb6687125 [1,1,0,0,0,0|0,0,1]=3 2045 B7R0.3 CCNC\C(N)=N\O Amb24612871 [1,1,0,0,0,0|1,0,1]=4 2046 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,1]=4 2047 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,1]=4 2048 B7R0.3 CCS(=O)NCCO Amb28437123 [1,1,0,0,0,0|1,0,1]=4 2049 B7R0.3 CCSCC(=O)OC Amb7753193 [1,1,0,0,0,0|1,0,1]=4 2050 B7R0.3 CN(CCC=O)N=O Amb17617679 [1,1,0,0,0,0|2,0,0]=4 2051 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,1]=4 2052 B7R0.3 CNC(=O)NCCCl Amb27148870 [1,1,0,0,0,0|1,0,1]=4 2053 B7R0.3 CNC(=O)NCCN Amb17231831 [1,1,0,0,0,0|1,0,1]=4 2054 B7R0.3 CNC(=O)NCCN Amb28934877 [1,1,0,0,0,0|1,0,1]=4 2055 B7R0.3 CNC(=O)NCCN Amb32663759 [1,1,0,0,0,0|1,0,1]=4 2056 B7R0.3 CNC(=O)NCCO Amb24376074 [1,1,0,0,0,0|0,0,1]=3 2057 B7R0.3 CNC(=O)NCCS Amb28350549 [1,1,0,0,0,0|0,1,1]=4 2058 B7R0.3 CNC(=O)OCCO Amb3939460 [1,1,0,0,0,0|1,0,1]=4 2059 B7R0.3 CNC(=S)NCCO Amb4303417 [1,1,0,0,0,0|0,1,1]=4 2060 B7R0.3 CNCCC(=O)NO Amb27763537 [1,1,0,0,0,0|2,0,0]=4 2061 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|2,0,0]=4 2062 B7R0.3 CNCCC(=O)OC Amb7969878 [1,1,0,0,0,0|2,0,0]=4 2063 B7R0.3 CNOCC(=O)OC Amb32662920 [1,1,0,0,0,0|2,0,0]=4 2064 B7R0.3 CNOCC(=O)OC Amb33067971 [1,1,0,0,0,0|2,0,0]=4 2065 B7R0.3 COC(=O)C#CC=O Amb27441102 [1,1,0,0,0,0|1,0,1]=4 2066 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,0]=3 2067 B7R0.3 COC(=O)CCSC Amb8393179 [1,1,0,0,0,0|2,0,0]=4 2068 B7R0.3 COC(=O)CN=C=O Amb3905407 [1,1,0,0,0,0|0,0,2]=4 2069 B7R0.3 COC(=O)CNC=O Amb22000868 [1,1,0,0,0,0|0,0,0]=2 2070 B7R0.3 COC(=O)CNC=S Amb27839121 [1,1,0,0,0,0|0,1,0]=3 2071 B7R0.3 COC(=O)C\C=C\Cl Amb28458363 [1,1,0,0,0,0|2,0,0]=4 2072 B7R0.3 COC(=O)NCC=O Amb27839038 [1,1,0,0,0,0|0,0,0]=2 2073 B7R0.3 COC(=O)NCCN Amb18970459 [1,1,0,0,0,0|1,0,1]=4 2074 B7R0.3 COC(=O)NCCN Amb28934803 [1,1,0,0,0,0|1,0,1]=4 2075 B7R0.3 COC(=O)NCCO Amb9285601 [1,1,0,0,0,0|0,0,1]=3 2076 B7R0.3 COC(=O)NCSC Amb28398191 [1,1,0,0,0,0|2,0,0]=4 2077 B7R0.3 COC(=O)OCC=O Amb28208420 [1,1,0,0,0,0|1,0,0]=3 2078 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [1,1,0,0,0,0|1,0,1]=4 2079 B7R0.3 COCCC(=O)OC Amb6296150 [1,1,0,0,0,0|2,0,0]=4 2080 B7R0.3 COCNC(=O)CF Amb28045827 [1,1,0,0,0,0|2,0,0]=4 2081 B7R0.3 COCNC(=O)OC Amb27253203 [1,1,0,0,0,0|2,0,0]=4 2082 B7R0.3 CONC\C(N)=N\O Amb28285234 [1,1,0,0,0,0|2,0,0]=4 2083 B7R0.3 CO[C@@H](C)CNC=O Amb35605354 [1,1,0,0,0,0|1,0,1]=4 2084 B7R0.3 CO[C@H](C)CNC=O Amb35605356 [1,1,0,0,0,0|1,0,1]=4 2085 B7R0.3 CO\C(C)=C\CC=O Amb28283269 [1,1,0,0,0,0|1,0,1]=4 2086 B7R0.3 CSC(=S)NCCO Amb25939436 [1,1,0,0,0,0|0,1,1]=4 2087 B7R0.3 C\C(C=O)=C/CC=O Amb27236148 [1,1,0,0,0,0|1,0,0]=3 2088 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,1,0,0,0,0|1,0,1]=4 2089 B7R0.3 C\C=C\CC(=N)NO Amb26582540 [1,1,0,0,0,0|2,0,0]=4 2090 B7R0.3 C\C=C\CC(=N)OC Amb28058157 [1,1,0,0,0,0|2,0,0]=4 2091 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [1,1,0,0,0,0|1,0,0]=3 2092 B7R0.3 C\C=C\NC(=O)NC Amb24585267 [1,1,0,0,0,0|1,0,1]=4 2093 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [1,1,0,0,0,0|1,0,1]=4 2094 B7R0.3 C\C=N\NC(=O)CCl Amb28345569 [1,1,0,0,0,0|2,0,0]=4 2095 B7R0.3 N#CCNC(=O)CBr Amb27626493 [1,1,0,0,0,0|1,0,1]=4 2096 B7R0.3 N#CCNC(=O)CCl Amb10608945 [1,1,0,0,0,0|1,0,1]=4 2097 B7R0.3 N#CCNC(=O)CN Amb32652935 [1,1,0,0,0,0|1,0,1]=4 2098 B7R0.3 N#CCNC(=O)CN Amb6274014 [1,1,0,0,0,0|1,0,1]=4 2099 B7R0.3 N=C(CCl)NCCO Amb28341725 [1,1,0,0,0,0|1,0,1]=4 2100 B7R0.3 NCC(=O)NCCF Amb27659897 [1,1,0,0,0,0|1,0,1]=4 2101 B7R0.3 NCC(=O)NCCF Amb33473629 [1,1,0,0,0,0|1,0,1]=4 2102 B7R0.3 NCC(=O)NCCO Amb9023087 [1,1,0,0,0,0|0,0,1]=3 2103 B7R0.3 NCCNC(=O)CS Amb27413124 [1,1,0,0,0,0|1,0,1]=4 2104 B7R0.3 NNC(=O)CNC=O Amb28364902 [1,1,0,0,0,0|1,0,0]=3 2105 B7R0.3 O=C(CBr)NCCBr Amb24104073 [1,1,0,0,0,0|1,0,1]=4 2106 B7R0.3 O=C(CBr)NCCCl Amb29848056 [1,1,0,0,0,0|1,0,1]=4 2107 B7R0.3 O=C(CCl)NCCBr Amb26055016 [1,1,0,0,0,0|1,0,1]=4 2108 B7R0.3 O=C(CCl)NCCCl Amb22261518 [1,1,0,0,0,0|1,0,1]=4 2109 B7R0.3 O=C(CCl)NCCF Amb28048272 [1,1,0,0,0,0|1,0,1]=4 2110 B7R0.3 O=C(CCl)NCCO Amb5716292 [1,1,0,0,0,0|0,0,1]=3 2111 B7R0.3 O=C(CCl)NCCS Amb25350349 [1,1,0,0,0,0|0,1,1]=4 2112 B7R0.3 O=C(CO)CCCO Amb27227084 [1,1,0,0,0,0|1,0,1]=4 2113 B7R0.3 O=C(CO)NCCO Amb5798091 [1,1,0,0,0,0|0,0,1]=3 2114 B7R0.3 O=C(CS)NCCF Amb28204076 [1,1,0,0,0,0|1,0,1]=4 2115 B7R0.3 O=C(CS)OCCO Amb26476359 [1,1,0,0,0,0|1,0,1]=4 2116 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,1,0,0,0,0|1,0,0]=3 2117 B7R0.3 O=CCC\C(Cl)=N\O Amb27751320 [1,1,0,0,0,0|2,0,0]=4 2118 B7R0.3 O=CC\C=C(/Cl)C=O Amb27401185 [1,1,0,0,0,0|2,0,0]=4 2119 B7R0.3 O=C\C=C\C(=O)CO Amb24574003 [1,1,0,0,0,0|1,0,1]=4 2120 B7R0.4 C#CCCNC(C)=O Amb21942373 [1,1,0,0,0,0|1,0,1]=4 2121 B7R0.4 C#CCNCC(=O)O Amb33551387 [1,1,0,0,0,0|0,0,2]=4 2122 B7R0.4 C#CCNCC(=O)O Amb6740302 [1,1,0,0,0,0|0,0,2]=4 2123 B7R0.4 C=C(C)CCNC=O Amb27228134 [1,1,0,0,0,0|2,0,0]=4 2124 B7R0.4 C=C(C)COCC=O Amb27949608 [1,1,0,0,0,0|2,0,0]=4 2125 B7R0.4 C=C(C)CONC=O Amb27620967 [1,1,0,0,0,0|2,0,0]=4 2126 B7R0.4 C=C=CCCC(C)=O Amb28315801 [1,1,0,0,0,0|2,0,0]=4 2127 B7R0.4 C=C=CSCC(=O)O Amb27812092 [1,1,0,0,0,0|1,0,1]=4 2128 B7R0.4 C=CC#CCC(=O)O Amb27162652 [1,1,0,0,0,0|1,0,1]=4 2129 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,1,0,0,0,0|1,0,1]=4 2130 B7R0.4 C=CCCCC(C)=O Amb17593171 [1,1,0,0,0,0|2,0,0]=4 2131 B7R0.4 C=CCCNC(N)=O Amb25789999 [1,1,0,0,0,0|2,0,0]=4 2132 B7R0.4 C=CCCOC(C)=O Amb3940828 [1,1,0,0,0,0|2,0,0]=4 2133 B7R0.4 C=CCCSC(C)=O Amb24117956 [1,1,0,0,0,0|2,0,0]=4 2134 B7R0.4 C=CCNCC(=C)C Amb17308750 [1,1,0,0,0,0|2,0,0]=4 2135 B7R0.4 C=CCNCC(=O)O Amb7766404 [1,1,0,0,0,0|0,0,1]=3 2136 B7R0.4 C=CCNCC(=O)O Amb8631497 [1,1,0,0,0,0|0,0,1]=3 2137 B7R0.4 C=CCNCC(N)=O Amb6706481 [1,1,0,0,0,0|1,0,1]=4 2138 B7R0.4 C=CCNN=C(C)C Amb27661895 [1,1,0,0,0,0|2,0,0]=4 2139 B7R0.4 C=CCOCC(=O)O Amb9208694 [1,1,0,0,0,0|1,0,1]=4 2140 B7R0.4 C=CCOCC(C)=O Amb27829146 [1,1,0,0,0,0|2,0,0]=4 2141 B7R0.4 C=CCONC(N)=O Amb2899787 [1,1,0,0,0,0|2,0,0]=4 2142 B7R0.4 C=CCSCC(=O)O Amb33526723 [1,1,0,0,0,0|1,0,1]=4 2143 B7R0.4 C=CNCCC(=O)O Amb27429817 [1,1,0,0,0,0|0,0,1]=3 2144 B7R0.4 C=COCCC(=O)O Amb28350126 [1,1,0,0,0,0|1,0,1]=4 2145 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [1,1,0,0,0,0|1,0,1]=4 2146 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,1,0,0,0,0|1,0,1]=4 2147 B7R0.4 CC#CCNC(C)=O Amb27758151 [1,1,0,0,0,0|1,0,1]=4 2148 B7R0.4 CC(=N)NCCCO Amb27967298 [1,1,0,0,0,0|1,0,1]=4 2149 B7R0.4 CC(=O)C#CCCO Amb28316149 [1,1,0,0,0,0|1,0,1]=4 2150 B7R0.4 CC(=O)C=C=CCO Amb28284681 [1,1,0,0,0,0|1,0,1]=4 2151 B7R0.4 CC(=O)CCCCO Amb10603864 [1,1,0,0,0,0|1,0,1]=4 2152 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [1,1,0,0,0,0|1,0,0]=3 2153 B7R0.4 CC(=O)CNOCO Amb27244723 [1,1,0,0,0,0|1,0,1]=4 2154 B7R0.4 CC(=O)COCCO Amb28122841 [1,1,0,0,0,0|1,0,1]=4 2155 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|1,0,1]=4 2156 B7R0.4 CC(=O)CS\C=N\O Amb27973055 [1,1,0,0,0,0|2,0,0]=4 2157 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [1,1,0,0,0,0|1,0,1]=4 2158 B7R0.4 CC(=O)NCCC#N Amb5787037 [1,1,0,0,0,0|1,0,1]=4 2159 B7R0.4 CC(=O)NCCC=O Amb17102165 [1,1,0,0,0,0|0,0,0]=2 2160 B7R0.4 CC(=O)NCCCBr Amb8826231 [1,1,0,0,0,0|1,0,1]=4 2161 B7R0.4 CC(=O)NCCCCl Amb3886559 [1,1,0,0,0,0|1,0,1]=4 2162 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|1,0,1]=4 2163 B7R0.4 CC(=O)NCCCN Amb6664982 [1,1,0,0,0,0|1,0,1]=4 2164 B7R0.4 CC(=O)NCCCO Amb3429354 [1,1,0,0,0,0|0,0,1]=3 2165 B7R0.4 CC(=O)NCCNN Amb24117179 [1,1,0,0,0,0|1,0,1]=4 2166 B7R0.4 CC(=O)NCCON Amb17138368 [1,1,0,0,0,0|0,0,1]=3 2167 B7R0.4 CC(=O)NOCCO Amb27484242 [1,1,0,0,0,0|0,0,1]=3 2168 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|1,0,1]=4 2169 B7R0.4 CC(=O)OC\C=C/Br Amb26652075 [1,1,0,0,0,0|2,0,0]=4 2170 B7R0.4 CC(=O)OC\C=C/Cl Amb27843145 [1,1,0,0,0,0|2,0,0]=4 2171 B7R0.4 CC(=O)OC\C=C\Br Amb27467221 [1,1,0,0,0,0|2,0,0]=4 2172 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,1,0,0,0,0|1,0,0]=3 2173 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [1,1,0,0,0,0|1,0,1]=4 2174 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|2,0,0]=4 2175 B7R0.4 CC(C)=CCNC=O Amb27838354 [1,1,0,0,0,0|2,0,0]=4 2176 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,1,0,0,0,0|1,0,1]=4 2177 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|1,0,1]=4 2178 B7R0.4 CCCCNC(C)=O Amb5835711 [1,1,0,0,0,0|1,0,1]=4 2179 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,1]=3 2180 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,1]=3 2181 B7R0.4 CCCNCC(C)=O Amb26954588 [1,1,0,0,0,0|1,0,1]=4 2182 B7R0.4 CCCNCC(N)=O Amb1124632 [1,1,0,0,0,0|1,0,1]=4 2183 B7R0.4 CCCNCC(N)=O Amb28934788 [1,1,0,0,0,0|1,0,1]=4 2184 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|1,0,1]=4 2185 B7R0.4 CCCONC(C)=O Amb27764366 [1,1,0,0,0,0|1,0,1]=4 2186 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|1,0,1]=4 2187 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|0,0,1]=3 2188 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|0,0,1]=3 2189 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,1]=4 2190 B7R0.4 CCNCCC(N)=O Amb33533384 [1,1,0,0,0,0|1,0,1]=4 2191 B7R0.4 CCNCCC(N)=O Amb35749820 [1,1,0,0,0,0|1,0,1]=4 2192 B7R0.4 CCNNCC(=O)O Amb28326075 [1,1,0,0,0,0|0,0,1]=3 2193 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|1,0,1]=4 2194 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|1,0,1]=4 2195 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|1,0,0]=3 2196 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|2,0,0]=4 2197 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|2,0,0]=4 2198 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|1,0,0]=3 2199 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|2,0,0]=4 2200 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,1,0,0,0,0|2,0,0]=4 2201 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|1,0,1]=4 2202 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|1,0,1]=4 2203 B7R0.4 CNCCNC(C)=O Amb28934797 [1,1,0,0,0,0|1,0,1]=4 2204 B7R0.4 CNCCNC(C)=O Amb9256137 [1,1,0,0,0,0|1,0,1]=4 2205 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|1,0,1]=4 2206 B7R0.4 COCCCC(C)=O Amb9031556 [1,1,0,0,0,0|1,0,1]=4 2207 B7R0.4 COCCNC(C)=O Amb3358082 [1,1,0,0,0,0|0,0,1]=3 2208 B7R0.4 COCCNC(N)=O Amb1104938 [1,1,0,0,0,0|1,0,1]=4 2209 B7R0.4 COCCOC(C)=O Amb4037074 [1,1,0,0,0,0|1,0,1]=4 2210 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|1,0,1]=4 2211 B7R0.4 COCSCC(=O)O Amb27466837 [1,1,0,0,0,0|1,0,1]=4 2212 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [1,1,0,0,0,0|0,0,1]=3 2213 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [1,1,0,0,0,0|0,0,1]=3 2214 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|1,0,1]=4 2215 B7R0.4 CSCCNC(C)=O Amb8504699 [1,1,0,0,0,0|0,1,1]=4 2216 B7R0.4 CSCSCC(=O)O Amb27858824 [1,1,0,0,0,0|1,0,1]=4 2217 B7R0.4 CSSCCC(=O)O Amb26848465 [1,1,0,0,0,0|2,0,0]=4 2218 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,1,0,0,0,0|1,0,0]=3 2219 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [1,1,0,0,0,0|2,0,0]=4 2220 B7R0.4 C\C=C\C#CC(=O)O Amb17593127 [1,1,0,0,0,0|1,0,1]=4 2221 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [1,1,0,0,0,0|1,0,1]=4 2222 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|1,0,0]=3 2223 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,1,0,0,0,0|2,0,0]=4 2224 B7R0.4 C\C=C\CNC(=O)S Amb26417290 [1,1,0,0,0,0|1,1,0]=4 2225 B7R0.4 C\C=C\COC(C)=O Amb6366590 [1,1,0,0,0,0|2,0,0]=4 2226 B7R0.4 N#CNCCC(=O)O Amb30031691 [1,1,0,0,0,0|1,0,1]=4 2227 B7R0.4 N#CNOCC(=O)O Amb35634483 [1,1,0,0,0,0|1,0,1]=4 2228 B7R0.4 NC(=O)CNCCO Amb6714605 [1,1,0,0,0,0|1,0,1]=4 2229 B7R0.4 NC(=O)NCCCO Amb9248133 [1,1,0,0,0,0|1,0,1]=4 2230 B7R0.4 NC(=O)NCCN=O Amb27796959 [1,1,0,0,0,0|1,0,1]=4 2231 B7R0.4 NC(=O)NN\C=C\O Amb27265610 [1,1,0,0,0,0|1,0,1]=4 2232 B7R0.4 NC(=S)CCNC=O Amb27395809 [1,1,0,0,0,0|1,1,0]=4 2233 B7R0.4 NCC#CCC(=O)O Amb27976019 [1,1,0,0,0,0|1,0,1]=4 2234 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|1,0,1]=4 2235 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|1,0,1]=4 2236 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|1,0,1]=4 2237 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|0,0,1]=3 2238 B7R0.4 NCCNCC(=O)O Amb33339058 [1,1,0,0,0,0|0,0,1]=3 2239 B7R0.4 NCCNCC(N)=O Amb28388338 [1,1,0,0,0,0|1,0,1]=4 2240 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|1,0,1]=4 2241 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|1,0,1]=4 2242 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,1]=4 2243 B7R0.4 NCCSCC(=O)O Amb20622325 [1,1,0,0,0,0|1,0,1]=4 2244 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|1,0,1]=4 2245 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|1,0,1]=4 2246 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|1,0,1]=4 2247 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|1,0,1]=4 2248 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|1,0,1]=4 2249 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|1,0,1]=4 2250 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [1,1,0,0,0,0|1,0,1]=4 2251 B7R0.4 O=C(O)CNCCF Amb28076282 [1,1,0,0,0,0|0,0,1]=3 2252 B7R0.4 O=C(O)CNCCO Amb9325653 [1,1,0,0,0,0|0,0,1]=3 2253 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,1]=4 2254 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|1,0,1]=4 2255 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|1,0,1]=4 2256 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,1]=4 2257 B7R0.4 O=C(O)CSSCCl Amb27983630 [1,1,0,0,0,0|2,0,0]=4 2258 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|1,0,0]=3 2259 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,1,0,0,0,0|1,0,0]=3 2260 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|1,0,0]=3 2261 B7R0.4 O=C=NCCC(=O)O Amb26053417 [1,1,0,0,0,0|0,0,2]=4 2262 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|1,0,0]=3 2263 B7R0.4 O=CNCC=C(Cl)Cl Amb35690539 [1,1,0,0,0,0|2,0,0]=4 2264 B7R0.4 O=CNCCC(=O)O Amb18290434 [1,1,0,0,0,0|0,0,0]=2 2265 B7R0.4 O=CNOCC(=O)O Amb27477273 [1,1,0,0,0,0|0,0,0]=2 2266 B7R0.4 O=NSCCC(=O)O Amb28429846 [1,1,0,0,0,0|2,0,0]=4 2267 B7R0.5 C#CCN(C)C(C)=O Amb24120433 [1,1,0,0,0,0|1,0,1]=4 2268 B7R0.5 C=C(C)C(=C)CC=O Amb28245848 [1,1,0,0,0,0|2,0,0]=4 2269 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [1,1,0,0,0,0|2,0,0]=4 2270 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [1,1,0,0,0,0|2,0,0]=4 2271 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,1,0,0,0,0|1,0,1]=4 2272 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [1,1,0,0,0,0|2,0,0]=4 2273 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,1,0,0,0,0|1,0,1]=4 2274 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,1,0,0,0,0|1,0,1]=4 2275 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [1,1,0,0,0,0|2,0,0]=4 2276 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,1,0,0,0,0|1,0,1]=4 2277 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,1,0,0,0,0|1,0,1]=4 2278 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [1,1,0,0,0,0|2,0,0]=4 2279 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [1,1,0,0,0,0|2,0,0]=4 2280 B7R0.5 C=CCN(Br)C(C)=O Amb28316145 [1,1,0,0,0,0|1,0,0]=3 2281 B7R0.5 C=CCN(C)C(=O)Cl Amb33296757 [1,1,0,0,0,0|2,0,0]=4 2282 B7R0.5 C=CCN(C)C(C)=O Amb4318131 [1,1,0,0,0,0|1,0,0]=3 2283 B7R0.5 C=CCN(C)C(N)=O Amb27838344 [1,1,0,0,0,0|2,0,0]=4 2284 B7R0.5 C=CCN(S)C(N)=O Amb27596029 [1,1,0,0,0,0|2,0,0]=4 2285 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,1,0,0,0,0|1,0,1]=4 2286 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,1,0,0,0,0|1,0,1]=4 2287 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [1,1,0,0,0,0|2,0,0]=4 2288 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,1,0,0,0,0|1,0,1]=4 2289 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,1,0,0,0,0|1,0,1]=4 2290 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,1,0,0,0,0|1,0,1]=4 2291 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,1,0,0,0,0|1,0,1]=4 2292 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [1,1,0,0,0,0|1,0,0]=3 2293 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,1,0,0,0,0|1,0,1]=4 2294 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,1,0,0,0,0|1,0,1]=4 2295 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,1,0,0,0,0|1,0,1]=4 2296 B7R0.5 CC(=O)C(C)NC=O Amb23442778 [1,1,0,0,0,0|1,0,0]=3 2297 B7R0.5 CC(=O)C(C)OC=O Amb26492625 [1,1,0,0,0,0|2,0,0]=4 2298 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,0]=3 2299 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,1,0,0,0,0|1,0,1]=4 2300 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|1,0,1]=4 2301 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|1,0,1]=4 2302 B7R0.5 CC(=O)N(C)CC#N Amb17399793 [1,1,0,0,0,0|1,0,1]=4 2303 B7R0.5 CC(=O)N(C)CC=O Amb17080668 [1,1,0,0,0,0|0,0,0]=2 2304 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [1,1,0,0,0,0|1,0,1]=4 2305 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [1,1,0,0,0,0|1,0,1]=4 2306 B7R0.5 CC(=O)N(C)CCN Amb17046786 [1,1,0,0,0,0|1,0,1]=4 2307 B7R0.5 CC(=O)N(C)CCN Amb34137491 [1,1,0,0,0,0|1,0,1]=4 2308 B7R0.5 CC(=O)N(C)CCO Amb5797447 [1,1,0,0,0,0|0,0,1]=3 2309 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,1,0,0,0,0|1,0,1]=4 2310 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [1,1,0,0,0,0|1,0,0]=3 2311 B7R0.5 CC(=O)\C(C)=C\C=O Amb28208341 [1,1,0,0,0,0|1,0,1]=4 2312 B7R0.5 CC(=O)\C(C)=N\C=O Amb28316244 [1,1,0,0,0,0|2,0,0]=4 2313 B7R0.5 CC(=S)N(C)CCO Amb27198220 [1,1,0,0,0,0|0,1,1]=4 2314 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [1,1,0,0,0,0|2,0,0]=4 2315 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,1,0,0,0,0|1,0,0]=3 2316 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [1,1,0,0,0,0|0,0,2]=4 2317 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [1,1,0,0,0,0|0,0,0]=2 2318 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,1,0,0,0,0|0,0,2]=4 2319 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [1,1,0,0,0,0|1,0,0]=3 2320 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|1,0,1]=4 2321 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|1,0,1]=4 2322 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|1,0,1]=4 2323 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|1,0,1]=4 2324 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|1,0,1]=4 2325 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|1,0,1]=4 2326 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|1,0,1]=4 2327 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,1,0,0,0,0|1,0,1]=4 2328 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|1,0,1]=4 2329 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|1,0,1]=4 2330 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|1,0,1]=4 2331 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|1,0,1]=4 2332 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|1,0,1]=4 2333 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|1,0,1]=4 2334 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|1,0,1]=4 2335 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|1,0,1]=4 2336 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|1,0,1]=4 2337 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|1,0,1]=4 2338 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|1,0,1]=4 2339 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,1,0,0,0,0|0,0,2]=4 2340 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|0,0,1]=3 2341 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|0,0,1]=3 2342 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|1,0,1]=4 2343 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,1,0,0,0,0|1,0,1]=4 2344 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|0,0,1]=3 2345 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|0,0,1]=3 2346 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|0,0,1]=3 2347 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,1]=4 2348 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,1]=4 2349 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,1]=4 2350 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|2,0,0]=4 2351 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|2,0,0]=4 2352 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|2,0,0]=4 2353 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|2,0,0]=4 2354 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|2,0,0]=4 2355 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|2,0,0]=4 2356 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|2,0,0]=4 2357 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|2,0,0]=4 2358 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|2,0,0]=4 2359 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|2,0,0]=4 2360 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|2,0,0]=4 2361 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|2,0,0]=4 2362 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|2,0,0]=4 2363 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|2,0,0]=4 2364 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|2,0,0]=4 2365 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|2,0,0]=4 2366 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|2,0,0]=4 2367 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|2,0,0]=4 2368 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|2,0,0]=4 2369 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|2,0,0]=4 2370 B7R0.5 CONC(C)C(N)=O Amb27657313 [1,1,0,0,0,0|2,0,0]=4 2371 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,1,0,0,0,0|1,0,0]=3 2372 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|2,0,0]=4 2373 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|2,0,0]=4 2374 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|2,0,0]=4 2375 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|2,0,0]=4 2376 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|2,0,0]=4 2377 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|2,0,0]=4 2378 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|2,0,0]=4 2379 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|2,0,0]=4 2380 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [1,1,0,0,0,0|0,0,2]=4 2381 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [1,1,0,0,0,0|1,0,1]=4 2382 B7R0.5 C[C@@H](NC=O)C(N)=O Amb27837549 [1,1,0,0,0,0|1,0,0]=3 2383 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [1,1,0,0,0,0|0,0,2]=4 2384 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [1,1,0,0,0,0|1,0,1]=4 2385 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [1,1,0,0,0,0|0,0,0]=2 2386 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,1,0,0,0,0|0,0,2]=4 2387 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|2,0,0]=4 2388 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|2,0,0]=4 2389 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [1,1,0,0,0,0|1,0,1]=4 2390 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,1,0,0,0,0|1,0,0]=3 2391 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [1,1,0,0,0,0|2,0,0]=4 2392 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,1,0,0,0,0|1,0,0]=3 2393 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [1,1,0,0,0,0|2,0,0]=4 2394 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,1,0,0,0,0|1,0,0]=3 2395 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,1,0,0,0,0|1,0,0]=3 2396 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,1,0,0,0,0|1,0,0]=3 2397 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [1,1,0,0,0,0|2,0,0]=4 2398 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [1,1,0,0,0,0|2,0,0]=4 2399 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,1,0,0,0,0|1,0,0]=3 2400 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,1,0,0,0,0|2,0,0]=4 2401 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [1,1,0,0,0,0|1,0,1]=4 2402 B7R0.5 O=C\C=C(/Br)C(=O)O Amb28320595 [1,1,0,0,0,0|1,0,1]=4 2403 B7R0.5 O=C\C=C(/Cl)C(=O)O Amb27784434 [1,1,0,0,0,0|1,0,1]=4 2404 B7R0.8 C=CCNS(C)(=N)=O Amb35688414 [1,1,0,0,0,0|2,0,0]=4 2405 B7R0.8 C=CCNS(C)(=O)=O Amb3360692 [1,1,0,0,0,0|2,0,0]=4 2406 B7R0.8 CC(C)(O)CNC=O Amb28250027 [1,1,0,0,0,0|1,0,1]=4 2407 B7R0.8 CP(=O)(O)CCC=O Amb27643443 [1,1,0,0,0,0|2,0,0]=4 2408 B7R0.8 CP(=O)(O)NCCO Amb27652858 [1,1,0,0,0,0|1,0,1]=4 2409 B7R0.8 CS(=N)(=O)NCCO Amb30012440 [1,1,0,0,0,0|1,0,1]=4 2410 B7R0.8 CS(=O)(=O)CCC=O Amb28289688 [1,1,0,0,0,0|2,0,0]=4 2411 B7R0.8 CS(=O)(=O)NCC=O Amb17102114 [1,1,0,0,0,0|1,0,0]=3 2412 B7R0.8 CS(=O)(=O)NCCO Amb9243392 [1,1,0,0,0,0|1,0,1]=4 2413 B7R0.9 C=C(C)CS(=O)(=O)O Amb8479884 [0,1,0,0,1,0|2,0,0]=4 2414 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [0,1,0,0,1,0|1,0,1]=4 2415 B7R0.9 CC(=O)CP(=O)(Cl)Cl Amb28201546 [0,1,0,0,1,0|2,0,0]=4 2416 B7R0.9 CC(=O)CS(=O)(=O)Cl Amb27206933 [0,1,0,0,1,0|1,0,1]=4 2417 B7R0.9 CC(=O)CS(=O)(=O)F Amb33038451 [0,1,0,0,1,0|1,0,1]=4 2418 B7R0.9 CC(=O)CS(C)(=O)=O Amb2689700 [0,1,0,0,1,0|1,0,1]=4 2419 B7R0.9 CC(=O)NS(=O)(=O)Cl Amb26347350 [0,1,0,0,1,0|1,0,1]=4 2420 B7R0.9 CC(=O)NS(C)(=O)=O Amb4158231 [0,1,0,0,1,0|1,0,1]=4 2421 B7R0.9 CC(=O)NS(N)(=O)=O Amb28345134 [0,1,0,0,1,0|1,0,1]=4 2422 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [0,1,0,0,1,0|1,0,1]=4 2423 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [0,1,0,0,1,0|1,0,1]=4 2424 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [0,1,0,0,1,0|1,0,1]=4 2425 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [0,1,0,0,1,0|1,0,1]=4 2426 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [0,1,0,0,1,0|1,0,1]=4 2427 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [0,1,0,0,1,0|1,0,1]=4 2428 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [0,1,0,0,1,0|1,0,1]=4 2429 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [0,1,0,0,1,0|0,0,2]=4 2430 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [0,1,0,0,1,0|0,1,1]=4 2431 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [0,1,0,0,1,0|1,0,1]=4 2432 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [0,1,0,0,1,0|0,0,2]=4 2433 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [0,1,0,0,1,0|0,0,2]=4 2434 B7R0.9 CP(=O)(O)CC(=O)O Amb3371772 [0,1,0,0,1,0|1,0,0]=3 2435 B7R0.9 CP(=O)([O-])CC(=O)[O-] Amb30585120 [0,1,0,0,1,0|1,0,1]=4 2436 B7R0.9 CP(=O)([O-])CC(N)=O Amb27790767 [0,1,0,0,1,0|2,0,0]=4 2437 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [0,1,0,0,1,0|1,0,0]=3 2438 B7R0.9 CS(=N)(=O)NC(N)=O Amb35688409 [0,1,0,0,1,0|2,0,0]=4 2439 B7R0.9 CS(=O)(=O)CC(=O)Cl Amb28397142 [0,1,0,0,1,0|2,0,0]=4 2440 B7R0.9 CS(=O)(=O)CC(=O)O Amb3939888 [0,1,0,0,1,0|1,0,0]=3 2441 B7R0.9 CS(=O)(=O)CC(N)=O Amb4020730 [0,1,0,0,1,0|2,0,0]=4 2442 B7R0.9 CS(=O)(=O)NC(N)=O Amb22039456 [0,1,0,0,1,0|2,0,0]=4 2443 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [0,1,0,0,1,0|2,0,0]=4 2444 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [0,1,0,0,1,0|2,0,0]=4 2445 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [0,1,0,0,1,0|2,0,0]=4 2446 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [0,1,0,0,1,0|1,1,0]=4 2447 B7R0.9 NC(=O)CS(=O)(=O)O Amb28398406 [0,1,0,0,1,0|2,0,0]=4 2448 B7R0.9 NS(=O)(=O)CC(=O)O Amb6741828 [0,1,0,0,1,0|2,0,0]=4 2449 B7R0.9 O=C(O)CP(=O)(O)O Amb4489433 [0,1,0,0,1,0|2,0,0]=4 2450 B7R0.9 O=C(O)CS(=O)(=O)Cl Amb28428457 [0,1,0,0,1,0|2,0,0]=4 2451 B7R0.9 O=C(O)CS(=O)(=O)F Amb26639922 [0,1,0,0,1,0|2,0,0]=4 2452 B7R0.9 O=C(O)CS(=O)(=O)O Amb16232248 [0,1,0,0,1,0|2,0,0]=4 2453 B7R0.9 O=C(O)C[SH](=O)([O-])O Amb27231739 [0,1,0,0,1,0|2,0,0]=4 2454 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,1,0,0,1,0|1,0,1]=4 2455 B7R0.16 C=C(C(=O)O)C(=O)Cl Amb28056536 [0,1,0,0,1,0|1,0,1]=4 2456 B7R0.16 C=C(C(C)=O)C(C)=O Amb27424014 [0,1,0,0,1,0|1,0,1]=4 2457 B7R0.16 C=C(C(C)=O)C(N)=O Amb27814821 [0,1,0,0,1,0|1,0,1]=4 2458 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,1,0,0,1,0|1,0,1]=4 2459 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,1,0,0,1,0|1,0,0]=3 2460 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [0,1,0,0,1,0|2,0,0]=4 2461 B7R0.16 C=C(C)C(Cl)C(C)=O Amb27633869 [0,1,0,0,1,0|2,0,0]=4 2462 B7R0.16 C=C(C)C(N)C(=C)O Amb27762325 [0,1,0,0,1,0|2,0,0]=4 2463 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,1,0,0,1,0|1,0,0]=3 2464 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,1,0,0,1,0|1,0,0]=3 2465 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [0,1,0,0,1,0|2,0,0]=4 2466 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,1,0,0,1,0|1,0,0]=3 2467 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,1,0,0,1,0|1,0,0]=3 2468 B7R0.16 CC(=N)C(C)C(C)=O Amb28315572 [0,1,0,0,1,0|2,0,0]=4 2469 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,1,0,0,1,0|0,0,1]=3 2470 B7R0.16 CC(=O)C(=O)C(C)=O Amb17593178 [0,1,0,0,1,0|1,0,1]=4 2471 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,1,0,0,1,0|1,0,1]=4 2472 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,1,0|1,0,0]=3 2473 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [0,1,0,0,1,0|1,0,0]=3 2474 B7R0.16 CC(=O)C(C)C(=S)S Amb27261425 [0,1,0,0,1,0|0,2,0]=4 2475 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [0,1,0,0,1,0|1,0,0]=3 2476 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,1,0,0,1,0|1,0,1]=4 2477 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,1,0,0,1,0|1,0,1]=4 2478 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [0,1,0,0,1,0|1,0,0]=3 2479 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,1,0,0,1,0|1,0,1]=4 2480 B7R0.16 CC(=O)C(F)[N+](=O)[O-] Amb28254640 [0,1,0,0,1,0|1,0,1]=4 2481 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,0,0,1,0|0,0,0]=2 2482 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,1,0,0,1,0|1,0,0]=3 2483 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,1,0,0,1,0|1,0,0]=3 2484 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [0,1,0,0,1,0|1,0,0]=3 2485 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,1,0,0,1,0|1,0,1]=4 2486 B7R0.16 CC(=O)N(C)C(=O)Cl Amb33338974 [0,1,0,0,1,0|1,0,0]=3 2487 B7R0.16 CC(=O)N(C)C(C)=O Amb2720846 [0,1,0,0,1,0|1,0,0]=3 2488 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,1,0,0,1,0|1,0,0]=3 2489 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,1,0,0,1,0|1,0,1]=4 2490 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,1,0,0,1,0|1,0,1]=4 2491 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,1,0,0,1,0|1,0,1]=4 2492 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,1,0,0,1,0|1,0,1]=4 2493 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,1,0,0,1,0|1,0,1]=4 2494 B7R0.16 CC(=O)\C(F)=C(/C)O Amb28384212 [0,1,0,0,1,0|1,0,1]=4 2495 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,1,0,0,1,0|1,0,1]=4 2496 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,1,0,0,1,0|0,1,0]=3 2497 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,1,0|1,0,1]=4 2498 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,1,0,0,1,0|1,0,0]=3 2499 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,1,0|2,0,0]=4 2500 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,1,0|2,0,0]=4 2501 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,1,0,0,1,0|2,0,0]=4 2502 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,1,0,0,1,0|1,0,0]=3 2503 B7R0.16 CC(C(N)=O)C(N)=O Amb4034611 [0,1,0,0,1,0|2,0,0]=4 2504 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,1,0,0,1,0|1,0,1]=4 2505 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,1,0,0,1,0|1,0,1]=4 2506 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,1,0,0,1,0|1,0,1]=4 2507 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,1,0,0,1,0|1,0,1]=4 2508 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,1,0|1,0,1]=4 2509 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,1,0|1,0,1]=4 2510 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,1,0|1,0,1]=4 2511 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,1,0|1,0,1]=4 2512 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,1,0|1,0,1]=4 2513 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,1,0|1,0,1]=4 2514 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,1,0|1,0,1]=4 2515 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,1,0|1,0,1]=4 2516 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,1,0|1,0,1]=4 2517 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,1,0|1,0,1]=4 2518 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,1,0|1,0,1]=4 2519 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,1,0|1,0,1]=4 2520 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,1,0|1,0,1]=4 2521 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,1,0|1,0,1]=4 2522 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,1,0|1,0,1]=4 2523 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,1,0|1,0,1]=4 2524 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,1,0|1,0,1]=4 2525 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,1,0|1,0,1]=4 2526 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,1,0|1,0,1]=4 2527 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,1,0|1,0,1]=4 2528 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,1,0|1,0,1]=4 2529 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,1,0|1,0,1]=4 2530 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,1,0|1,0,1]=4 2531 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,1,0|1,0,1]=4 2532 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,1,0|1,0,1]=4 2533 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,1,0|1,0,1]=4 2534 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,1,0|1,0,1]=4 2535 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,1,0|1,0,1]=4 2536 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,1,0|0,0,2]=4 2537 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,1,0|0,0,2]=4 2538 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,1,0|0,0,2]=4 2539 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,1,0|0,0,2]=4 2540 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,1,0|0,0,2]=4 2541 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,1,0|0,0,2]=4 2542 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,1,0|0,0,2]=4 2543 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,1,0|0,1,1]=4 2544 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,1,0|0,1,1]=4 2545 B7R0.16 CN(C(=O)Cl)C(=O)Cl Amb28127675 [0,1,0,0,1,0|2,0,0]=4 2546 B7R0.16 CN(C(N)=O)C(N)=O Amb27411152 [0,1,0,0,1,0|2,0,0]=4 2547 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,1,0|2,0,0]=4 2548 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,1,0|2,0,0]=4 2549 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,1,0|2,0,0]=4 2550 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,1,0|1,0,1]=4 2551 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,1,0|1,0,1]=4 2552 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,1,0|1,0,1]=4 2553 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,1,0|1,0,1]=4 2554 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,1,0|1,0,1]=4 2555 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,1,0|1,0,1]=4 2556 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,1,0|1,0,1]=4 2557 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,1,0|0,0,2]=4 2558 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,1,0|0,0,2]=4 2559 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,1,0|0,0,2]=4 2560 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,1,0|0,0,2]=4 2561 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,1,0|0,0,2]=4 2562 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,1,0|0,0,2]=4 2563 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,1,0|0,0,2]=4 2564 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,1,0|0,0,2]=4 2565 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,1,0|0,1,1]=4 2566 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,1,0|2,0,0]=4 2567 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,1,0|0,0,2]=4 2568 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,1,0|1,0,1]=4 2569 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,1,0|1,0,1]=4 2570 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,1,0|1,0,1]=4 2571 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,1,0|1,0,1]=4 2572 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,1,0|1,0,1]=4 2573 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,1,0|0,0,2]=4 2574 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,1,0|0,0,2]=4 2575 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,1,0|0,0,2]=4 2576 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,1,0|0,0,2]=4 2577 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,1,0|0,0,2]=4 2578 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,1,0|0,0,2]=4 2579 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,1,0|0,0,2]=4 2580 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,1,0|0,0,2]=4 2581 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,1,0|0,0,2]=4 2582 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,1,0|0,0,2]=4 2583 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,1,0,0,1,0|1,0,0]=3 2584 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,1,0,0,1,0|1,0,1]=4 2585 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,1,0,0,1,0|0,0,2]=4 2586 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,1,0,0,1,0|0,0,2]=4 2587 B7R0.16 NC(=O)C(Br)C(N)=O Amb23504430 [0,1,0,0,1,0|2,0,0]=4 2588 B7R0.16 NC(=O)C(F)C(N)=O Amb27948525 [0,1,0,0,1,0|2,0,0]=4 2589 B7R0.16 NC(=O)C(N)C(N)=O Amb518675 [0,1,0,0,1,0|2,0,0]=4 2590 B7R0.16 NC(=O)C(O)C(N)=O Amb27212957 [0,1,0,0,1,0|2,0,0]=4 2591 B7R0.16 NC(=O)C([Na])C(N)=O Amb27838298 [0,1,0,0,1,0|2,0,0]=4 2592 B7R0.16 NC(=O)N(O)C(N)=O Amb35748113 [0,1,0,0,1,0|2,0,0]=4 2593 B7R0.16 NC(=O)N(O)C(N)=O Amb35753209 [0,1,0,0,1,0|2,0,0]=4 2594 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,1,0,0,1,0|1,0,0]=3 2595 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,1,0|1,0,0]=3 2596 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,1,0,0,1,0|2,0,0]=4 2597 B7R0.16 O=C(Cl)C(Cl)C(=O)Cl Amb27781570 [0,1,0,0,1,0|2,0,0]=4 2598 B7R0.16 O=C(Cl)C(F)C(=O)Cl Amb32456101 [0,1,0,0,1,0|2,0,0]=4 2599 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,1,0,0,1,0|1,0,1]=4 2600 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,1,0,0,1,0|1,0,0]=3 2601 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,1,0,0,1,0|1,0,0]=3 2602 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,1,0,0,1,0|1,0,0]=3 2603 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,1,0,0,1,0|1,0,0]=3 2604 B9R0.1 C#CC(=O)NOCC(=O)O Amb27399796 [0,1,0,0,0,1|0,0,1]=3 2605 B9R0.1 C#CC(=O)NOCC(N)=O Amb28344971 [0,1,0,0,0,1|1,0,1]=4 2606 B9R0.1 C#C\C(C)=C\CCC(=O)O Amb27461397 [0,1,0,0,0,1|2,0,0]=4 2607 B9R0.1 C=C(Br)CNCC(=O)NC Amb18303977 [0,1,0,0,0,1|2,0,0]=4 2608 B9R0.1 C=C(C)CCCC(=O)OC Amb25995990 [0,1,0,0,0,1|2,0,0]=4 2609 B9R0.1 C=C(C)CCNC(=O)CCl Amb27974797 [0,1,0,0,0,1|2,0,0]=4 2610 B9R0.1 C=C(C)CCNC(=O)CS Amb28144813 [0,1,0,0,0,1|2,0,0]=4 2611 B9R0.1 C=C(C)CCNC(=O)OC Amb27247131 [0,1,0,0,0,1|2,0,0]=4 2612 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,1,0,0,0,1|2,0,0]=4 2613 B9R0.1 C=C(C)CNCC(=O)NC Amb27407164 [0,1,0,0,0,1|2,0,0]=4 2614 B9R0.1 C=C(C)CONC(=O)CC Amb28142558 [0,1,0,0,0,1|2,0,0]=4 2615 B9R0.1 C=C(C=O)CCCC(C)=O Amb8392635 [0,1,0,0,0,1|2,0,0]=4 2616 B9R0.1 C=C(C=O)CCOC(C)=O Amb18643822 [0,1,0,0,0,1|2,0,0]=4 2617 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,1,0,0,0,1|1,0,0]=3 2618 B9R0.1 C=C(CO)CCOC(C)=O Amb28322751 [0,1,0,0,0,1|2,0,0]=4 2619 B9R0.1 C=CC(=O)CCCC(=O)O Amb27770363 [0,1,0,0,0,1|1,0,1]=4 2620 B9R0.1 C=CC(=O)CCCC(C)=O Amb27409542 [0,1,0,0,0,1|2,0,0]=4 2621 B9R0.1 C=CC(=O)NCCC(=O)O Amb6257105 [0,1,0,0,0,1|0,0,1]=3 2622 B9R0.1 C=CC(=O)NCCC(=O)[O-] Amb20668483 [0,1,0,0,0,1|0,0,2]=4 2623 B9R0.1 C=CC(=O)NCCC(N)=O Amb9481014 [0,1,0,0,0,1|1,0,1]=4 2624 B9R0.1 C=CC(=O)NCNC(N)=O Amb27467860 [0,1,0,0,0,1|1,0,1]=4 2625 B9R0.1 C=CC(=O)OCCC(=O)O Amb18644058 [0,1,0,0,0,1|1,0,1]=4 2626 B9R0.1 CC(=O)CCCC(=O)NO Amb27980256 [0,1,0,0,0,1|1,0,0]=3 2627 B9R0.1 CC(=O)CCC\C(C)=N\O Amb28434847 [0,1,0,0,0,1|2,0,0]=4 2628 B9R0.1 CC(=O)CC\C=C(/C)C=O Amb18124577 [0,1,0,0,0,1|2,0,0]=4 2629 B9R0.1 CC(=O)CC\C=C(\C)C=O Amb27195922 [0,1,0,0,0,1|2,0,0]=4 2630 B9R0.1 CC(=O)NCCC(C)CO Amb28203991 [0,1,0,0,0,1|1,0,1]=4 2631 B9R0.1 CC(=O)NCCC(O)CO Amb32645132 [0,1,0,0,0,1|0,0,2]=4 2632 B9R0.1 CC(=O)NCNC(=O)CO Amb27243935 [0,1,0,0,0,1|0,0,0]=2 2633 B9R0.1 CC(=O)NCNC(C)=S=O Amb28196357 [0,1,0,0,0,1|1,0,0]=3 2634 B9R0.1 CC(=O)OC\C=C(/C)C=O Amb17593584 [0,1,0,0,0,1|2,0,0]=4 2635 B9R0.1 CC(=O)SCCC(=O)CCl Amb24436675 [0,1,0,0,0,1|2,0,0]=4 2636 B9R0.1 CC(=O)SC\C=C(\C)C=O Amb28411202 [0,1,0,0,0,1|2,0,0]=4 2637 B9R0.1 CC(C)NCCC(=O)NO Amb27948303 [0,1,0,0,0,1|1,0,1]=4 2638 B9R0.1 CC(C=O)CCCC(=O)O Amb27173621 [0,1,0,0,0,1|1,0,1]=4 2639 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,1,0,0,0,1|0,0,2]=4 2640 B9R0.1 CC(O)CCNC(=O)CS Amb28120401 [0,1,0,0,0,1|1,0,1]=4 2641 B9R0.1 CCC(=N)NCCC(N)=O Amb27181001 [0,1,0,0,0,1|2,0,0]=4 2642 B9R0.1 CCC(=O)NCC=C(C)C Amb27628319 [0,1,0,0,0,1|2,0,0]=4 2643 B9R0.1 CCC(=O)NCC=C(Cl)Cl Amb35690541 [0,1,0,0,0,1|2,0,0]=4 2644 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,1,0,0,0,1|0,0,0]=2 2645 B9R0.1 CCC(=O)NCCC(C)=O Amb17102869 [0,1,0,0,0,1|1,0,0]=3 2646 B9R0.1 CCC(=O)NCCC(N)=O Amb17231982 [0,1,0,0,0,1|1,0,0]=3 2647 B9R0.1 CCC(=O)NCCC(N)=S Amb17232333 [0,1,0,0,0,1|1,1,0]=4 2648 B9R0.1 CCC(=O)NOCC(N)=O Amb27390237 [0,1,0,0,0,1|1,0,0]=3 2649 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,1,0,0,0,1|1,0,0]=3 2650 B9R0.1 CCC(=O)OCOC(=O)Cl Amb25212596 [0,1,0,0,0,1|2,0,0]=4 2651 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,1,0,0,0,1|1,0,0]=3 2652 B9R0.1 CCS(=O)CCNC(C)=O Amb27616407 [0,1,0,0,0,1|2,0,0]=4 2653 B9R0.1 CCS(=O)NOCC(=O)O Amb27249429 [0,1,0,0,0,1|1,0,0]=3 2654 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,1,0,0,0,1|2,0,0]=4 2655 B9R0.1 CN(CCCC(=O)O)N=O Amb17618588 [0,1,0,0,0,1|2,0,0]=4 2656 B9R0.1 CNC(=N)NCCC(=O)O Amb26014274 [0,1,0,0,0,1|1,0,0]=3 2657 B9R0.1 CNC(=N)NCCC(N)=O Amb27865845 [0,1,0,0,0,1|2,0,0]=4 2658 B9R0.1 CNC(=O)CCCC(=O)[O-] Amb24271120 [0,1,0,0,0,1|1,0,1]=4 2659 B9R0.1 CNC(=O)CNCC(=O)O Amb8943036 [0,1,0,0,0,1|0,0,0]=2 2660 B9R0.1 CNC(=O)CNCC(C)=O Amb27789643 [0,1,0,0,0,1|1,0,0]=3 2661 B9R0.1 CNC(=O)CNC[C@@H](C)O Amb28188407 [0,1,0,0,0,1|1,0,1]=4 2662 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,1,0,0,0,1|1,0,0]=3 2663 B9R0.1 CNC(=O)CONC(C)=O Amb28315988 [0,1,0,0,0,1|1,0,0]=3 2664 B9R0.1 CNC(=O)CSCC(=O)O Amb6251930 [0,1,0,0,0,1|1,0,0]=3 2665 B9R0.1 CNC(=O)CSCC(N)=O Amb27170981 [0,1,0,0,0,1|2,0,0]=4 2666 B9R0.1 CNC(=O)NCC=C(Cl)Cl Amb35690707 [0,1,0,0,0,1|2,0,0]=4 2667 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,1,0,0,0,1|0,0,0]=2 2668 B9R0.1 CNC(=O)NCCC(C)O Amb27971912 [0,1,0,0,0,1|1,0,1]=4 2669 B9R0.1 CNC(=O)NOCC(=O)O Amb27970392 [0,1,0,0,0,1|0,0,0]=2 2670 B9R0.1 CNC(=S)NCCC(C)=O Amb27408306 [0,1,0,0,0,1|1,1,0]=4 2671 B9R0.1 CNC(=S)NOCC(=O)O Amb27201706 [0,1,0,0,0,1|0,1,0]=3 2672 B9R0.1 COC(=O)CCCC(=O)Cl Amb3939328 [0,1,0,0,0,1|2,0,0]=4 2673 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,1,0,0,0,1|1,0,0]=3 2674 B9R0.1 COC(=O)CCCC(=O)[O-] Amb33948529 [0,1,0,0,0,1|1,0,1]=4 2675 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,1,0,0,0,1|1,0,0]=3 2676 B9R0.1 COC(=O)CCCC(N)=O Amb27882411 [0,1,0,0,0,1|2,0,0]=4 2677 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,1,0,0,0,1|2,0,0]=4 2678 B9R0.1 COC(=O)CCNC(C)=O Amb15691935 [0,1,0,0,0,1|0,0,0]=2 2679 B9R0.1 COC(=O)CCNC(C)C Amb9203616 [0,1,0,0,0,1|1,0,1]=4 2680 B9R0.1 COC(=O)CCNC(N)=O Amb22740124 [0,1,0,0,0,1|1,0,0]=3 2681 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,1,0,0,0,1|2,0,0]=4 2682 B9R0.1 COC(=O)CCOC(C)=O Amb27972208 [0,1,0,0,0,1|1,0,0]=3 2683 B9R0.1 COC(=O)CCSC(=O)Cl Amb26446360 [0,1,0,0,0,1|2,0,0]=4 2684 B9R0.1 COC(=O)CCSC(N)=O Amb28254662 [0,1,0,0,0,1|2,0,0]=4 2685 B9R0.1 COC(=O)CC\N=C(/C)N Amb27826068 [0,1,0,0,0,1|1,0,1]=4 2686 B9R0.1 COC(=O)CNCC(=O)O Amb7766422 [0,1,0,0,0,1|0,0,0]=2 2687 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,1,0,0,0,1|1,0,1]=4 2688 B9R0.1 COC(=O)CNCC(C)O Amb9247006 [0,1,0,0,0,1|0,0,2]=4 2689 B9R0.1 COC(=O)CNCN(C)C Amb28041215 [0,1,0,0,0,1|2,0,0]=4 2690 B9R0.1 COC(=O)COCC(=O)O Amb25305044 [0,1,0,0,0,1|1,0,0]=3 2691 B9R0.1 COC(=O)COCC(C)=O Amb8392403 [0,1,0,0,0,1|1,0,0]=3 2692 B9R0.1 COC(=O)CSCC(=O)O Amb33532171 [0,1,0,0,0,1|1,0,0]=3 2693 B9R0.1 COC(=O)CSCC(C)=O Amb2444691 [0,1,0,0,0,1|1,0,0]=3 2694 B9R0.1 COC(=O)C\C=C\C(C)=O Amb25205440 [0,1,0,0,0,1|1,0,0]=3 2695 B9R0.1 COC(=O)C\N=C\C(C)=O Amb28052024 [0,1,0,0,0,1|0,0,1]=3 2696 B9R0.1 COC(=O)NCC=C(Cl)Cl Amb35690708 [0,1,0,0,0,1|2,0,0]=4 2697 B9R0.1 COC(=O)NCCC(=O)O Amb6468177 [0,1,0,0,0,1|0,0,0]=2 2698 B9R0.1 COC(=O)NCC[C@H](C)O Amb27663109 [0,1,0,0,0,1|1,0,1]=4 2699 B9R0.1 COC(=O)N\C=C/C(C)=O Amb27627638 [0,1,0,0,0,1|1,0,1]=4 2700 B9R0.1 COC(=O)N\C=C/C(N)=O Amb28341305 [0,1,0,0,0,1|1,0,1]=4 2701 B9R0.1 COC(=O)N\C=C\C(=O)Cl Amb27838039 [0,1,0,0,0,1|1,0,1]=4 2702 B9R0.1 COC(=O)N\N=C\C(=O)O Amb24427251 [0,1,0,0,0,1|0,0,1]=3 2703 B9R0.1 COC(=O)OC#CC(C)=O Amb24415049 [0,1,0,0,0,1|1,0,1]=4 2704 B9R0.1 COC(=O)OCCC(C)=O Amb28049880 [0,1,0,0,0,1|1,0,0]=3 2705 B9R0.1 COC(=O)\C=C/NC(C)=O Amb28067616 [0,1,0,0,0,1|0,0,1]=3 2706 B9R0.1 COC(=O)\C=N\NC(N)=O Amb28050079 [0,1,0,0,0,1|1,0,1]=4 2707 B9R0.1 COC(=S)NCCC(N)=O Amb28126714 [0,1,0,0,0,1|1,1,0]=4 2708 B9R0.1 COC(=S)N\N=C\C(=O)O Amb24100367 [0,1,0,0,0,1|0,1,1]=4 2709 B9R0.1 COC(=S)SCCC(=O)O Amb27983821 [0,1,0,0,0,1|1,1,0]=4 2710 B9R0.1 COC(C)CCNC(C)=O Amb27260083 [0,1,0,0,0,1|1,0,1]=4 2711 B9R0.1 COC(C)CONC(C)=O Amb27856871 [0,1,0,0,0,1|1,0,1]=4 2712 B9R0.1 CON(C)CCNC(C)=O Amb27822674 [0,1,0,0,0,1|2,0,0]=4 2713 B9R0.1 CS(=O)CCNC(=O)CCl Amb27852973 [0,1,0,0,0,1|2,0,0]=4 2714 B9R0.1 CS(=O)CCNC(=O)CN Amb27451738 [0,1,0,0,0,1|2,0,0]=4 2715 B9R0.1 CSC(=N)NCCC(=O)O Amb28193743 [0,1,0,0,0,1|1,0,0]=3 2716 B9R0.1 C\C(=C/Cl)CNCC(N)=O Amb27979447 [0,1,0,0,0,1|2,0,0]=4 2717 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,1,0,0,0,1|1,0,1]=4 2718 B9R0.1 C\C(CCl)=N/OCC(=O)O Amb27831952 [0,1,0,0,0,1|1,0,1]=4 2719 B9R0.1 C\C(CF)=N/OCC(=O)O Amb27174879 [0,1,0,0,0,1|1,0,1]=4 2720 B9R0.1 C\N=C(/N)N\N=C\C(=O)O Amb27216735 [0,1,0,0,0,1|1,0,1]=4 2721 B9R0.1 N=C(CN)NCCC(=O)O Amb28346899 [0,1,0,0,0,1|1,0,0]=3 2722 B9R0.1 NC(=O)CCNC(=O)CBr Amb27786158 [0,1,0,0,0,1|1,0,0]=3 2723 B9R0.1 NC(=O)CCNC(=O)CCl Amb9415901 [0,1,0,0,0,1|1,0,0]=3 2724 B9R0.1 NC(=O)CCNC(=O)CS Amb27981235 [0,1,0,0,0,1|1,0,0]=3 2725 B9R0.1 NC(=O)CCOC(=O)CO Amb28136694 [0,1,0,0,0,1|2,0,0]=4 2726 B9R0.1 NC(=O)CNC\C(N)=N\O Amb27949308 [0,1,0,0,0,1|2,0,0]=4 2727 B9R0.1 NC(=O)CONC(=O)CCl Amb27945304 [0,1,0,0,0,1|1,0,0]=3 2728 B9R0.1 NC(=O)CSCC(=O)NO Amb27764593 [0,1,0,0,0,1|2,0,0]=4 2729 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,1,0,0,0,1|1,0,0]=3 2730 B9R0.1 NCC(=O)CNCB(O)O Amb24591556 [0,1,0,0,0,1|1,0,1]=4 2731 B9R0.1 NCC(=O)CNCC(=O)O Amb27979091 [0,1,0,0,0,1|0,0,0]=2 2732 B9R0.1 NCC(=O)NCC=C(Cl)Cl Amb29857483 [0,1,0,0,0,1|2,0,0]=4 2733 B9R0.1 NCC(=O)NCCC(=O)O Amb4018061 [0,1,0,0,0,1|0,0,0]=2 2734 B9R0.1 NCC(=O)NNCC(N)=O Amb28313796 [0,1,0,0,0,1|1,0,0]=3 2735 B9R0.1 NCC(=O)ONCC(=O)O Amb27625948 [0,1,0,0,0,1|0,0,0]=2 2736 B9R0.1 N\C(CNCC(=O)O)=N/O Amb27881601 [0,1,0,0,0,1|1,0,1]=4 2737 B9R0.1 N\N=C(/N)NCCC(=O)O Amb24682101 [0,1,0,0,0,1|2,0,0]=4 2738 B9R0.1 O=C(CBr)NCC=C(Cl)Cl Amb35684020 [0,1,0,0,0,1|2,0,0]=4 2739 B9R0.1 O=C(CCl)NCC=C(Cl)Cl Amb35684019 [0,1,0,0,0,1|2,0,0]=4 2740 B9R0.1 O=C(CS)NCC=C(Cl)Cl Amb35690529 [0,1,0,0,0,1|2,0,0]=4 2741 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,1,0,0,0,1|1,0,0]=3 2742 B9R0.1 O=C(O)CCCC(=O)NO Amb27494720 [0,1,0,0,0,1|2,0,0]=4 2743 B9R0.1 O=C(O)CCNC(=O)CBr Amb17609911 [0,1,0,0,0,1|0,0,0]=2 2744 B9R0.1 O=C(O)CCNC(=O)CCl Amb2781692 [0,1,0,0,0,1|0,0,0]=2 2745 B9R0.1 O=C(O)CCNC(=O)CO Amb24478846 [0,1,0,0,0,1|0,0,0]=2 2746 B9R0.1 O=C(O)\C=C\NC(=O)CCl Amb27494076 [0,1,0,0,0,1|0,0,1]=3 2747 B9R0.7 C=C(Br)CNC(C)C(=O)O Amb18303282 [0,1,0,0,0,1|1,0,1]=4 2748 B9R0.7 C=C(Br)CN[C@@H](C)C(=O)O Amb27174841 [0,1,0,0,0,1|1,0,1]=4 2749 B9R0.7 C=C(C)C(=O)NCC(=O)O Amb16232088 [0,1,0,0,0,1|1,0,0]=3 2750 B9R0.7 C=C(C)C(=O)OCC(=O)O Amb18644056 [0,1,0,0,0,1|2,0,0]=4 2751 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [0,1,0,0,0,1|2,0,0]=4 2752 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,1,0,0,0,1|2,0,0]=4 2753 B9R0.7 C=C(C)CCC(=C)C(=O)O Amb28047421 [0,1,0,0,0,1|2,0,0]=4 2754 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,1,0,0,0,1|2,0,0]=4 2755 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,1,0,0,0,1|2,0,0]=4 2756 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,1,0,0,0,1|2,0,0]=4 2757 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,1,0,0,0,1|2,0,0]=4 2758 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,1,0,0,0,1|2,0,0]=4 2759 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [0,1,0,0,0,1|2,0,0]=4 2760 B9R0.7 C=C(CCC(=O)O)C(=O)O Amb8391367 [0,1,0,0,0,1|2,0,0]=4 2761 B9R0.7 C=C(CCC(=O)O)C(C)=O Amb27814984 [0,1,0,0,0,1|1,0,0]=3 2762 B9R0.7 C=C(CCC(C)=O)C(C)=O Amb25303019 [0,1,0,0,0,1|2,0,0]=4 2763 B9R0.7 C=C(COC(C)=O)C(C)=O Amb25359020 [0,1,0,0,0,1|2,0,0]=4 2764 B9R0.7 CC(=N)N(C)CCC(=O)O Amb27242469 [0,1,0,0,0,1|1,0,0]=3 2765 B9R0.7 CC(=O)C(=O)NCC(=O)O Amb17593639 [0,1,0,0,0,1|0,0,0]=2 2766 B9R0.7 CC(=O)C(=O)NCC(C)O Amb27197014 [0,1,0,0,0,1|1,0,1]=4 2767 B9R0.7 CC(=O)C(=O)OCC(=O)O Amb28126708 [0,1,0,0,0,1|1,0,0]=3 2768 B9R0.7 CC(=O)C(=O)\C=C\C(=O)O Amb27803733 [0,1,0,0,0,1|1,0,1]=4 2769 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [0,1,0,0,0,1|1,0,0]=3 2770 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,1,0,0,0,1|2,0,0]=4 2771 B9R0.7 CC(=O)C(C)SCC(N)=O Amb28206699 [0,1,0,0,0,1|2,0,0]=4 2772 B9R0.7 CC(=O)C(F)CCC(=O)O Amb27620074 [0,1,0,0,0,1|1,0,0]=3 2773 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,1,0,0,0,1|1,0,0]=3 2774 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [0,1,0,0,0,1|1,0,0]=3 2775 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,1,0,0,0,1|2,0,0]=4 2776 B9R0.7 CC(=O)CCC(Cl)C(C)=O Amb27444965 [0,1,0,0,0,1|2,0,0]=4 2777 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,1,0,0,0,1|1,0,0]=3 2778 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,1,0,0,0,1|1,0,0]=3 2779 B9R0.7 CC(=O)CCC(N)C(N)=O Amb26649117 [0,1,0,0,0,1|2,0,0]=4 2780 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,1,0,0,0,1|1,0,0]=3 2781 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,1,0,0,0,1|1,0,0]=3 2782 B9R0.7 CC(=O)CNC(=O)C(=O)O Amb24480846 [0,1,0,0,0,1|0,0,1]=3 2783 B9R0.7 CC(=O)COC(=O)C(C)=O Amb27212481 [0,1,0,0,0,1|2,0,0]=4 2784 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [0,1,0,0,0,1|1,0,0]=3 2785 B9R0.7 CC(=O)CSC(C)C(N)=O Amb27949123 [0,1,0,0,0,1|2,0,0]=4 2786 B9R0.7 CC(=O)C\C=C(/C)C(C)=O Amb27264520 [0,1,0,0,0,1|2,0,0]=4 2787 B9R0.7 CC(=O)N(C)CCC(=O)O Amb2691290 [0,1,0,0,0,1|0,0,0]=2 2788 B9R0.7 CC(=O)N(C)CCC(N)=S Amb33533008 [0,1,0,0,0,1|1,1,0]=4 2789 B9R0.7 CC(=O)N(O)CCC(=O)O Amb28050128 [0,1,0,0,0,1|0,0,0]=2 2790 B9R0.7 CC(=O)NCC(C)=C(C)C Amb28282658 [0,1,0,0,0,1|2,0,0]=4 2791 B9R0.7 CC(=O)NCC(C)S(C)=O Amb28137643 [0,1,0,0,0,1|2,0,0]=4 2792 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,1,0,0,0,1|0,0,0]=2 2793 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [0,1,0,0,0,1|0,0,0]=2 2794 B9R0.7 CC(=O)NOC(C)C(N)=O Amb28206966 [0,1,0,0,0,1|1,0,0]=3 2795 B9R0.7 CC(=O)OCC(=O)C(C)=O Amb25094676 [0,1,0,0,0,1|2,0,0]=4 2796 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [0,1,0,0,0,1|1,0,0]=3 2797 B9R0.7 CC(=O)OCC(C)C(C)=O Amb27471984 [0,1,0,0,0,1|2,0,0]=4 2798 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,1,0,0,0,1|1,0,0]=3 2799 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,1,0,0,0,1|1,0,0]=3 2800 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [0,1,0,0,0,1|1,0,0]=3 2801 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [0,1,0,0,0,1|1,0,0]=3 2802 B9R0.7 CC(=O)OC[C@H](C)C(C)=O Amb28049898 [0,1,0,0,0,1|2,0,0]=4 2803 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,1,0,0,0,1|1,0,0]=3 2804 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,1,0,0,0,1|1,0,0]=3 2805 B9R0.7 CC(=O)ONC(C)C(=O)O Amb27765574 [0,1,0,0,0,1|0,0,0]=2 2806 B9R0.7 CC(=O)O\C=C(\F)C(=O)O Amb27236545 [0,1,0,0,0,1|1,0,1]=4 2807 B9R0.7 CC(=O)O\N=C(/C)C(=O)O Amb27473311 [0,1,0,0,0,1|0,0,2]=4 2808 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [0,1,0,0,0,1|1,0,0]=3 2809 B9R0.7 CC(=O)SCC(C)C(N)=O Amb22586594 [0,1,0,0,0,1|2,0,0]=4 2810 B9R0.7 CC(=O)SCC(Cl)C(=O)Cl Amb28247162 [0,1,0,0,0,1|2,0,0]=4 2811 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,1,0,0,0,1|1,0,0]=3 2812 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [0,1,0,0,0,1|1,0,0]=3 2813 B9R0.7 CC(=O)SC[C@@H](C)C(=O)Cl Amb26641827 [0,1,0,0,0,1|2,0,0]=4 2814 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [0,1,0,0,0,1|1,0,0]=3 2815 B9R0.7 CC(=O)SC[C@H](C)C(=O)Cl Amb25230202 [0,1,0,0,0,1|2,0,0]=4 2816 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [0,1,0,0,0,1|1,0,0]=3 2817 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,1,0,0,0,1|1,0,1]=4 2818 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,1,0,0,0,1|2,0,0]=4 2819 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,1,0,0,0,1|2,0,0]=4 2820 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,1,0,0,0,1|2,0,0]=4 2821 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,1,0,0,0,1|2,0,0]=4 2822 B9R0.7 CC(C)=NOC(C)C(=O)O Amb9814220 [0,1,0,0,0,1|1,0,1]=4 2823 B9R0.7 CC(C)=NO[C@H](C)C(=O)O Amb27831924 [0,1,0,0,0,1|1,0,1]=4 2824 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,1,0,0,0,1|1,0,1]=4 2825 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,1,0,0,0,1|1,0,1]=4 2826 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,0,0,0,1|1,0,1]=4 2827 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,0,0,0,1|1,0,1]=4 2828 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,1,0,0,0,1|1,0,1]=4 2829 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,1,0,0,0,1|1,0,1]=4 2830 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,1,0,0,0,1|1,0,1]=4 2831 B9R0.7 CC(CCC(=O)O)C(=O)O Amb6296609 [0,1,0,0,0,1|2,0,0]=4 2832 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [0,1,0,0,0,1|2,0,0]=4 2833 B9R0.7 CC(CNC(=N)N)C(=O)O Amb28050103 [0,1,0,0,0,1|2,0,0]=4 2834 B9R0.7 CC(CNC(N)=O)C(=O)O Amb18298054 [0,1,0,0,0,1|1,0,0]=3 2835 B9R0.7 CC(CNN(C)C)C(=O)O Amb27855116 [0,1,0,0,0,1|2,0,0]=4 2836 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,1,0,0,0,1|1,0,1]=4 2837 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,1,0,0,0,1|1,0,1]=4 2838 B9R0.7 CC(NCC(=O)O)C(=O)O Amb26506272 [0,1,0,0,0,1|1,0,0]=3 2839 B9R0.7 CC(NCC(=O)O)C(=O)O Amb3427836 [0,1,0,0,0,1|1,0,0]=3 2840 B9R0.7 CC(NCC(=O)O)C(N)=O Amb9285399 [0,1,0,0,0,1|1,0,0]=3 2841 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,1,0,0,0,1|0,0,2]=4 2842 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,1,0,0,0,1|0,0,2]=4 2843 B9R0.7 CC(NNC(N)=O)C(=O)O Amb26391983 [0,1,0,0,0,1|1,0,0]=3 2844 B9R0.7 CC(O)C(C)NCC(=O)O Amb27444950 [0,1,0,0,0,1|0,0,2]=4 2845 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,1,0,0,0,1|0,0,2]=4 2846 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,1,0,0,0,1|0,0,2]=4 2847 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,1,0,0,0,1|0,0,2]=4 2848 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,1,0,0,0,1|0,1,1]=4 2849 B9R0.7 CC(SCC(=O)O)C(=O)O Amb2431034 [0,1,0,0,0,1|2,0,0]=4 2850 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,1,0,0,0,1|2,0,0]=4 2851 B9R0.7 CN(C)C(=S)NCC(=O)O Amb25708504 [0,1,0,0,0,1|2,0,0]=4 2852 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [0,1,0,0,0,1|2,0,0]=4 2853 B9R0.7 CN(CCC(=O)O)C(=N)N Amb27389762 [0,1,0,0,0,1|2,0,0]=4 2854 B9R0.7 CN(CCC(=O)O)C(N)=O Amb18984979 [0,1,0,0,0,1|1,0,0]=3 2855 B9R0.7 CN(CCC(=O)O)[N+](=O)[O-] Amb23481534 [0,1,0,0,0,1|2,0,0]=4 2856 B9R0.7 CN(CCC(N)=O)C(N)=O Amb28316022 [0,1,0,0,0,1|2,0,0]=4 2857 B9R0.7 CN(N)C(=S)NCC(=O)O Amb26318925 [0,1,0,0,0,1|2,0,0]=4 2858 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,1,0,0,0,1|2,0,0]=4 2859 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [0,1,0,0,0,1|2,0,0]=4 2860 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,1,0,0,0,1|2,0,0]=4 2861 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,1,0,0,0,1|2,0,0]=4 2862 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [0,1,0,0,0,1|1,0,0]=3 2863 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,1,0,0,0,1|1,0,1]=4 2864 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O Amb22799543 [0,1,0,0,0,1|2,0,0]=4 2865 B9R0.7 C[C@@H](CNC(N)=O)C(=O)O Amb10844047 [0,1,0,0,0,1|1,0,0]=3 2866 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 2867 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,1,0,0,0,1|1,0,1]=4 2868 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,1,0,0,0,1|1,0,1]=4 2869 B9R0.7 C[C@@H](NCC(=O)O)C(=O)O Amb22748947 [0,1,0,0,0,1|1,0,0]=3 2870 B9R0.7 C[C@H](CCC(=O)O)C(=O)O Amb22225175 [0,1,0,0,0,1|2,0,0]=4 2871 B9R0.7 C[C@H](CNC(N)=O)C(=O)O Amb27235917 [0,1,0,0,0,1|1,0,0]=3 2872 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,1,0,0,0,1|1,0,1]=4 2873 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,1,0,0,0,1|1,0,1]=4 2874 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,1,0,0,0,1|1,0,1]=4 2875 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb25133540 [0,1,0,0,0,1|1,0,0]=3 2876 B9R0.7 C[C@H](NCC(=O)O)C(=O)O Amb33803333 [0,1,0,0,0,1|1,0,0]=3 2877 B9R0.7 C[C@H](NCC(=O)O)C(N)=O Amb27771293 [0,1,0,0,0,1|1,0,0]=3 2878 B9R0.7 C\C(=C/CC(=O)O)C(=O)O Amb27214024 [0,1,0,0,0,1|2,0,0]=4 2879 B9R0.7 C\C(=C\CC(=O)O)C(=O)O Amb25960751 [0,1,0,0,0,1|2,0,0]=4 2880 B9R0.7 C\C(=N/CC(=O)O)C(=O)O Amb27759453 [0,1,0,0,0,1|1,0,1]=4 2881 B9R0.7 C\C(=N/NC(N)=O)C(=O)O Amb9901909 [0,1,0,0,0,1|1,0,1]=4 2882 B9R0.7 C\C(Cl)=C/CC(Cl)C(=O)O Amb27212547 [0,1,0,0,0,1|2,0,0]=4 2883 B9R0.7 C\C(Cl)=C\CC(Cl)C(=O)O Amb17594711 [0,1,0,0,0,1|2,0,0]=4 2884 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,1,0,0,0,1|2,0,0]=4 2885 B9R0.7 N=C(N)C(=N)NCC(=O)O Amb27817484 [0,1,0,0,0,1|2,0,0]=4 2886 B9R0.7 N=C(N)NCC(N)C(=O)O Amb22169574 [0,1,0,0,0,1|2,0,0]=4 2887 B9R0.7 N=C(N)NCC(N)C(=O)O Amb9871390 [0,1,0,0,0,1|2,0,0]=4 2888 B9R0.7 N=C(N)NCC(O)C(=O)O Amb27229727 [0,1,0,0,0,1|2,0,0]=4 2889 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb28058768 [0,1,0,0,0,1|2,0,0]=4 2890 B9R0.7 N=C(N)NC[C@@H](N)C(=O)O Amb31292962 [0,1,0,0,0,1|2,0,0]=4 2891 B9R0.7 N=C(N)NC[C@H](N)C(=O)O Amb27230623 [0,1,0,0,0,1|2,0,0]=4 2892 B9R0.7 NC(=O)C(=O)NCC(=O)O Amb28050058 [0,1,0,0,0,1|1,0,0]=3 2893 B9R0.7 NC(=O)C(N)CCC(=O)O Amb18644256 [0,1,0,0,0,1|2,0,0]=4 2894 B9R0.7 NC(=O)CCC(=O)C(=O)O Amb26369364 [0,1,0,0,0,1|2,0,0]=4 2895 B9R0.7 NC(=O)CCC(Br)C(=O)O Amb27828829 [0,1,0,0,0,1|2,0,0]=4 2896 B9R0.7 NC(=O)CCC(N)C(=O)O Amb9702792 [0,1,0,0,0,1|2,0,0]=4 2897 B9R0.7 NC(=O)CC[C@@H](Br)C(=O)O Amb28049993 [0,1,0,0,0,1|2,0,0]=4 2898 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O Amb2688618 [0,1,0,0,0,1|2,0,0]=4 2899 B9R0.7 NC(=O)CC[C@H](N)C(=O)O Amb6600045 [0,1,0,0,0,1|2,0,0]=4 2900 B9R0.7 NC(=O)CNC(=O)C(=O)O Amb9303805 [0,1,0,0,0,1|1,0,1]=4 2901 B9R0.7 NC(=O)NCC(F)C(=O)O Amb17610485 [0,1,0,0,0,1|1,0,0]=3 2902 B9R0.7 NC(=O)NCC(N)C(=O)O Amb4037018 [0,1,0,0,0,1|1,0,0]=3 2903 B9R0.7 NC(=O)NCC(N)C(N)=O Amb27646620 [0,1,0,0,0,1|2,0,0]=4 2904 B9R0.7 NC(=O)NCC(O)C(=O)O Amb27464106 [0,1,0,0,0,1|1,0,0]=3 2905 B9R0.7 NC(=O)NCC(O)C(N)=O Amb28384014 [0,1,0,0,0,1|2,0,0]=4 2906 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O Amb10068479 [0,1,0,0,0,1|1,0,0]=3 2907 B9R0.7 NC(=O)NC[C@H](N)C(=O)O Amb6298794 [0,1,0,0,0,1|1,0,0]=3 2908 B9R0.7 NC(=O)N\C=C(/F)C(=O)O Amb17614482 [0,1,0,0,0,1|1,0,1]=4 2909 B9R0.7 NC(=O)OCC(N)C(=O)O Amb26968173 [0,1,0,0,0,1|2,0,0]=4 2910 B9R0.7 NC(=O)OC[C@H](N)C(=O)O Amb28126945 [0,1,0,0,0,1|2,0,0]=4 2911 B9R0.7 NC(=O)SCC(N)C(=O)O Amb3993051 [0,1,0,0,0,1|2,0,0]=4 2912 B9R0.7 NC(=O)SC[C@@H](N)C(=O)O Amb10072293 [0,1,0,0,0,1|2,0,0]=4 2913 B9R0.7 NC(=O)SC[C@H](N)C(=O)O Amb22735296 [0,1,0,0,0,1|2,0,0]=4 2914 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O Amb22745051 [0,1,0,0,0,1|2,0,0]=4 2915 B9R0.7 NC(=O)[C@H](N)CCC(=O)O Amb24557281 [0,1,0,0,0,1|2,0,0]=4 2916 B9R0.7 NC(CCC(=O)Cl)C(=O)O Amb27816376 [0,1,0,0,0,1|2,0,0]=4 2917 B9R0.7 NC(CCC(=O)O)C(=O)O Amb8395158 [0,1,0,0,0,1|2,0,0]=4 2918 B9R0.7 NC(CCC(=O)O)C(=O)O Amb9703098 [0,1,0,0,0,1|2,0,0]=4 2919 B9R0.7 NC(CCC(=O)O)C(=O)[O-] Amb4014785 [0,1,0,0,0,1|2,0,0]=4 2920 B9R0.7 NC(CN[N+](=O)[O-])C(=O)O Amb27857570 [0,1,0,0,0,1|2,0,0]=4 2921 B9R0.7 NC(CSC(=O)O)C(=O)O Amb27491502 [0,1,0,0,0,1|2,0,0]=4 2922 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb34915082 [0,1,0,0,0,1|2,0,0]=4 2923 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb3940322 [0,1,0,0,0,1|2,0,0]=4 2924 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O Amb8513626 [0,1,0,0,0,1|2,0,0]=4 2925 B9R0.7 N[C@@H](CCC(=O)O)C(=O)[O-] Amb22745619 [0,1,0,0,0,1|2,0,0]=4 2926 B9R0.7 N[C@@H](CSC(=O)O)C(=O)O Amb27666945 [0,1,0,0,0,1|2,0,0]=4 2927 B9R0.7 N[C@H](CCC(=O)O)C(=O)O Amb2720565 [0,1,0,0,0,1|2,0,0]=4 2928 B9R0.7 O=C(Cl)SCC(=O)C(=O)O Amb33070040 [0,1,0,0,0,1|2,0,0]=4 2929 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb1154117 [0,1,0,0,0,1|2,0,0]=4 2930 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb16232496 [0,1,0,0,0,1|2,0,0]=4 2931 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb22746233 [0,1,0,0,0,1|2,0,0]=4 2932 B9R0.7 O=C(O)CCC(Br)C(=O)O Amb26568399 [0,1,0,0,0,1|2,0,0]=4 2933 B9R0.7 O=C(O)CCC(Cl)C(=O)O Amb17594149 [0,1,0,0,0,1|2,0,0]=4 2934 B9R0.7 O=C(O)CCC(O)C(=O)O Amb18124864 [0,1,0,0,0,1|2,0,0]=4 2935 B9R0.7 O=C(O)CCC(S)C(=O)O Amb27983646 [0,1,0,0,0,1|2,0,0]=4 2936 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O Amb22799690 [0,1,0,0,0,1|2,0,0]=4 2937 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O Amb26885416 [0,1,0,0,0,1|2,0,0]=4 2938 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O Amb26590823 [0,1,0,0,0,1|2,0,0]=4 2939 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Amb25948742 [0,1,0,0,0,1|2,0,0]=4 2940 B9R0.7 O=C(O)CNC(=O)C(=O)O Amb2447304 [0,1,0,0,0,1|1,0,0]=3 2941 B9R0.7 O=C(O)COC(=O)C(=O)O Amb28050116 [0,1,0,0,0,1|2,0,0]=4 2942 B9R0.7 O=C(O)C\C=C(/Cl)C(=O)O Amb27863082 [0,1,0,0,0,1|2,0,0]=4 2943 B9R0.7 O=C([O-])CCC(=O)C(=O)O Amb22231405 [0,1,0,0,0,1|2,0,0]=4 2944 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,1,0,0,0,1|2,0,0]=4 2945 B9R0.53 C=C(NC(C)=O)SC(C)=O Amb28428632 [0,1,0,0,0,1|1,0,1]=4 2946 B9R0.53 CC(=O)CC(=O)CC(C)=O Amb4018226 [0,1,0,0,0,1|2,0,0]=4 2947 B9R0.53 CC(=O)CC(=O)NC(C)=O Amb2410281 [0,1,0,0,0,1|1,0,0]=3 2948 B9R0.53 CC(=O)CC(=O)NC(N)=O Amb17593618 [0,1,0,0,0,1|2,0,0]=4 2949 B9R0.53 CC(=O)CC(=O)OC(C)=O Amb28460740 [0,1,0,0,0,1|2,0,0]=4 2950 B9R0.53 CC(=O)CC(C)OC(N)=O Amb27196213 [0,1,0,0,0,1|2,0,0]=4 2951 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [0,1,0,0,0,1|1,0,0]=3 2952 B9R0.53 CC(=O)C[C@H](C)OC(C)=O Amb25863249 [0,1,0,0,0,1|2,0,0]=4 2953 B9R0.53 CC(=O)NC(=N)NC(C)=O Amb24478229 [0,1,0,0,0,1|1,0,1]=4 2954 B9R0.53 CC(=O)NC(=O)CC(=O)O Amb24671240 [0,1,0,0,0,1|0,0,0]=2 2955 B9R0.53 CC(=O)NC(=O)NC(C)=O Amb22524201 [0,1,0,0,0,1|1,0,1]=4 2956 B9R0.53 CC(=O)NC(=O)NC(N)=O Amb28057137 [0,1,0,0,0,1|1,0,1]=4 2957 B9R0.53 CC(=O)NC(=O)\C=C(/C)O Amb27789891 [0,1,0,0,0,1|1,0,1]=4 2958 B9R0.53 CC(=O)NC(=O)\C=C(\C)O Amb27873079 [0,1,0,0,0,1|1,0,1]=4 2959 B9R0.53 CC(=O)NC(=S)NC(C)=O Amb28186603 [0,1,0,0,0,1|1,0,1]=4 2960 B9R0.53 CC(=O)NC(=S)NC(N)=O Amb27606325 [0,1,0,0,0,1|1,0,1]=4 2961 B9R0.53 CC(=O)NC(C)CC(=O)O Amb9007551 [0,1,0,0,0,1|0,0,0]=2 2962 B9R0.53 CC(=O)NC(C)CC(N)=O Amb27454423 [0,1,0,0,0,1|1,0,0]=3 2963 B9R0.53 CC(=O)NC(C)CC(N)=S Amb18800429 [0,1,0,0,0,1|1,1,0]=4 2964 B9R0.53 CC(=O)NC(C)CS(C)=O Amb27243706 [0,1,0,0,0,1|2,0,0]=4 2965 B9R0.53 CC(=O)NC(C)NC(C)=O Amb4035096 [0,1,0,0,0,1|1,0,0]=3 2966 B9R0.53 CC(=O)NN(C)CC(=O)O Amb24430379 [0,1,0,0,0,1|0,0,0]=2 2967 B9R0.53 CC(=O)N[C@@H](C)CC(=O)O Amb2372568 [0,1,0,0,0,1|0,0,0]=2 2968 B9R0.53 CC(=O)OC(C)OC(C)=O Amb8516628 [0,1,0,0,0,1|2,0,0]=4 2969 B9R0.53 CC(=O)O[C@@H](C)CC(=O)O Amb28340506 [0,1,0,0,0,1|1,0,0]=3 2970 B9R0.53 CC(=O)SC(C)CC(=O)O Amb4014288 [0,1,0,0,0,1|1,0,0]=3 2971 B9R0.53 CC(=O)[CH-]C(=O)CC(C)=O Amb28182517 [0,1,0,0,0,1|2,0,0]=4 2972 B9R0.53 CC(=O)\C=C(/C)CC(C)=O Amb24647875 [0,1,0,0,0,1|2,0,0]=4 2973 B9R0.53 CC(=O)\C=C(/O)CC(C)=O Amb27945526 [0,1,0,0,0,1|2,0,0]=4 2974 B9R0.53 CC(=O)\C=C(\C)CC(C)=O Amb25719264 [0,1,0,0,0,1|2,0,0]=4 2975 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,1,0,0,0,1|1,0,1]=4 2976 B9R0.53 CC(C)NC(=O)CC(=O)O Amb17399889 [0,1,0,0,0,1|1,0,1]=4 2977 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,1,0,0,0,1|1,0,1]=4 2978 B9R0.53 CC(CC(=O)O)CC(=O)O Amb2782854 [0,1,0,0,0,1|2,0,0]=4 2979 B9R0.53 CC(CC(=O)O)NC(=N)N Amb25696242 [0,1,0,0,0,1|2,0,0]=4 2980 B9R0.53 CC(CC(=O)O)NC(N)=O Amb9018480 [0,1,0,0,0,1|1,0,0]=3 2981 B9R0.53 CC(CC(=O)O)NN(C)C Amb28317947 [0,1,0,0,0,1|2,0,0]=4 2982 B9R0.53 CN(C)NC(=O)CC(=O)O Amb20246800 [0,1,0,0,0,1|2,0,0]=4 2983 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,1,0,0,0,1|1,0,0]=3 2984 B9R0.53 CN(CC(N)=O)CC(N)=O Amb27395331 [0,1,0,0,0,1|2,0,0]=4 2985 B9R0.53 CS(=O)C[C@H](N)CC(=O)O Amb27776743 [0,1,0,0,0,1|2,0,0]=4 2986 B9R0.53 C[C@@H](CC(N)=O)CC(=O)O Amb27404517 [0,1,0,0,0,1|2,0,0]=4 2987 B9R0.53 C\C(=C/C(=O)O)CC(=O)O Amb24556420 [0,1,0,0,0,1|2,0,0]=4 2988 B9R0.53 C\C(=C\C(=O)O)CC(=O)O Amb26421861 [0,1,0,0,0,1|2,0,0]=4 2989 B9R0.53 NC(=O)CC(=O)NC(N)=O Amb27668140 [0,1,0,0,0,1|2,0,0]=4 2990 B9R0.53 NC(=O)CC(N)CC(=O)O Amb27837998 [0,1,0,0,0,1|2,0,0]=4 2991 B9R0.53 NC(=O)C[C@@H](N)CC(=O)O Amb26023970 [0,1,0,0,0,1|2,0,0]=4 2992 B9R0.53 NC(=O)NC(=O)CC(=O)O Amb25887627 [0,1,0,0,0,1|1,0,0]=3 2993 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,1,0,0,0,1|2,0,0]=4 2994 B9R0.53 NC(CC(=O)O)CC(=O)O Amb6296966 [0,1,0,0,0,1|2,0,0]=4 2995 B9R0.53 NN(CC(=O)O)CC(=O)O Amb534841 [0,1,0,0,0,1|1,0,0]=3 2996 B9R0.53 O=C(O)CC(=O)CC(=O)O Amb6298323 [0,1,0,0,0,1|2,0,0]=4 2997 B9R0.53 O=C(O)CC(Br)CC(=O)O Amb28049987 [0,1,0,0,0,1|2,0,0]=4 2998 B9R0.53 O=C(O)CC(O)CC(=O)O Amb17615401 [0,1,0,0,0,1|2,0,0]=4 2999 B9R0.53 O=C(O)CS(=O)CC(=O)O Amb6364793 [0,1,0,0,0,1|2,0,0]=4 3000 B9R0.53 O=C(O)\C=C(\Cl)CC(=O)O Amb2612119 [0,1,0,0,0,1|2,0,0]=4 3001 B9R0.53 [NH3+]N(CC(=O)O)CC(=O)O Amb23453377 [0,1,0,0,0,1|1,0,0]=3 3002 B9R0.56 CC(=O)CCNS(C)(=O)=O Amb17102926 [0,1,0,0,0,1|2,0,0]=4 3003 B9R0.56 CC(=O)NCCS(=O)(=O)O Amb26916542 [0,1,0,0,0,1|1,0,0]=3 3004 B9R0.56 CC(=O)NCCS(=O)(=O)[O-] Amb31031083 [0,1,0,0,0,1|1,0,1]=4 3005 B9R0.56 CC(=O)NCCS(C)(=O)=O Amb16971455 [0,1,0,0,0,1|1,0,1]=4 3006 B9R0.56 CC(=O)NCCS(N)(=O)=O Amb33536942 [0,1,0,0,0,1|1,0,1]=4 3007 B9R0.56 CC(=O)SCCS(=O)(=O)O Amb21857874 [0,1,0,0,0,1|2,0,0]=4 3008 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,1,0,0,0,1|1,0,1]=4 3009 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,1,0,0,0,1|1,0,1]=4 3010 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [0,1,0,0,0,1|1,0,1]=4 3011 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [0,1,0,0,0,1|1,0,1]=4 3012 B9R0.56 CP(=O)(O)CCCC(=O)O Amb24524573 [0,1,0,0,0,1|2,0,0]=4 3013 B9R0.56 CP(C)(=O)CNCC(=O)O Amb25339632 [0,1,0,0,0,1|1,0,0]=3 3014 B9R0.56 CS(=O)(=O)CCCC(=O)O Amb17503668 [0,1,0,0,0,1|2,0,0]=4 3015 B9R0.56 CS(=O)(=O)NCCC(=O)Cl Amb5742641 [0,1,0,0,0,1|2,0,0]=4 3016 B9R0.56 CS(=O)(=O)NCCC(=O)O Amb33536611 [0,1,0,0,0,1|1,0,0]=3 3017 B9R0.56 CS(=O)(=O)NCCC(N)=O Amb17232584 [0,1,0,0,0,1|2,0,0]=4 3018 B9R0.56 CS(=O)(=O)SCCC(=O)O Amb10071647 [0,1,0,0,0,1|2,0,0]=4 3019 B9R0.56 NC(=O)CNCP(=O)(O)O Amb27606177 [0,1,0,0,0,1|2,0,0]=4 3020 B9R0.56 NC(=O)NCCS(=O)(=O)O Amb24710318 [0,1,0,0,0,1|2,0,0]=4 3021 B9R0.56 NP(=O)(O)CNCC(=O)O Amb27233408 [0,1,0,0,0,1|2,0,0]=4 3022 B9R0.56 NS(=O)(=O)NCCC(=O)O Amb6263261 [0,1,0,0,0,1|2,0,0]=4 3023 B9R0.56 O=C(O)CNCP(=O)(O)O Amb3941678 [0,1,0,0,0,1|2,0,0]=4 3024 B9R0.56 O=C(O)CNCP(=O)([O-])O Amb28995134 [0,1,0,0,0,1|2,0,0]=4 3025 B9R0.56 O=C([O-])CNCP(=O)(O)O Amb22731628 [0,1,0,0,0,1|2,0,0]=4 3026 B9R0.21 CC(C)(C)NCC(=O)NO Amb27830850 [0,2,0,0,0,0|1,0,1]=4 3027 B9R0.21 CC(C)(O)CNC(=O)CCl Amb25889876 [0,2,0,0,0,0|1,0,1]=4 3028 B9R0.21 CC(C)(O)CNC(=O)CN Amb27614853 [0,2,0,0,0,0|1,0,1]=4 3029 B9R0.21 CCC(=O)CNS(C)(=O)=O Amb27220397 [0,2,0,0,0,0|2,0,0]=4 3030 B9R0.21 CCC(=O)NCP(=O)(O)O Amb28341012 [0,2,0,0,0,0|1,0,0]=3 3031 B9R0.21 CNC(=O)CNS(C)(=N)=O Amb35688350 [0,2,0,0,0,0|2,0,0]=4 3032 B9R0.21 COC(=O)CCP(=O)(O)O Amb22388887 [0,2,0,0,0,0|2,0,0]=4 3033 B9R0.21 COC(=O)CCS(=O)(=O)O Amb17400246 [0,2,0,0,0,0|2,0,0]=4 3034 B9R0.21 COC(=O)CCS(C)(=N)=O Amb33621261 [0,2,0,0,0,0|2,0,0]=4 3035 B9R0.21 COC(=O)CCS(C)(=N)=O Amb33749083 [0,2,0,0,0,0|2,0,0]=4 3036 B9R0.21 COC(=O)CCS(C)(=O)=O Amb18177820 [0,2,0,0,0,0|2,0,0]=4 3037 B9R0.21 COC(=O)CC[S@](C)(=N)=O Amb33744014 [0,2,0,0,0,0|2,0,0]=4 3038 B9R0.21 COC(=O)CNC(C)(C)C Amb2779525 [0,2,0,0,0,0|1,0,1]=4 3039 B9R0.21 COC(=O)CNS(N)(=O)=O Amb25084936 [0,2,0,0,0,0|2,0,0]=4 3040 B9R0.21 COC(=O)COS(C)(=O)=O Amb27633552 [0,2,0,0,0,0|2,0,0]=4 3041 B9R0.21 COC(=O)NCP(=O)(O)O Amb27202848 [0,2,0,0,0,0|1,0,0]=3 3042 B9R0.21 CP(=O)(O)ONC(=O)CN Amb27803679 [0,2,0,0,0,0|2,0,0]=4 3043 B9R0.21 CS(=O)(=O)CCC(=O)NO Amb28049751 [0,2,0,0,0,0|2,0,0]=4 3044 B9R0.21 O=C(CCl)NCP(=O)(O)O Amb27823588 [0,2,0,0,0,0|1,0,0]=3 3045 B9R0.21 O=C(CO)CCP(=O)(O)O Amb27945519 [0,2,0,0,0,0|2,0,0]=4 3046 B9R0.23 C=C(C)CC(C)C(=O)OC Amb27857780 [0,2,0,0,0,0|2,0,0]=4 3047 B9R0.23 C=C(C)CC(Cl)C(=O)OC Amb28051409 [0,2,0,0,0,0|2,0,0]=4 3048 B9R0.23 C=C(C)CC(N)C(=O)OC Amb26654974 [0,2,0,0,0,0|2,0,0]=4 3049 B9R0.23 C=C(C)CC(O)C(=O)OC Amb24464009 [0,2,0,0,0,0|2,0,0]=4 3050 B9R0.23 C=C(C)CN(C)C(=O)CN Amb25052537 [0,2,0,0,0,0|2,0,0]=4 3051 B9R0.23 C=C(C)C[C@@H](O)C(=O)OC Amb27219810 [0,2,0,0,0,0|2,0,0]=4 3052 B9R0.23 C=C(CC(=O)O)C(=O)OC Amb4034427 [0,2,0,0,0,0|1,0,0]=3 3053 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,2,0,0,0,0|2,0,0]=4 3054 B9R0.23 C=C(NC(C)=O)C(=O)OC Amb10807388 [0,2,0,0,0,0|0,0,1]=3 3055 B9R0.23 C=CC(=O)N(C)CC(=O)O Amb6267159 [0,2,0,0,0,0|0,0,1]=3 3056 B9R0.23 C=CC(=O)N(O)CC(=O)O Amb27175200 [0,2,0,0,0,0|0,0,1]=3 3057 B9R0.23 CC(=O)NC(C)C(=O)NN Amb8998040 [0,2,0,0,0,0|1,0,0]=3 3058 B9R0.23 CC(=O)NC(C)C(O)CO Amb35660314 [0,2,0,0,0,0|0,0,2]=4 3059 B9R0.23 CC(=O)NC(C)\C(N)=N\O Amb28126933 [0,2,0,0,0,0|1,0,0]=3 3060 B9R0.23 CC(=O)OC(C)C(=O)C=O Amb27852090 [0,2,0,0,0,0|1,0,1]=4 3061 B9R0.23 CC(=O)OC(C)C(=O)NN Amb27769604 [0,2,0,0,0,0|2,0,0]=4 3062 B9R0.23 CC(=O)O[C@@H](C)[C@H](O)C=O Amb27194323 [0,2,0,0,0,0|1,0,1]=4 3063 B9R0.23 CC(C=O)C(C)CC(=O)O Amb27838156 [0,2,0,0,0,0|1,0,1]=4 3064 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,2,0,0,0,0|1,0,1]=4 3065 B9R0.23 CC(O)CN(C)C(=O)CS Amb27400508 [0,2,0,0,0,0|1,0,1]=4 3066 B9R0.23 CCC(=O)C(C)NC(N)=O Amb28350530 [0,2,0,0,0,0|2,0,0]=4 3067 B9R0.23 CCC(=O)C(C)NS(C)=O Amb28195270 [0,2,0,0,0,0|2,0,0]=4 3068 B9R0.23 CCC(=O)C(C)OC(C)=O Amb25909694 [0,2,0,0,0,0|2,0,0]=4 3069 B9R0.23 CCC(=O)N(C)CB(O)O Amb8392105 [0,2,0,0,0,0|1,0,1]=4 3070 B9R0.23 CCC(=O)N(C)CC(=O)O Amb1113094 [0,2,0,0,0,0|0,0,0]=2 3071 B9R0.23 CCC(=O)N(C)CC(C)=O Amb27448733 [0,2,0,0,0,0|1,0,0]=3 3072 B9R0.23 CCC(=O)N(C)CC(N)=O Amb17231983 [0,2,0,0,0,0|1,0,0]=3 3073 B9R0.23 CCC(=O)N(C)C[C@@H](C)O Amb28281581 [0,2,0,0,0,0|1,0,1]=4 3074 B9R0.23 CCC(=O)[C@H](C)NC(C)=O Amb27468250 [0,2,0,0,0,0|1,0,0]=3 3075 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,2,0,0,0,0|1,0,1]=4 3076 B9R0.23 CCS(=O)C(C)CC(=O)O Amb19012075 [0,2,0,0,0,0|2,0,0]=4 3077 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,2,0,0,0,0|2,0,0]=4 3078 B9R0.23 CN(CC(=O)Cl)C(=O)CCl Amb28400001 [0,2,0,0,0,0|1,0,0]=3 3079 B9R0.23 CN(CC(=O)O)C(=O)CCl Amb21956220 [0,2,0,0,0,0|0,0,0]=2 3080 B9R0.23 CN(CC(=O)O)C(=O)CN Amb21929346 [0,2,0,0,0,0|0,0,0]=2 3081 B9R0.23 CN(CC(=O)O)C(=O)CO Amb25848387 [0,2,0,0,0,0|0,0,0]=2 3082 B9R0.23 CN(CC(=O)O)C(=O)CS Amb27406788 [0,2,0,0,0,0|0,0,0]=2 3083 B9R0.23 CN(CC(N)=O)C(=O)CCl Amb8957103 [0,2,0,0,0,0|1,0,0]=3 3084 B9R0.23 CN(CC(N)=O)C(=O)CS Amb27588532 [0,2,0,0,0,0|1,0,0]=3 3085 B9R0.23 CNC(=N)N(C)CC(=O)O Amb27465437 [0,2,0,0,0,0|1,0,0]=3 3086 B9R0.23 CNC(=O)C(C)CC(N)=O Amb17334220 [0,2,0,0,0,0|2,0,0]=4 3087 B9R0.23 CNC(=O)C(C)NC(N)=O Amb27806674 [0,2,0,0,0,0|2,0,0]=4 3088 B9R0.23 CNC(=O)C(C)OC(C)=O Amb27168697 [0,2,0,0,0,0|2,0,0]=4 3089 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,2,0,0,0,0|1,0,0]=3 3090 B9R0.23 CNC(=O)C(N)CC(N)=O Amb18968977 [0,2,0,0,0,0|2,0,0]=4 3091 B9R0.23 CNC(=O)N(C)CC(=N)N Amb28280473 [0,2,0,0,0,0|2,0,0]=4 3092 B9R0.23 CNC(=O)[C@@H](C)NC(N)=O Amb35660536 [0,2,0,0,0,0|2,0,0]=4 3093 B9R0.23 CNC(=O)[C@@H](C)OC(C)=O Amb27253659 [0,2,0,0,0,0|2,0,0]=4 3094 B9R0.23 CNC(=O)[C@H](C)NC(C)=O Amb22800074 [0,2,0,0,0,0|1,0,0]=3 3095 B9R0.23 CNC(=O)\C(C)=C\C(=O)O Amb27202767 [0,2,0,0,0,0|1,0,1]=4 3096 B9R0.23 CNC(=S)[C@H](C)NC(C)=O Amb27597544 [0,2,0,0,0,0|1,1,0]=4 3097 B9R0.23 COC(=O)C(=O)CC(C)=O Amb1155424 [0,2,0,0,0,0|1,0,1]=4 3098 B9R0.23 COC(=O)C(=O)NC(N)=O Amb27229772 [0,2,0,0,0,0|1,0,1]=4 3099 B9R0.23 COC(=O)C(Br)CC(=O)O Amb18656999 [0,2,0,0,0,0|1,0,0]=3 3100 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [0,2,0,0,0,0|1,0,0]=3 3101 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,2,0,0,0,0|1,0,0]=3 3102 B9R0.23 COC(=O)C(C)C[PH](=O)O Amb27826336 [0,2,0,0,0,0|2,0,0]=4 3103 B9R0.23 COC(=O)C(C)NC(=N)N Amb27780112 [0,2,0,0,0,0|2,0,0]=4 3104 B9R0.23 COC(=O)C(C)NC(C)=O Amb24650565 [0,2,0,0,0,0|0,0,0]=2 3105 B9R0.23 COC(=O)C(C)NC(C)=S Amb27838032 [0,2,0,0,0,0|0,1,0]=3 3106 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,2,0,0,0,0|1,0,1]=4 3107 B9R0.23 COC(=O)C(C)NC(N)=O Amb20407420 [0,2,0,0,0,0|1,0,0]=3 3108 B9R0.23 COC(=O)C(C)NN(C)C Amb27985422 [0,2,0,0,0,0|2,0,0]=4 3109 B9R0.23 COC(=O)C(C)NS(C)=O Amb27431923 [0,2,0,0,0,0|1,0,0]=3 3110 B9R0.23 COC(=O)C(Cl)CC(=O)O Amb27589899 [0,2,0,0,0,0|1,0,0]=3 3111 B9R0.23 COC(=O)C(Cl)NC(C)=O Amb28193243 [0,2,0,0,0,0|0,0,0]=2 3112 B9R0.23 COC(=O)C(F)CC(=O)O Amb27837974 [0,2,0,0,0,0|1,0,0]=3 3113 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,2,0,0,0,0|1,0,0]=3 3114 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,2,0,0,0,0|1,0,0]=3 3115 B9R0.23 COC(=O)C(N)CC(N)=O Amb16243083 [0,2,0,0,0,0|2,0,0]=4 3116 B9R0.23 COC(=O)C(N)CC(N)=O Amb17601698 [0,2,0,0,0,0|2,0,0]=4 3117 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [0,2,0,0,0,0|1,0,0]=3 3118 B9R0.23 COC(=O)C(O)CC(N)=O Amb27655536 [0,2,0,0,0,0|2,0,0]=4 3119 B9R0.23 COC(=O)N(C)CC(=N)N Amb27947615 [0,2,0,0,0,0|2,0,0]=4 3120 B9R0.23 COC(=O)N(C)CC(=O)O Amb6668732 [0,2,0,0,0,0|0,0,0]=2 3121 B9R0.23 COC(=O)N(C)CC(N)=S Amb18800645 [0,2,0,0,0,0|1,1,0]=4 3122 B9R0.23 COC(=O)N(C)C[C@@H](C)O Amb28456472 [0,2,0,0,0,0|1,0,1]=4 3123 B9R0.23 COC(=O)N(C)C[C@H](C)O Amb27873990 [0,2,0,0,0,0|1,0,1]=4 3124 B9R0.23 COC(=O)[C@@H](Br)CC(N)=O Amb27789593 [0,2,0,0,0,0|2,0,0]=4 3125 B9R0.23 COC(=O)[C@@H](C)NC(C)=O Amb17621817 [0,2,0,0,0,0|0,0,0]=2 3126 B9R0.23 COC(=O)[C@@H](C)OC(C)=O Amb28314265 [0,2,0,0,0,0|1,0,0]=3 3127 B9R0.23 COC(=O)[C@@H](F)CC(=O)O Amb27406311 [0,2,0,0,0,0|1,0,0]=3 3128 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,2,0,0,0,0|1,0,0]=3 3129 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,2,0,0,0,0|1,0,0]=3 3130 B9R0.23 COC(=O)[C@@H](N)CC(=O)[O-] Amb22231950 [0,2,0,0,0,0|1,0,1]=4 3131 B9R0.23 COC(=O)[C@@H](N)CC(N)=O Amb8390381 [0,2,0,0,0,0|2,0,0]=4 3132 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [0,2,0,0,0,0|1,0,0]=3 3133 B9R0.23 COC(=O)[C@H](C)CC(=O)Cl Amb28050543 [0,2,0,0,0,0|2,0,0]=4 3134 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [0,2,0,0,0,0|1,0,0]=3 3135 B9R0.23 COC(=O)[C@H](C)NC(C)=O Amb4034849 [0,2,0,0,0,0|0,0,0]=2 3136 B9R0.23 COC(=O)[C@H](C)NC(C)=S Amb26907443 [0,2,0,0,0,0|0,1,0]=3 3137 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,2,0,0,0,0|1,0,1]=4 3138 B9R0.23 COC(=O)[C@H](C)NC(N)=O Amb27948545 [0,2,0,0,0,0|1,0,0]=3 3139 B9R0.23 COC(=O)[C@H](Cl)CC(=O)O Amb27232518 [0,2,0,0,0,0|1,0,0]=3 3140 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,2,0,0,0,0|1,0,0]=3 3141 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb19883963 [0,2,0,0,0,0|2,0,0]=4 3142 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb27597987 [0,2,0,0,0,0|2,0,0]=4 3143 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [0,2,0,0,0,0|2,0,0]=4 3144 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [0,2,0,0,0,0|1,0,0]=3 3145 B9R0.23 COC(=O)[C@H](O)CC(N)=O Amb27623997 [0,2,0,0,0,0|2,0,0]=4 3146 B9R0.23 COC(=O)\C(Br)=C\C(=O)O Amb15695379 [0,2,0,0,0,0|1,0,1]=4 3147 B9R0.23 COC(=O)\C(C)=C\C(=O)O Amb27221493 [0,2,0,0,0,0|1,0,1]=4 3148 B9R0.23 COC(=O)\C(C)=C\C(C)=O Amb27164598 [0,2,0,0,0,0|1,0,1]=4 3149 B9R0.23 COC(=O)\C(F)=C\C(=O)O Amb28288995 [0,2,0,0,0,0|1,0,1]=4 3150 B9R0.23 COC(=O)\C(N)=C\C(C)=O Amb24411031 [0,2,0,0,0,0|1,0,1]=4 3151 B9R0.23 COC(=O)\C(O)=C\C(C)=O Amb1981446 [0,2,0,0,0,0|1,0,1]=4 3152 B9R0.23 COC(=O)\C([O-])=C\C(C)=O Amb29083217 [0,2,0,0,0,0|1,0,1]=4 3153 B9R0.23 COC(=S)N(C)CC(=O)O Amb24514158 [0,2,0,0,0,0|0,1,0]=3 3154 B9R0.23 COC(C)[C@@H](C)NC(C)=O Amb27197797 [0,2,0,0,0,0|1,0,1]=4 3155 B9R0.23 COC(C)[C@H](C)NC(C)=O Amb28063340 [0,2,0,0,0,0|1,0,1]=4 3156 B9R0.23 CSC(=N)N(C)CC(=O)O Amb27834370 [0,2,0,0,0,0|1,0,0]=3 3157 B9R0.23 CSC(=S)N(C)CC(=O)O Amb26852199 [0,2,0,0,0,0|0,1,0]=3 3158 B9R0.23 CSC(=S)N(C)CC(N)=O Amb27224707 [0,2,0,0,0,0|1,1,0]=4 3159 B9R0.23 C[C@@H](O)CN(C)C(=O)CO Amb28456435 [0,2,0,0,0,0|1,0,1]=4 3160 B9R0.23 C[C@H](C=O)[C@@H](C)CC(=O)O Amb27874077 [0,2,0,0,0,0|1,0,1]=4 3161 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,2,0,0,0,0|0,0,2]=4 3162 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,2,0,0,0,0|2,0,0]=4 3163 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,2,0,0,0,0|1,0,1]=4 3164 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,2,0,0,0,0|2,0,0]=4 3165 B9R0.23 NNC(=O)C(N)CC(=O)O Amb26438038 [0,2,0,0,0,0|2,0,0]=4 3166 B9R0.23 NNC(=O)C(N)CC(=O)O Amb35750707 [0,2,0,0,0,0|2,0,0]=4 3167 B9R0.23 N[C@H](CC(=O)O)C(=O)NO Amb27413035 [0,2,0,0,0,0|2,0,0]=4 3168 B9R0.23 N\N=C(\N)N(N)CC(=O)O Amb24502285 [0,2,0,0,0,0|2,0,0]=4 3169 B9R0.23 O=C(O)CC(Br)C(=O)CBr Amb15772353 [0,2,0,0,0,0|1,0,0]=3 3170 B9R0.23 O=C(O)CC(S)C(=O)CS Amb27758589 [0,2,0,0,0,0|1,0,0]=3 3171 B9R0.24 C#CC(=O)NNC(=O)NC Amb28285768 [0,2,0,0,0,0|2,0,0]=4 3172 B9R0.24 C#CC(C)NCC(=O)OC Amb27401661 [0,2,0,0,0,0|1,0,1]=4 3173 B9R0.24 C=C(C#N)CNC(=O)NC Amb27435827 [0,2,0,0,0,0|2,0,0]=4 3174 B9R0.24 C=C(C=O)CCC(=O)OC Amb27876497 [0,2,0,0,0,0|1,0,1]=4 3175 B9R0.24 C=C(CC)CNC(=O)CN Amb27792144 [0,2,0,0,0,0|2,0,0]=4 3176 B9R0.24 C=C(CO)COC(=O)OC Amb28050776 [0,2,0,0,0,0|2,0,0]=4 3177 B9R0.24 CC(CO)CNC(=O)CBr Amb27175197 [0,2,0,0,0,0|1,0,1]=4 3178 B9R0.24 CC(CO)CNC(=O)CCl Amb27833178 [0,2,0,0,0,0|1,0,1]=4 3179 B9R0.24 CC(CO)CNC(=O)CN Amb27197708 [0,2,0,0,0,0|1,0,1]=4 3180 B9R0.24 CC(CO)CNC(=O)CS Amb27401279 [0,2,0,0,0,0|1,0,1]=4 3181 B9R0.24 CCC(=O)CCC(=O)CC Amb8391992 [0,2,0,0,0,0|2,0,0]=4 3182 B9R0.24 CCC(=O)CNC(=O)CCl Amb24725631 [0,2,0,0,0,0|1,0,0]=3 3183 B9R0.24 CCC(=O)CNC(=O)CO Amb27448700 [0,2,0,0,0,0|1,0,0]=3 3184 B9R0.24 CCC(=O)COC(=O)CC Amb27598340 [0,2,0,0,0,0|2,0,0]=4 3185 B9R0.24 CCC(=O)NCC(=O)NN Amb27982624 [0,2,0,0,0,0|1,0,0]=3 3186 B9R0.24 CCC(=O)NCC(C)ON Amb17138410 [0,2,0,0,0,0|1,0,1]=4 3187 B9R0.24 CCC(=O)NCC(O)CC Amb27426269 [0,2,0,0,0,0|1,0,1]=4 3188 B9R0.24 CCC(=O)NC[C@@H](O)CO Amb33041812 [0,2,0,0,0,0|0,0,2]=4 3189 B9R0.24 CCC(=O)NNC(=O)CC Amb22347723 [0,2,0,0,0,0|2,0,0]=4 3190 B9R0.24 CCC(=O)NNC(=O)CCl Amb16186696 [0,2,0,0,0,0|2,0,0]=4 3191 B9R0.24 CCC(=O)NNC(=O)CN Amb17334235 [0,2,0,0,0,0|2,0,0]=4 3192 B9R0.24 CCC(C)NCC(=O)OC Amb6687134 [0,2,0,0,0,0|1,0,1]=4 3193 B9R0.24 CCC(O)CNC(=O)CBr Amb28256000 [0,2,0,0,0,0|1,0,1]=4 3194 B9R0.24 CCC(O)CNC(=O)CN Amb27242062 [0,2,0,0,0,0|1,0,1]=4 3195 B9R0.24 CC[C@H](O)CNC(=O)NC Amb27945374 [0,2,0,0,0,0|1,0,1]=4 3196 B9R0.24 CNC(=O)CCC(=O)NC Amb4017621 [0,2,0,0,0,0|2,0,0]=4 3197 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,0]=3 3198 B9R0.24 CNC(=O)CNC(=O)CBr Amb27752218 [0,2,0,0,0,0|1,0,0]=3 3199 B9R0.24 CNC(=O)CNC(=O)CCl Amb475203 [0,2,0,0,0,0|1,0,0]=3 3200 B9R0.24 CNC(=O)CNC(=O)NC Amb28073324 [0,2,0,0,0,0|1,0,0]=3 3201 B9R0.24 CNC(=O)CNC(=O)NN Amb32410410 [0,2,0,0,0,0|2,0,0]=4 3202 B9R0.24 CNC(=O)COC(=O)CO Amb28315993 [0,2,0,0,0,0|2,0,0]=4 3203 B9R0.24 CNC(=O)NCC(C)CO Amb28363662 [0,2,0,0,0,0|1,0,1]=4 3204 B9R0.24 CNC(=O)NC[C@@H](C)OC Amb35637593 [0,2,0,0,0,0|1,0,1]=4 3205 B9R0.24 CNC(=O)NC[C@H](C)OC Amb35641868 [0,2,0,0,0,0|1,0,1]=4 3206 B9R0.24 CNC(=O)NC\C(N)=N\O Amb27399938 [0,2,0,0,0,0|1,0,0]=3 3207 B9R0.24 CNC(=O)SCC(=O)OC Amb27180433 [0,2,0,0,0,0|1,0,0]=3 3208 B9R0.24 CNC(=O)\N=C\C(=O)OC Amb27473353 [0,2,0,0,0,0|0,0,2]=4 3209 B9R0.24 CNC(=S)NNC(=O)CO Amb19860452 [0,2,0,0,0,0|1,1,0]=4 3210 B9R0.24 CNC(=S)NNC(=O)OC Amb27972064 [0,2,0,0,0,0|1,1,0]=4 3211 B9R0.24 COC(=O)C#CC(=O)OC Amb6891940 [0,2,0,0,0,0|1,0,1]=4 3212 B9R0.24 COC(=O)CCC(=N)NO Amb27148692 [0,2,0,0,0,0|2,0,0]=4 3213 B9R0.24 COC(=O)CCC(=O)CBr Amb33526898 [0,2,0,0,0,0|1,0,0]=3 3214 B9R0.24 COC(=O)CCC(=O)CCl Amb26649344 [0,2,0,0,0,0|1,0,0]=3 3215 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,0]=3 3216 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,2,0,0,0,0|1,0,0]=3 3217 B9R0.24 COC(=O)CCC(=O)NN Amb28046722 [0,2,0,0,0,0|2,0,0]=4 3218 B9R0.24 COC(=O)CCC(=O)NO Amb28454716 [0,2,0,0,0,0|1,0,0]=3 3219 B9R0.24 COC(=O)CCC(=O)OC Amb2793094 [0,2,0,0,0,0|1,0,0]=3 3220 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|1,0,1]=4 3221 B9R0.24 COC(=O)CCN(C)N=O Amb17618594 [0,2,0,0,0,0|2,0,0]=4 3222 B9R0.24 COC(=O)CCS(=O)OC Amb22728623 [0,2,0,0,0,0|2,0,0]=4 3223 B9R0.24 COC(=O)CC\C(C)=N\O Amb28064373 [0,2,0,0,0,0|1,0,1]=4 3224 B9R0.24 COC(=O)CNC(=O)C#N Amb27426721 [0,2,0,0,0,0|0,0,1]=3 3225 B9R0.24 COC(=O)CNC(=O)CBr Amb17329958 [0,2,0,0,0,0|0,0,0]=2 3226 B9R0.24 COC(=O)CNC(=O)CCl Amb367447 [0,2,0,0,0,0|0,0,0]=2 3227 B9R0.24 COC(=O)CNC(=O)CN Amb2701513 [0,2,0,0,0,0|0,0,0]=2 3228 B9R0.24 COC(=O)CNC(=O)CN Amb5783125 [0,2,0,0,0,0|0,0,0]=2 3229 B9R0.24 COC(=O)CNC(=O)CO Amb28410960 [0,2,0,0,0,0|0,0,0]=2 3230 B9R0.24 COC(=O)CNC(=O)NN Amb32789579 [0,2,0,0,0,0|1,0,0]=3 3231 B9R0.24 COC(=O)CNC(=O)OC Amb9265412 [0,2,0,0,0,0|0,0,0]=2 3232 B9R0.24 COC(=O)CNC(=O)SC Amb24620395 [0,2,0,0,0,0|0,0,0]=2 3233 B9R0.24 COC(=O)CNC(=S)NN Amb9205808 [0,2,0,0,0,0|1,1,0]=4 3234 B9R0.24 COC(=O)CNC(C)C#N Amb17044888 [0,2,0,0,0,0|1,0,1]=4 3235 B9R0.24 COC(=O)COC(=O)CO Amb28206230 [0,2,0,0,0,0|1,0,0]=3 3236 B9R0.24 COC(=O)CSC(=O)CCl Amb27407672 [0,2,0,0,0,0|1,0,0]=3 3237 B9R0.24 COC(=O)C\C=C(\C)CO Amb28050664 [0,2,0,0,0,0|1,0,1]=4 3238 B9R0.24 COC(=O)C\N=C(/C)OC Amb27632931 [0,2,0,0,0,0|0,0,2]=4 3239 B9R0.24 COC(=O)NCC(=O)CBr Amb28122949 [0,2,0,0,0,0|1,0,0]=3 3240 B9R0.24 COC(=O)NCC(=O)NN Amb27969172 [0,2,0,0,0,0|1,0,0]=3 3241 B9R0.24 COC(=O)NCC(=O)NO Amb27211651 [0,2,0,0,0,0|0,0,0]=2 3242 B9R0.24 COC(=O)NCC(C)CO Amb28286586 [0,2,0,0,0,0|1,0,1]=4 3243 B9R0.24 COC(=O)NCC(N)CO Amb27598507 [0,2,0,0,0,0|1,0,1]=4 3244 B9R0.24 COC(=O)NCC(O)CO Amb27876174 [0,2,0,0,0,0|0,0,2]=4 3245 B9R0.24 COC(=O)NCN(C)N=O Amb27776473 [0,2,0,0,0,0|2,0,0]=4 3246 B9R0.24 COC(=O)NNC(=N)CCl Amb19959265 [0,2,0,0,0,0|2,0,0]=4 3247 B9R0.24 COC(=O)N\C=C(/C)C=O Amb27837939 [0,2,0,0,0,0|1,0,1]=4 3248 B9R0.24 COC(=O)O\C=C(\C)C=O Amb27640699 [0,2,0,0,0,0|2,0,0]=4 3249 B9R0.24 COC(=O)\C=C/C(=O)OC Amb8514575 [0,2,0,0,0,0|1,0,1]=4 3250 B9R0.24 COC(=O)\C=C\C(=O)CBr Amb26539741 [0,2,0,0,0,0|1,0,1]=4 3251 B9R0.24 COC(=O)\C=C\C(=O)OC Amb1789270 [0,2,0,0,0,0|1,0,1]=4 3252 B9R0.24 COC(=O)\N=N\C(=O)OC Amb6296109 [0,2,0,0,0,0|1,0,1]=4 3253 B9R0.24 COC(C)CNC(=O)CN Amb27474446 [0,2,0,0,0,0|1,0,1]=4 3254 B9R0.24 COC(C)CNC(=O)CS Amb27656573 [0,2,0,0,0,0|1,0,1]=4 3255 B9R0.24 C\C=C(/C)CNC(=O)OC Amb28346258 [0,2,0,0,0,0|2,0,0]=4 3256 B9R0.24 NCC(=O)CCC(=O)CCl Amb27767996 [0,2,0,0,0,0|2,0,0]=4 3257 B9R0.24 NCC(=O)NCC(=O)NN Amb28060025 [0,2,0,0,0,0|1,0,0]=3 3258 B9R0.24 NOC(=O)CCC(=O)ON Amb22346144 [0,2,0,0,0,0|2,0,0]=4 3259 B9R0.24 O=C(CCl)NCC(O)CO Amb22754889 [0,2,0,0,0,0|0,0,2]=4 3260 B9R0.24 O=C(CCl)NC[C@H](O)CO Amb28072856 [0,2,0,0,0,0|0,0,2]=4 3261 B9R0.24 O=CC(O)CNC(=O)CBr Amb27841938 [0,2,0,0,0,0|0,0,1]=3 3262 B9R0.42 C#CC(=O)N[C@@H](C)C(=O)O Amb28060769 [0,2,0,0,0,0|0,0,1]=3 3263 B9R0.42 C=C(C)C(=O)CC(=O)OC Amb26925268 [0,2,0,0,0,0|2,0,0]=4 3264 B9R0.42 C=C(C)C(O)CC(=O)OC Amb27839501 [0,2,0,0,0,0|2,0,0]=4 3265 B9R0.42 C=C(C)[C@@H](O)CC(=O)OC Amb33199529 [0,2,0,0,0,0|2,0,0]=4 3266 B9R0.42 C=C(C)[C@H](O)CC(=O)OC Amb33199525 [0,2,0,0,0,0|2,0,0]=4 3267 B9R0.42 C=C(CC(=O)NC)C(=O)O Amb22269311 [0,2,0,0,0,0|1,0,1]=4 3268 B9R0.42 C=C(CC(=O)OC)C(=O)O Amb4035034 [0,2,0,0,0,0|1,0,1]=4 3269 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,2,0,0,0,0|2,0,0]=4 3270 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,2,0,0,0,0|2,0,0]=4 3271 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,2,0,0,0,0|2,0,0]=4 3272 B9R0.42 C=C(NC(=O)CCl)C(=O)O Amb1951911 [0,2,0,0,0,0|0,0,1]=3 3273 B9R0.42 C=C(NC(=O)CN)C(=O)O Amb25845451 [0,2,0,0,0,0|0,0,1]=3 3274 B9R0.42 C=C(OC(=O)OC)C(C)=O Amb25951847 [0,2,0,0,0,0|2,0,0]=4 3275 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb3940875 [0,2,0,0,0,0|0,0,1]=3 3276 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb9790819 [0,2,0,0,0,0|0,0,1]=3 3277 B9R0.42 C=CC(=O)NC(O)C(=O)[O-] Amb33512922 [0,2,0,0,0,0|0,0,2]=4 3278 B9R0.42 C=CC(=O)N[C@H](C)C(N)=O Amb27770556 [0,2,0,0,0,0|1,0,1]=4 3279 B9R0.42 C=CC(=O)OC(C)C(=O)O Amb27592472 [0,2,0,0,0,0|1,0,1]=4 3280 B9R0.42 CC(=O)C(C)\C=C(/C)C=O Amb27753996 [0,2,0,0,0,0|2,0,0]=4 3281 B9R0.42 CC(=O)C(O)CC(=O)C=O Amb27480852 [0,2,0,0,0,0|1,0,1]=4 3282 B9R0.42 CC(=O)N(C)CC(=O)NO Amb28291755 [0,2,0,0,0,0|0,0,0]=2 3283 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [0,2,0,0,0,0|1,0,0]=3 3284 B9R0.42 CC(NC(=O)C=O)C(=O)O Amb27830810 [0,2,0,0,0,0|0,0,1]=3 3285 B9R0.42 CC(NC(=O)C=O)C(N)=O Amb27469201 [0,2,0,0,0,0|1,0,1]=4 3286 B9R0.42 CC(NC(=O)CBr)C(N)=O Amb27470048 [0,2,0,0,0,0|1,0,0]=3 3287 B9R0.42 CC(NC(=O)CCl)C(=O)Cl Amb27201426 [0,2,0,0,0,0|1,0,0]=3 3288 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [0,2,0,0,0,0|0,0,0]=2 3289 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [0,2,0,0,0,0|0,0,0]=2 3290 B9R0.42 CC(O)C(C)NC(=O)CN Amb27424140 [0,2,0,0,0,0|1,0,1]=4 3291 B9R0.42 CC(OC(=O)CCl)C(=O)O Amb28042677 [0,2,0,0,0,0|1,0,0]=3 3292 B9R0.42 CC(OC(=O)CN)C(N)=O Amb27596266 [0,2,0,0,0,0|2,0,0]=4 3293 B9R0.42 CC(OC(=O)CO)C(N)=O Amb28126899 [0,2,0,0,0,0|2,0,0]=4 3294 B9R0.42 CCC(=O)CC(=O)C(C)=O Amb25110491 [0,2,0,0,0,0|2,0,0]=4 3295 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,2,0,0,0,0|1,0,0]=3 3296 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,2,0,0,0,0|1,0,0]=3 3297 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,2,0,0,0,0|2,0,0]=4 3298 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,2,0,0,0,0|1,0,0]=3 3299 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,2,0,0,0,0|1,0,0]=3 3300 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,2,0,0,0,0|1,0,0]=3 3301 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [0,2,0,0,0,0|0,0,0]=2 3302 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [0,2,0,0,0,0|0,0,0]=2 3303 B9R0.42 CCC(=O)OC(C)C(C)=O Amb26063123 [0,2,0,0,0,0|2,0,0]=4 3304 B9R0.42 CCC(=O)\C=C(/C)C(=O)O Amb27613306 [0,2,0,0,0,0|1,0,1]=4 3305 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,2,0,0,0,0|1,0,1]=4 3306 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,2,0,0,0,0|2,0,0]=4 3307 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,2,0,0,0,0|2,0,0]=4 3308 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,2,0,0,0,0|2,0,0]=4 3309 B9R0.42 CCS(=O)NC(C)C(=O)O Amb28319239 [0,2,0,0,0,0|1,0,0]=3 3310 B9R0.42 CCS(=O)N[C@@H](C)C(=O)O Amb27243800 [0,2,0,0,0,0|1,0,0]=3 3311 B9R0.42 CN(CC(=O)NN)C(N)=O Amb28320178 [0,2,0,0,0,0|2,0,0]=4 3312 B9R0.42 CN(C\C(N)=N\O)C(N)=O Amb27406364 [0,2,0,0,0,0|2,0,0]=4 3313 B9R0.42 CNC(=O)CC(C)C(N)=O Amb17334219 [0,2,0,0,0,0|2,0,0]=4 3314 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,2,0,0,0,0|1,0,0]=3 3315 B9R0.42 CNC(=O)CN(C)C(C)=O Amb33530553 [0,2,0,0,0,0|1,0,0]=3 3316 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,2,0,0,0,0|1,0,0]=3 3317 B9R0.42 CNC(=O)NC(C)C(=O)O Amb1130316 [0,2,0,0,0,0|0,0,0]=2 3318 B9R0.42 CNC(=O)NC(C)C(N)=O Amb27255879 [0,2,0,0,0,0|1,0,0]=3 3319 B9R0.42 CNC(=O)NN(C)C(C)=O Amb28289344 [0,2,0,0,0,0|2,0,0]=4 3320 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O Amb24478025 [0,2,0,0,0,0|0,0,0]=2 3321 B9R0.42 CNC(=O)N[C@H](C)C(=O)O Amb24558529 [0,2,0,0,0,0|0,0,0]=2 3322 B9R0.42 CNC(=O)OC(C)C(=O)O Amb35655772 [0,2,0,0,0,0|1,0,0]=3 3323 B9R0.42 CNC(=O)ON(C)C(C)=O Amb27830594 [0,2,0,0,0,0|2,0,0]=4 3324 B9R0.42 CNC(=O)O[C@@H](C)C(=O)O Amb35647450 [0,2,0,0,0,0|1,0,0]=3 3325 B9R0.42 CNC(=O)O[C@H](C)C(=O)O Amb29866286 [0,2,0,0,0,0|1,0,0]=3 3326 B9R0.42 COC(=O)CC(=O)C(=O)O Amb22728219 [0,2,0,0,0,0|1,0,1]=4 3327 B9R0.42 COC(=O)CC(=O)C(=O)[O-] Amb34916317 [0,2,0,0,0,0|2,0,0]=4 3328 B9R0.42 COC(=O)CC(=O)C(C)=O Amb25146895 [0,2,0,0,0,0|1,0,0]=3 3329 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,2,0,0,0,0|1,0,0]=3 3330 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,2,0,0,0,0|1,0,0]=3 3331 B9R0.42 COC(=O)CC(Br)C(N)=O Amb27969234 [0,2,0,0,0,0|2,0,0]=4 3332 B9R0.42 COC(=O)CC(C)C(=O)Cl Amb27972299 [0,2,0,0,0,0|2,0,0]=4 3333 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,2,0,0,0,0|1,0,0]=3 3334 B9R0.42 COC(=O)CC(C)C(=O)[O-] Amb34915052 [0,2,0,0,0,0|1,0,1]=4 3335 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,2,0,0,0,0|1,0,0]=3 3336 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,2,0,0,0,0|1,0,0]=3 3337 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,2,0,0,0,0|1,0,0]=3 3338 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,2,0,0,0,0|1,0,0]=3 3339 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,2,0,0,0,0|1,0,0]=3 3340 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,2,0,0,0,0|1,0,0]=3 3341 B9R0.42 COC(=O)CC(O)C(N)=O Amb27830345 [0,2,0,0,0,0|2,0,0]=4 3342 B9R0.42 COC(=O)CN(C)C(=N)N Amb25143562 [0,2,0,0,0,0|2,0,0]=4 3343 B9R0.42 COC(=O)CN(C)C(=O)Cl Amb35749071 [0,2,0,0,0,0|1,0,0]=3 3344 B9R0.42 COC(=O)CN(C)C(C)=O Amb9263349 [0,2,0,0,0,0|0,0,0]=2 3345 B9R0.42 COC(=O)CN(C)C(C)C Amb7757820 [0,2,0,0,0,0|1,0,1]=4 3346 B9R0.42 COC(=O)CN(C)[N+](=O)[O-] Amb26642139 [0,2,0,0,0,0|2,0,0]=4 3347 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,2,0,0,0,0|1,0,0]=3 3348 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,2,0,0,0,0|1,0,0]=3 3349 B9R0.42 COC(=O)C[C@@H](C)C(N)=O Amb27169355 [0,2,0,0,0,0|2,0,0]=4 3350 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,2,0,0,0,0|1,0,0]=3 3351 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,2,0,0,0,0|1,0,0]=3 3352 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,2,0,0,0,0|1,0,0]=3 3353 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,2,0,0,0,0|1,0,0]=3 3354 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,2,0,0,0,0|1,0,0]=3 3355 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,2,0,0,0,0|1,0,0]=3 3356 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,2,0,0,0,0|1,0,0]=3 3357 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,2,0,0,0,0|1,0,0]=3 3358 B9R0.42 COC(=O)C[C@H](O)C(N)=O Amb28120921 [0,2,0,0,0,0|2,0,0]=4 3359 B9R0.42 COC(=O)NC(C)C(=N)N Amb27789549 [0,2,0,0,0,0|2,0,0]=4 3360 B9R0.42 COC(=O)NC(C)C(=O)O Amb6668789 [0,2,0,0,0,0|0,0,0]=2 3361 B9R0.42 COC(=O)N[C@@H](C)C(=O)O Amb24477985 [0,2,0,0,0,0|0,0,0]=2 3362 B9R0.42 COC(=O)N[C@H](C)C(=O)O Amb24381066 [0,2,0,0,0,0|0,0,0]=2 3363 B9R0.42 COC(=O)N[C@H](C)C(N)=O Amb27428453 [0,2,0,0,0,0|1,0,0]=3 3364 B9R0.42 COC(=O)SC(C)C(C)=O Amb27243977 [0,2,0,0,0,0|2,0,0]=4 3365 B9R0.42 COC(=O)\C=C(/C)C(=O)O Amb18644070 [0,2,0,0,0,0|1,0,1]=4 3366 B9R0.42 COC(=O)\C=C(/C)C(C)=O Amb20668358 [0,2,0,0,0,0|1,0,1]=4 3367 B9R0.42 COC(=S)SC(C)C(=O)O Amb28458571 [0,2,0,0,0,0|1,1,0]=4 3368 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [0,2,0,0,0,0|0,0,0]=2 3369 B9R0.42 C[C@@H](NC(=O)CN)C(N)=O Amb27865946 [0,2,0,0,0,0|1,0,0]=3 3370 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [0,2,0,0,0,0|0,0,0]=2 3371 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [0,2,0,0,0,0|0,0,0]=2 3372 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [0,2,0,0,0,0|0,0,0]=2 3373 B9R0.42 C[C@H](OC(=O)CBr)C(N)=O Amb27985898 [0,2,0,0,0,0|2,0,0]=4 3374 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,2,0,0,0,0|2,0,0]=4 3375 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,2,0,0,0,0|2,0,0]=4 3376 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,2,0,0,0,0|2,0,0]=4 3377 B9R0.42 C\C(=N/C(=O)CO)C(=O)O Amb27426561 [0,2,0,0,0,0|0,0,2]=4 3378 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,2,0,0,0,0|2,0,0]=4 3379 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,2,0,0,0,0|1,0,0]=3 3380 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,2,0,0,0,0|1,0,0]=3 3381 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [0,2,0,0,0,0|2,0,0]=4 3382 B9R0.42 NC(\C=C(\P)C=O)C(=O)O Amb25361040 [0,2,0,0,0,0|2,0,0]=4 3383 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [0,2,0,0,0,0|2,0,0]=4 3384 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,2,0,0,0,0|1,0,0]=3 3385 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,2,0,0,0,0|1,0,0]=3 3386 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,2,0,0,0,0|1,0,0]=3 3387 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [0,2,0,0,0,0|2,0,0]=4 3388 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [0,2,0,0,0,0|1,0,0]=3 3389 B9R0.42 O=C(CCl)NC(O)C(=O)O Amb27598875 [0,2,0,0,0,0|0,0,0]=2 3390 B9R0.43 C#CC(CC)NCC(=O)O Amb28453722 [0,2,0,0,0,0|1,0,1]=4 3391 B9R0.43 CC(=O)OC\C(C=O)=N\O Amb27438152 [0,2,0,0,0,0|1,0,0]=3 3392 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,2,0,0,0,0|1,0,1]=4 3393 B9R0.43 CNC(=NCC(=O)O)NC Amb24478941 [0,2,0,0,0,0|1,0,1]=4 3394 B9R0.43 COC(CNC(C)=O)OC Amb10808671 [0,2,0,0,0,0|0,0,2]=4 3395 B9R0.43 CSC(=NCC(=O)O)SC Amb28118980 [0,2,0,0,0,0|0,1,1]=4 3396 B9R0.43 C\C=C(/C=O)COC(C)=O Amb25371691 [0,2,0,0,0,0|2,0,0]=4 3397 B9R0.43 C\C=C(\CO)COC(C)=O Amb27443414 [0,2,0,0,0,0|2,0,0]=4 3398 B9R0.43 C\N=C(/NC)NCC(N)=O Amb27627819 [0,2,0,0,0,0|2,0,0]=4 3399 B9R0.48 C#CCC(=O)NCC(=C)Br Amb28252971 [0,2,0,0,0,0|2,0,0]=4 3400 B9R0.48 C#CCC(=O)NCC(=O)O Amb27641047 [0,2,0,0,0,0|0,0,0]=2 3401 B9R0.48 C#CCC(=O)NCC(C)O Amb28074201 [0,2,0,0,0,0|1,0,1]=4 3402 B9R0.48 C#CCC(=O)NC[C@@H](C)O Amb27243409 [0,2,0,0,0,0|1,0,1]=4 3403 B9R0.48 C=C(Br)CNC(=O)C#CC Amb27171934 [0,2,0,0,0,0|2,0,0]=4 3404 B9R0.48 C=C(Br)CNC(=O)CC#N Amb27859916 [0,2,0,0,0,0|2,0,0]=4 3405 B9R0.48 C=C(Br)CNC(=O)CCBr Amb27229780 [0,2,0,0,0,0|2,0,0]=4 3406 B9R0.48 C=C(Br)CNC(=O)CCCl Amb28071695 [0,2,0,0,0,0|2,0,0]=4 3407 B9R0.48 C=C(Br)CNC(=O)NOC Amb27594444 [0,2,0,0,0,0|2,0,0]=4 3408 B9R0.48 C=C(Br)CNC(=O)OCC Amb27877481 [0,2,0,0,0,0|2,0,0]=4 3409 B9R0.48 C=C(Br)CNC(=O)\C=C\C Amb27240096 [0,2,0,0,0,0|2,0,0]=4 3410 B9R0.48 C=C(C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|2,0,0]=4 3411 B9R0.48 C=C(C)CNC(=O)C#CC Amb27465761 [0,2,0,0,0,0|2,0,0]=4 3412 B9R0.48 C=C(C)CNC(=O)CCS Amb27836803 [0,2,0,0,0,0|2,0,0]=4 3413 B9R0.48 C=C(C)CNC(=O)NCC Amb4018877 [0,2,0,0,0,0|2,0,0]=4 3414 B9R0.48 C=C(C)CNC(=O)OCC Amb4016947 [0,2,0,0,0,0|2,0,0]=4 3415 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|2,0,0]=4 3416 B9R0.48 C=C(COC(C)=O)OCC Amb28050232 [0,2,0,0,0,0|2,0,0]=4 3417 B9R0.48 C=C(Cl)CNC(=O)CC#N Amb28247160 [0,2,0,0,0,0|2,0,0]=4 3418 B9R0.48 C=C(Cl)CNC(=O)CCS Amb27256663 [0,2,0,0,0,0|2,0,0]=4 3419 B9R0.48 C=C(Cl)CNC(=O)NOC Amb27780304 [0,2,0,0,0,0|2,0,0]=4 3420 B9R0.48 C=CNC(=O)CCC(=O)O Amb24505247 [0,2,0,0,0,0|1,0,1]=4 3421 B9R0.48 C=COC(=O)NCC(=O)O Amb28063004 [0,2,0,0,0,0|0,0,1]=3 3422 B9R0.48 CC#CC(=O)NC[C@@H](C)O Amb27465743 [0,2,0,0,0,0|1,0,1]=4 3423 B9R0.48 CC#CC(=O)NC[C@H](C)O Amb27474592 [0,2,0,0,0,0|1,0,1]=4 3424 B9R0.48 CC#CC(=O)NNC(C)=O Amb28188098 [0,2,0,0,0,0|2,0,0]=4 3425 B9R0.48 CC(=C\C=O)\C=C\C(=O)O Amb27210491 [0,2,0,0,0,0|1,0,1]=4 3426 B9R0.48 CC(=O)CC\C(C)=C/C=O Amb27643630 [0,2,0,0,0,0|2,0,0]=4 3427 B9R0.48 CC(=O)CC\C(C)=C\C=O Amb27818040 [0,2,0,0,0,0|2,0,0]=4 3428 B9R0.48 CC(=O)CN\C(C)=C\C=O Amb28326012 [0,2,0,0,0,0|1,0,0]=3 3429 B9R0.48 CC(=O)COC(=O)CC#N Amb27652757 [0,2,0,0,0,0|2,0,0]=4 3430 B9R0.48 CC(=O)NCC(C)CCO Amb28364911 [0,2,0,0,0,0|1,0,1]=4 3431 B9R0.48 CC(=O)NNC(=O)CC#N Amb2779142 [0,2,0,0,0,0|2,0,0]=4 3432 B9R0.48 CC(=O)NNC(=O)CCCl Amb9489669 [0,2,0,0,0,0|2,0,0]=4 3433 B9R0.48 CC(=O)NNC(=O)CCN Amb17334233 [0,2,0,0,0,0|2,0,0]=4 3434 B9R0.48 CC(=O)NNC(=O)OCCl Amb30030143 [0,2,0,0,0,0|1,0,0]=3 3435 B9R0.48 CC(=O)OCC(=O)C=[N+]=[N-] Amb17593580 [0,2,0,0,0,0|2,0,0]=4 3436 B9R0.48 CC(=O)OC\C(C)=C\C=O Amb28385065 [0,2,0,0,0,0|2,0,0]=4 3437 B9R0.48 CC(=O)SCC(=O)NCS Amb27837955 [0,2,0,0,0,0|1,1,0]=4 3438 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|1,0,1]=4 3439 B9R0.48 CC(CCC(=O)O)N=C=O Amb33471389 [0,2,0,0,0,0|1,0,1]=4 3440 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|0,0,2]=4 3441 B9R0.48 CC(\C=C\C(=O)O)=C/C=O Amb27215348 [0,2,0,0,0,0|1,0,1]=4 3442 B9R0.48 CCCC(=O)CCC(C)=O Amb2721037 [0,2,0,0,0,0|2,0,0]=4 3443 B9R0.48 CCCC(=O)COC(C)=O Amb28437151 [0,2,0,0,0,0|2,0,0]=4 3444 B9R0.48 CCCC(=O)NCC(=O)O Amb5741675 [0,2,0,0,0,0|0,0,0]=2 3445 B9R0.48 CCCC(=O)NCC(C)O Amb9275481 [0,2,0,0,0,0|1,0,1]=4 3446 B9R0.48 CCCC(=O)NCC(N)=O Amb17231980 [0,2,0,0,0,0|1,0,0]=3 3447 B9R0.48 CCCC(=O)NNC(C)=O Amb28453795 [0,2,0,0,0,0|2,0,0]=4 3448 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,2,0,0,0,0|1,0,0]=3 3449 B9R0.48 CCCC(=O)OCC(C)=O Amb28350457 [0,2,0,0,0,0|2,0,0]=4 3450 B9R0.48 CCCC(=O)SCC(=O)O Amb27400351 [0,2,0,0,0,0|1,0,0]=3 3451 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [0,2,0,0,0,0|2,0,0]=4 3452 B9R0.48 CCCS(=O)NCC(N)=O Amb27613567 [0,2,0,0,0,0|2,0,0]=4 3453 B9R0.48 CCNC(=N)NCC(N)=O Amb27855456 [0,2,0,0,0,0|2,0,0]=4 3454 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,0]=3 3455 B9R0.48 CCNC(=O)CCC(C)=O Amb17334212 [0,2,0,0,0,0|2,0,0]=4 3456 B9R0.48 CCNC(=O)CCC(N)=O Amb17142864 [0,2,0,0,0,0|2,0,0]=4 3457 B9R0.48 CCNC(=O)NCC(=O)O Amb1129570 [0,2,0,0,0,0|0,0,0]=2 3458 B9R0.48 CCNC(=O)NCC(C)=O Amb28194385 [0,2,0,0,0,0|1,0,0]=3 3459 B9R0.48 CCNC(=O)NCC(C)O Amb9361473 [0,2,0,0,0,0|1,0,1]=4 3460 B9R0.48 CCNC(=O)NCC(N)=S Amb18792342 [0,2,0,0,0,0|1,1,0]=4 3461 B9R0.48 CCNC(=O)NNC(C)=O Amb27487197 [0,2,0,0,0,0|2,0,0]=4 3462 B9R0.48 CCNC(=O)NNC(N)=O Amb25063732 [0,2,0,0,0,0|2,0,0]=4 3463 B9R0.48 CCNC(=O)OCC(=O)O Amb27173452 [0,2,0,0,0,0|1,0,0]=3 3464 B9R0.48 CCNC(=O)OCC(C)=O Amb27660754 [0,2,0,0,0,0|2,0,0]=4 3465 B9R0.48 CCNC(=O)OCC(N)=O Amb28126696 [0,2,0,0,0,0|2,0,0]=4 3466 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [0,2,0,0,0,0|1,0,1]=4 3467 B9R0.48 CCNC(=O)\C=C\C(=O)O Amb9251696 [0,2,0,0,0,0|1,0,1]=4 3468 B9R0.48 CCNC(=S)NCC(=O)O Amb25857780 [0,2,0,0,0,0|0,1,0]=3 3469 B9R0.48 CCNC(=S)OCC(=O)O Amb28343116 [0,2,0,0,0,0|1,1,0]=4 3470 B9R0.48 CCOC(=O)C#CC(C)=O Amb26959237 [0,2,0,0,0,0|1,0,1]=4 3471 B9R0.48 CCOC(=O)CC=C(C)C Amb4036274 [0,2,0,0,0,0|2,0,0]=4 3472 B9R0.48 CCOC(=O)CCC(=O)Cl Amb3939960 [0,2,0,0,0,0|2,0,0]=4 3473 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,0]=3 3474 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,2,0,0,0,0|1,0,0]=3 3475 B9R0.48 CCOC(=O)CCC(N)=O Amb8997750 [0,2,0,0,0,0|2,0,0]=4 3476 B9R0.48 CCOC(=O)CCS(=O)O Amb24551974 [0,2,0,0,0,0|2,0,0]=4 3477 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,2,0,0,0,0|2,0,0]=4 3478 B9R0.48 CCOC(=O)CNC(=N)N Amb28068654 [0,2,0,0,0,0|2,0,0]=4 3479 B9R0.48 CCOC(=O)CNC(C)=O Amb33534694 [0,2,0,0,0,0|0,0,0]=2 3480 B9R0.48 CCOC(=O)CNC(C)=S Amb27794578 [0,2,0,0,0,0|0,1,0]=3 3481 B9R0.48 CCOC(=O)CNC(C)C Amb19887458 [0,2,0,0,0,0|1,0,1]=4 3482 B9R0.48 CCOC(=O)CNC(C)C Amb6706356 [0,2,0,0,0,0|1,0,1]=4 3483 B9R0.48 CCOC(=O)CNC(N)=O Amb2438049 [0,2,0,0,0,0|1,0,0]=3 3484 B9R0.48 CCOC(=O)CNC(N)=S Amb18792422 [0,2,0,0,0,0|1,1,0]=4 3485 B9R0.48 CCOC(=O)COC(=O)Cl Amb27803973 [0,2,0,0,0,0|2,0,0]=4 3486 B9R0.48 CCOC(=O)NCC(=O)O Amb6246368 [0,2,0,0,0,0|0,0,0]=2 3487 B9R0.48 CCOC(=O)NCC(C)O Amb9285612 [0,2,0,0,0,0|1,0,1]=4 3488 B9R0.48 CCOC(=O)NCC(N)=O Amb27392498 [0,2,0,0,0,0|1,0,0]=3 3489 B9R0.48 CCOC(=O)NC[C@@H](C)O Amb27786644 [0,2,0,0,0,0|1,0,1]=4 3490 B9R0.48 CCOC(=O)NNC(N)=O Amb26391965 [0,2,0,0,0,0|2,0,0]=4 3491 B9R0.48 CCOC(=O)NOC(C)=O Amb28050560 [0,2,0,0,0,0|2,0,0]=4 3492 B9R0.48 CCOC(=O)OCC(=O)O Amb25367281 [0,2,0,0,0,0|1,0,0]=3 3493 B9R0.48 CCOC(=O)\C=C/C(=O)O Amb24462678 [0,2,0,0,0,0|1,0,1]=4 3494 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [0,2,0,0,0,0|1,0,1]=4 3495 B9R0.48 CCOC(=O)\C=C\C(C)=O Amb3428594 [0,2,0,0,0,0|1,0,1]=4 3496 B9R0.48 CCOC(=O)\C=N\C(C)=O Amb27770427 [0,2,0,0,0,0|0,0,2]=4 3497 B9R0.48 CCOC(=O)\N=C\C(C)=O Amb27668941 [0,2,0,0,0,0|2,0,0]=4 3498 B9R0.48 CCOC(=S)NCC(=O)O Amb26481347 [0,2,0,0,0,0|0,1,0]=3 3499 B9R0.48 CCOC(=S)SCC(=O)O Amb4017675 [0,2,0,0,0,0|1,1,0]=4 3500 B9R0.48 CCOC(C)CNC(C)=O Amb27174342 [0,2,0,0,0,0|1,0,1]=4 3501 B9R0.48 CCSC(=O)CCC(C)=O Amb28253786 [0,2,0,0,0,0|1,1,0]=4 3502 B9R0.48 CCSC(=O)CNC(C)=O Amb25146289 [0,2,0,0,0,0|0,1,0]=3 3503 B9R0.48 CCSC(=S)SCC(=O)O Amb28385725 [0,2,0,0,0,0|1,1,0]=4 3504 B9R0.48 CCS\C(S)=N/CC(=O)O Amb21862600 [0,2,0,0,0,0|0,1,1]=4 3505 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|2,0,0]=4 3506 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|2,0,0]=4 3507 B9R0.48 CNCC(=O)NCC(=O)O Amb19010138 [0,2,0,0,0,0|0,0,0]=2 3508 B9R0.48 CNCC(=O)NCC(C)O Amb9360232 [0,2,0,0,0,0|1,0,1]=4 3509 B9R0.48 CNCC(=O)NNC(C)=O Amb27458705 [0,2,0,0,0,0|2,0,0]=4 3510 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,2,0,0,0,0|1,0,1]=4 3511 B9R0.48 CNOC(=O)CCC(=O)O Amb28126710 [0,2,0,0,0,0|1,0,0]=3 3512 B9R0.48 COCC(=O)CC=C(C)C Amb27233842 [0,2,0,0,0,0|2,0,0]=4 3513 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,2,0,0,0,0|1,0,0]=3 3514 B9R0.48 COCC(=O)CNC(C)C Amb27231606 [0,2,0,0,0,0|1,0,1]=4 3515 B9R0.48 COCC(=O)COC(C)=O Amb27599018 [0,2,0,0,0,0|1,0,0]=3 3516 B9R0.48 COCC(=O)NCC(=O)O Amb1118442 [0,2,0,0,0,0|0,0,0]=2 3517 B9R0.48 COCC(=O)OCC(N)=O Amb27456203 [0,2,0,0,0,0|2,0,0]=4 3518 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|0,0,2]=4 3519 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|0,0,2]=4 3520 B9R0.48 COCC(Cl)CNC(C)=O Amb28049466 [0,2,0,0,0,0|1,0,1]=4 3521 B9R0.48 COC[C@@H](O)CNC(C)=O Amb27663283 [0,2,0,0,0,0|0,0,2]=4 3522 B9R0.48 CONC(=O)CCC(=O)O Amb27839045 [0,2,0,0,0,0|1,0,0]=3 3523 B9R0.48 CONC(=O)CNC(C)=O Amb27771053 [0,2,0,0,0,0|0,0,0]=2 3524 B9R0.48 CONC(=O)\C=C/C(=O)O Amb27855758 [0,2,0,0,0,0|1,0,1]=4 3525 B9R0.48 CONC(=S)NCC(N)=O Amb28349715 [0,2,0,0,0,0|1,1,0]=4 3526 B9R0.48 CO\N=C(/C)CCC(C)=O Amb24583507 [0,2,0,0,0,0|2,0,0]=4 3527 B9R0.48 CSCC(=O)NCC(N)=O Amb28189006 [0,2,0,0,0,0|1,0,0]=3 3528 B9R0.48 CSCC(=O)NC[C@@H](C)O Amb28207872 [0,2,0,0,0,0|1,0,1]=4 3529 B9R0.48 C[C@@H](O)CNC(=O)CCBr Amb27399958 [0,2,0,0,0,0|1,0,1]=4 3530 B9R0.48 C[C@H](O)CNC(=O)CC#N Amb27232337 [0,2,0,0,0,0|1,0,1]=4 3531 B9R0.48 C\C(=C/CO)CCC(=O)O Amb27630663 [0,2,0,0,0,0|1,0,1]=4 3532 B9R0.48 C\C=C\C(=O)NCC(=O)O Amb9719598 [0,2,0,0,0,0|0,0,0]=2 3533 B9R0.48 C\C=C\C(=O)NC[C@@H](C)O Amb27836661 [0,2,0,0,0,0|1,0,1]=4 3534 B9R0.48 C\C=C\C(=O)NNC(C)=O Amb28136439 [0,2,0,0,0,0|2,0,0]=4 3535 B9R0.48 C\C=C\C(=O)OCC(C)=O Amb26627032 [0,2,0,0,0,0|2,0,0]=4 3536 B9R0.48 C\C=C\C(=O)SCC(=O)O Amb27400187 [0,2,0,0,0,0|1,0,0]=3 3537 B9R0.48 C\C=C\C(O)CNC(C)=O Amb24480779 [0,2,0,0,0,0|1,0,1]=4 3538 B9R0.48 C\C=N\C(=O)CCC(=O)O Amb27217285 [0,2,0,0,0,0|1,0,0]=3 3539 B9R0.48 N#CCC(=O)CCC(=O)O Amb24053663 [0,2,0,0,0,0|1,0,0]=3 3540 B9R0.48 N#CCC(=O)NCC(N)=O Amb6270334 [0,2,0,0,0,0|1,0,0]=3 3541 B9R0.48 N#CNC(=N)NCC(=O)O Amb27413250 [0,2,0,0,0,0|1,0,1]=4 3542 B9R0.48 NC(=O)CNC(=O)C#CBr Amb28363984 [0,2,0,0,0,0|1,0,1]=4 3543 B9R0.48 NCCC(=O)NCC(=O)O Amb28555431 [0,2,0,0,0,0|0,0,0]=2 3544 B9R0.48 NCCC(=O)NCC(=O)O Amb4035945 [0,2,0,0,0,0|0,0,0]=2 3545 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [0,2,0,0,0,0|1,0,0]=3 3546 B9R0.48 O=C(O)CCC(=O)NCO Amb28132582 [0,2,0,0,0,0|1,0,0]=3 3547 B9R0.48 O=C(O)CNC(=O)C#CBr Amb27867573 [0,2,0,0,0,0|0,0,1]=3 3548 B9R0.48 O=C(O)\C=C\C(=O)NCO Amb28346249 [0,2,0,0,0,0|1,0,1]=4 3549 B9R0.48 O=CCC(=O)CCC(=O)O Amb18644074 [0,2,0,0,0,0|1,0,0]=3 3550 B9R0.48 [N-]=[N+]=CC(=O)NCC(N)=O Amb28437103 [0,2,0,0,0,0|1,0,1]=4 3551 B9R0.64 CC(=O)NCP(=O)(O)CN Amb28367174 [0,2,0,0,0,0|1,0,0]=3 3552 B9R0.64 CC(C)(C#N)NCC(=O)O Amb25699825 [0,2,0,0,0,0|1,0,1]=4 3553 B9R0.64 CC(C)(C=O)CCC(=O)O Amb18644118 [0,2,0,0,0,0|1,0,1]=4 3554 B9R0.64 CCC(C)(O)CNC(C)=O Amb27795587 [0,2,0,0,0,0|1,0,1]=4 3555 B9R0.64 CCS(=O)(=O)CCC(=O)O Amb6266853 [0,2,0,0,0,0|2,0,0]=4 3556 B9R0.64 CCS(=O)(=O)NCC(=O)O Amb1112815 [0,2,0,0,0,0|1,0,0]=3 3557 B9R0.64 CCS(=O)(=O)NCC(C)=O Amb27807137 [0,2,0,0,0,0|2,0,0]=4 3558 B9R0.64 CCS(=O)(=O)NCC(N)=O Amb17232583 [0,2,0,0,0,0|2,0,0]=4 3559 B9R0.64 CNS(=O)(=O)CCC(=O)O Amb6741778 [0,2,0,0,0,0|2,0,0]=4 3560 B9R0.64 CNS(=O)(=O)NCC(=O)O Amb25756106 [0,2,0,0,0,0|1,0,0]=3 3561 B9R0.64 CNS(=O)(=O)NCC(N)=O Amb28142771 [0,2,0,0,0,0|2,0,0]=4 3562 B9R0.64 COC(C)(C)CNC(C)=O Amb28255406 [0,2,0,0,0,0|1,0,1]=4 3563 B9R0.64 COP(=O)(O)COC(C)=O Amb27493526 [0,2,0,0,0,0|2,0,0]=4 3564 B9R0.64 COP(=O)(O)NCC(=O)O Amb27602360 [0,2,0,0,0,0|1,0,0]=3 3565 B9R0.64 COP(=O)(S)SCC(=O)O Amb28241332 [0,2,0,0,0,0|2,0,0]=4 3566 B9R0.64 COS(=O)(=O)OCC(=O)O Amb27983681 [0,2,0,0,0,0|2,0,0]=4 3567 B9R0.64 NC(=O)CNS(=O)(=O)CCl Amb28042917 [0,2,0,0,0,0|2,0,0]=4 3568 B9R0.64 O=C(O)CCP(=O)(O)CCl Amb27615065 [0,2,0,0,0,0|2,0,0]=4 3569 B9R0.64 O=C(O)CCS(=O)(=O)CF Amb27793811 [0,2,0,0,0,0|2,0,0]=4 3570 B9R0.64 O=C(O)CNS(=O)(=O)CBr Amb27219748 [0,2,0,0,0,0|1,0,0]=3 3571 B9R0.10 CC(=O)NC(C)P(=O)(O)O Amb27229951 [0,2,0,0,0,0|1,0,0]=3 3572 B9R0.10 CN(CC(=O)Cl)S(C)(=O)=O Amb25857494 [0,2,0,0,0,0|2,0,0]=4 3573 B9R0.10 CN(CC(=O)O)C(C)(C)C Amb17334246 [0,2,0,0,0,0|1,0,1]=4 3574 B9R0.10 CN(CC(=O)O)S(C)(=N)=O Amb35695561 [0,2,0,0,0,0|1,0,0]=3 3575 B9R0.10 CN(CC(=O)O)S(C)(=O)=O Amb1111612 [0,2,0,0,0,0|1,0,0]=3 3576 B9R0.10 CN(CC(=O)O)S(N)(=O)=O Amb6264241 [0,2,0,0,0,0|2,0,0]=4 3577 B9R0.10 CN(CC(N)=O)S(C)(=N)=O Amb30019707 [0,2,0,0,0,0|2,0,0]=4 3578 B9R0.10 CN(CC(N)=O)S(C)(=O)=O Amb8483814 [0,2,0,0,0,0|2,0,0]=4 3579 B9R0.10 CP(=O)(O)C(N)CC(=O)O Amb27831332 [0,2,0,0,0,0|2,0,0]=4 3580 B9R0.11 C=C(C)C(C)(C)CC(=O)O Amb25703730 [0,2,0,0,0,0|2,0,0]=4 3581 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb22641962 [0,2,0,0,0,0|2,0,0]=4 3582 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb31307620 [0,2,0,0,0,0|2,0,0]=4 3583 B9R0.11 C=C(C)C(F)(F)CC(=O)O Amb32810021 [0,2,0,0,0,0|2,0,0]=4 3584 B9R0.11 C=C(C)CC(C)(C)C(=O)O Amb27619182 [0,2,0,0,0,0|2,0,0]=4 3585 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,2,0,0,0,0|2,0,0]=4 3586 B9R0.11 C=C(C)CC(C)(O)C(=O)O Amb24763776 [0,2,0,0,0,0|2,0,0]=4 3587 B9R0.11 C=C(C)CC(F)(F)C(=O)O Amb26356276 [0,2,0,0,0,0|2,0,0]=4 3588 B9R0.11 C=C(C)C[C@](C)(O)C(=O)O Amb27618953 [0,2,0,0,0,0|2,0,0]=4 3589 B9R0.11 CC(=N)NC(C)(C)C(N)=O Amb27260683 [0,2,0,0,0,0|2,0,0]=4 3590 B9R0.11 CC(=O)C(C)(C)CC(=O)O Amb594714 [0,2,0,0,0,0|1,0,0]=3 3591 B9R0.11 CC(=O)C(C)(C)CC(N)=O Amb26055921 [0,2,0,0,0,0|2,0,0]=4 3592 B9R0.11 CC(=O)CC(C)(C)C(=O)O Amb18644092 [0,2,0,0,0,0|1,0,0]=3 3593 B9R0.11 CC(=O)CC(C)(C)C(=O)S Amb28201149 [0,2,0,0,0,0|1,1,0]=4 3594 B9R0.11 CC(=O)CC(C)(S)C(=O)O Amb27984551 [0,2,0,0,0,0|1,0,0]=3 3595 B9R0.11 CC(=O)C[C@](C)(O)C(=O)O Amb27170683 [0,2,0,0,0,0|1,0,0]=3 3596 B9R0.11 CC(=O)NC(C)(C)C(=O)O Amb13952726 [0,2,0,0,0,0|0,0,0]=2 3597 B9R0.11 CC(=O)NC(C)(C)C(C)=O Amb27798335 [0,2,0,0,0,0|1,0,0]=3 3598 B9R0.11 CC(=O)NC(C)(N)C(=O)O Amb27881127 [0,2,0,0,0,0|0,0,0]=2 3599 B9R0.11 CC(=O)OC(C)(C)C(=O)Br Amb8384982 [0,2,0,0,0,0|2,0,0]=4 3600 B9R0.11 CC(=O)OC(C)(C)C(=O)Cl Amb3939171 [0,2,0,0,0,0|2,0,0]=4 3601 B9R0.11 CC(=O)OC(C)(C)C(=O)O Amb18644243 [0,2,0,0,0,0|1,0,0]=3 3602 B9R0.11 CC(=O)OC(C)(C)C(C)=O Amb8394371 [0,2,0,0,0,0|2,0,0]=4 3603 B9R0.11 CC(=O)SC(C)(C)C(=O)O Amb17607677 [0,2,0,0,0,0|1,0,0]=3 3604 B9R0.11 CC(=O)SC(F)(F)C(=O)O Amb27252817 [0,2,0,0,0,0|1,0,0]=3 3605 B9R0.11 CC(C)(CC(=O)O)C(=O)Cl Amb27449457 [0,2,0,0,0,0|2,0,0]=4 3606 B9R0.11 CC(C)(CC(=O)O)C(=O)O Amb9787793 [0,2,0,0,0,0|2,0,0]=4 3607 B9R0.11 CC(C)(NC(N)=O)C(=O)O Amb9825347 [0,2,0,0,0,0|1,0,0]=3 3608 B9R0.11 CC(C)=CC(C)(C)C(=O)O Amb27162610 [0,2,0,0,0,0|2,0,0]=4 3609 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,2,0,0,0,0|1,0,1]=4 3610 B9R0.11 CC(Cl)(CC(=O)O)C(=O)O Amb18126463 [0,2,0,0,0,0|2,0,0]=4 3611 B9R0.11 CC(N)(CC(=O)O)C(=O)O Amb10807406 [0,2,0,0,0,0|2,0,0]=4 3612 B9R0.11 CC(N)(CC(N)=O)C(=O)O Amb28131361 [0,2,0,0,0,0|2,0,0]=4 3613 B9R0.11 CC(O)(CC(=O)O)C(=O)O Amb6366309 [0,2,0,0,0,0|2,0,0]=4 3614 B9R0.11 CS(=O)C(C)(C)CC(=O)O Amb28128345 [0,2,0,0,0,0|2,0,0]=4 3615 B9R0.11 CS(=O)CC(C)(C)C(=O)O Amb28049647 [0,2,0,0,0,0|2,0,0]=4 3616 B9R0.11 CS(=O)CC(C)(O)C(=O)O Amb27984742 [0,2,0,0,0,0|2,0,0]=4 3617 B9R0.11 CS(=O)CC(F)(F)C(=O)O Amb33169820 [0,2,0,0,0,0|2,0,0]=4 3618 B9R0.11 C[C@@](N)(CC(N)=O)C(=O)O Amb22225025 [0,2,0,0,0,0|2,0,0]=4 3619 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O Amb10601663 [0,2,0,0,0,0|2,0,0]=4 3620 B9R0.11 C[C@](N)(CC(N)=O)C(=O)O Amb27195940 [0,2,0,0,0,0|2,0,0]=4 3621 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O Amb26398856 [0,2,0,0,0,0|2,0,0]=4 3622 B9R0.11 NC(=O)CC(N)(O)C(=O)O Amb27794741 [0,2,0,0,0,0|2,0,0]=4 3623 B9R0.11 NC(=O)C[C@@](N)(O)C(=O)O Amb28348701 [0,2,0,0,0,0|2,0,0]=4 3624 B9R0.11 O=C(O)CC(Cl)(Cl)C(=O)O Amb27971430 [0,2,0,0,0,0|2,0,0]=4 3625 B9R0.11 O=C(O)CC(F)(F)C(=O)O Amb2732193 [0,2,0,0,0,0|2,0,0]=4 3626 B9R0.39 C#CC(NC(C)=O)C(=O)O Amb27411184 [0,2,0,0,0,0|0,0,0]=2 3627 B9R0.39 C#C[C@@H](NC(C)=O)C(=O)O Amb27393972 [0,2,0,0,0,0|0,0,0]=2 3628 B9R0.39 C=C(C)C(CC)CC(=O)O Amb27655611 [0,2,0,0,0,0|2,0,0]=4 3629 B9R0.39 C=C(C)C(CN)CC(=O)O Amb33199956 [0,2,0,0,0,0|2,0,0]=4 3630 B9R0.39 C=C(C)CC(C#N)C(=O)O Amb35741470 [0,2,0,0,0,0|2,0,0]=4 3631 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [0,2,0,0,0,0|2,0,0]=4 3632 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [0,2,0,0,0,0|2,0,0]=4 3633 B9R0.39 C=C[C@@H](NC(C)=O)C(=O)O Amb28050121 [0,2,0,0,0,0|0,0,0]=2 3634 B9R0.39 CC(=N)N[C@@H](CO)C(=O)O Amb27192588 [0,2,0,0,0,0|1,0,0]=3 3635 B9R0.39 CC(=O)CC(C=O)C(=O)O Amb28048038 [0,2,0,0,0,0|1,0,0]=3 3636 B9R0.39 CC(=O)C\C(=N\O)C(C)=O Amb27256458 [0,2,0,0,0,0|2,0,0]=4 3637 B9R0.39 CC(=O)N(CC(=O)O)N=O Amb27391141 [0,2,0,0,0,0|0,0,0]=2 3638 B9R0.39 CC(=O)NC(C#N)C(N)=O Amb1046298 [0,2,0,0,0,0|1,0,0]=3 3639 B9R0.39 CC(=O)NC(C=O)C(N)=O Amb27240214 [0,2,0,0,0,0|1,0,0]=3 3640 B9R0.39 CC(=O)NC(CCl)C(=O)O Amb27494110 [0,2,0,0,0,0|0,0,0]=2 3641 B9R0.39 CC(=O)NC(CN)C(=O)O Amb28128874 [0,2,0,0,0,0|0,0,0]=2 3642 B9R0.39 CC(=O)NC(CO)C(=O)O Amb1115493 [0,2,0,0,0,0|0,0,0]=2 3643 B9R0.39 CC(=O)NC(CO)C(N)=O Amb4018749 [0,2,0,0,0,0|1,0,0]=3 3644 B9R0.39 CC(=O)NC(CS)C(=O)O Amb1112748 [0,2,0,0,0,0|0,0,0]=2 3645 B9R0.39 CC(=O)NC(CS)C(N)=O Amb24482241 [0,2,0,0,0,0|1,0,0]=3 3646 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O Amb22746917 [0,2,0,0,0,0|0,0,0]=2 3647 B9R0.39 CC(=O)N[C@@H](CO)C(N)=O Amb28461160 [0,2,0,0,0,0|1,0,0]=3 3648 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O Amb2684240 [0,2,0,0,0,0|0,0,0]=2 3649 B9R0.39 CC(=O)N[C@@H](CS)C(N)=O Amb24183864 [0,2,0,0,0,0|1,0,0]=3 3650 B9R0.39 CC(=O)N[C@H](CCl)C(=O)O Amb27171775 [0,2,0,0,0,0|0,0,0]=2 3651 B9R0.39 CC(=O)N[C@H](CS)C(=O)O Amb25887589 [0,2,0,0,0,0|0,0,0]=2 3652 B9R0.39 CC(=O)N[C@H](CS)C(N)=O Amb27232938 [0,2,0,0,0,0|1,0,0]=3 3653 B9R0.39 CC(=O)N\C(=C\Br)C(=O)O Amb27451991 [0,2,0,0,0,0|0,0,1]=3 3654 B9R0.39 CC(=O)N\C(=C\N)C(C)=O Amb28060035 [0,2,0,0,0,0|1,0,1]=4 3655 B9R0.39 CC(=O)OC(C=O)C(C)=O Amb27798281 [0,2,0,0,0,0|2,0,0]=4 3656 B9R0.39 CC(=O)OC(CCl)C(=O)O Amb27796012 [0,2,0,0,0,0|1,0,0]=3 3657 B9R0.39 CC(=O)O[C@@H](CN)C(=O)O Amb27874054 [0,2,0,0,0,0|1,0,0]=3 3658 B9R0.39 CC(C)N(C#N)CC(=O)O Amb35634517 [0,2,0,0,0,0|1,0,1]=4 3659 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,2,0,0,0,0|1,0,1]=4 3660 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,2,0,0,0,0|1,0,1]=4 3661 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,2,0,0,0,0|1,0,1]=4 3662 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,2,0,0,0,0|1,0,1]=4 3663 B9R0.39 CC(N)NC(CS)C(=O)O Amb27792112 [0,2,0,0,0,0|1,0,1]=4 3664 B9R0.39 CCC(CC(=O)O)C(=O)O Amb10071696 [0,2,0,0,0,0|2,0,0]=4 3665 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [0,2,0,0,0,0|1,0,0]=3 3666 B9R0.39 CCC(CC(C)=O)C(C)=O Amb27403023 [0,2,0,0,0,0|2,0,0]=4 3667 B9R0.39 CCC(NC(C)=O)C(=O)O Amb2099651 [0,2,0,0,0,0|0,0,0]=2 3668 B9R0.39 CCC(NC(C)=O)C(C)=O Amb28348733 [0,2,0,0,0,0|1,0,0]=3 3669 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,2,0,0,0,0|1,0,1]=4 3670 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,2,0,0,0,0|1,0,1]=4 3671 B9R0.39 CCC(NC(N)=O)C(=O)O Amb435947 [0,2,0,0,0,0|1,0,0]=3 3672 B9R0.39 CCC(OC(C)=O)C(=O)Cl Amb28059233 [0,2,0,0,0,0|2,0,0]=4 3673 B9R0.39 CCC(OC(C)=O)C(N)=O Amb25274332 [0,2,0,0,0,0|2,0,0]=4 3674 B9R0.39 CCC(OC(N)=O)C(=O)O Amb28283574 [0,2,0,0,0,0|2,0,0]=4 3675 B9R0.39 CCN(CC(=O)O)C(C)=O Amb17399887 [0,2,0,0,0,0|0,0,0]=2 3676 B9R0.39 CCN(CC(=O)O)C(N)=O Amb18999255 [0,2,0,0,0,0|1,0,0]=3 3677 B9R0.39 CCN(CC(C)O)C(C)=O Amb27219905 [0,2,0,0,0,0|1,0,1]=4 3678 B9R0.39 CCN(C[C@@H](C)O)C(C)=O Amb28063653 [0,2,0,0,0,0|1,0,1]=4 3679 B9R0.39 CCN(C[C@H](C)O)C(C)=O Amb28281456 [0,2,0,0,0,0|1,0,1]=4 3680 B9R0.39 CCN(NC(N)=O)C(C)=O Amb27229465 [0,2,0,0,0,0|2,0,0]=4 3681 B9R0.39 CC[C@@H](CC(=O)O)C(=O)O Amb27830576 [0,2,0,0,0,0|2,0,0]=4 3682 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O Amb3941467 [0,2,0,0,0,0|0,0,0]=2 3683 B9R0.39 CC[C@H](CC(=O)O)C(=O)O Amb24643194 [0,2,0,0,0,0|2,0,0]=4 3684 B9R0.39 CC[C@H](NC(C)=O)C(=O)O Amb3990111 [0,2,0,0,0,0|0,0,0]=2 3685 B9R0.39 CC[C@H](OC(C)=O)C(=O)O Amb27948340 [0,2,0,0,0,0|1,0,0]=3 3686 B9R0.39 CC\C(=C/C(=O)O)C(C)=O Amb26391990 [0,2,0,0,0,0|1,0,1]=4 3687 B9R0.39 CNC(CC(=O)O)C(=O)O Amb1905634 [0,2,0,0,0,0|2,0,0]=4 3688 B9R0.39 CNC(CC(=O)O)C(=O)O Amb30867747 [0,2,0,0,0,0|2,0,0]=4 3689 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,2,0,0,0,0|1,0,0]=3 3690 B9R0.39 CNC(CC(N)=O)C(=O)O Amb18644255 [0,2,0,0,0,0|2,0,0]=4 3691 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O Amb3499450 [0,2,0,0,0,0|2,0,0]=4 3692 B9R0.39 CN[C@H](CC(=O)O)C(=O)O Amb8515692 [0,2,0,0,0,0|2,0,0]=4 3693 B9R0.39 CN[C@H](CC(N)=O)C(=O)O Amb28049962 [0,2,0,0,0,0|2,0,0]=4 3694 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,2,0,0,0,0|2,0,0]=4 3695 B9R0.39 COC(CC(=O)O)C(C)=O Amb27952022 [0,2,0,0,0,0|1,0,0]=3 3696 B9R0.39 COC(CC(=O)O)C(N)=O Amb23536075 [0,2,0,0,0,0|2,0,0]=4 3697 B9R0.39 CO[C@H](CC(=O)O)C(=O)O Amb27849552 [0,2,0,0,0,0|2,0,0]=4 3698 B9R0.39 CO\C(=C/C(=O)O)C(C)=O Amb28345759 [0,2,0,0,0,0|1,0,1]=4 3699 B9R0.39 CS(=O)NC(CO)C(=O)O Amb28193924 [0,2,0,0,0,0|1,0,0]=3 3700 B9R0.39 CSC(CC(=O)O)C(=O)O Amb18646024 [0,2,0,0,0,0|2,0,0]=4 3701 B9R0.39 C\C(Cl)=C/C(ON)C(=O)O Amb27252200 [0,2,0,0,0,0|2,0,0]=4 3702 B9R0.39 C\C=C(/CC(=O)O)C(=O)O Amb8631758 [0,2,0,0,0,0|2,0,0]=4 3703 B9R0.39 C\C=C(/OC(C)=O)C(=O)O Amb27759731 [0,2,0,0,0,0|1,0,1]=4 3704 B9R0.39 C\C=C(\CC(=O)O)C(=O)O Amb25292254 [0,2,0,0,0,0|2,0,0]=4 3705 B9R0.39 C\C=C(\NC(C)=O)C(=O)O Amb27781271 [0,2,0,0,0,0|0,0,1]=3 3706 B9R0.39 N#CC(NC(N)=O)C(N)=O Amb17593581 [0,2,0,0,0,0|2,0,0]=4 3707 B9R0.39 N=C(N)NC(CS)C(=O)O Amb24711320 [0,2,0,0,0,0|2,0,0]=4 3708 B9R0.39 N=CC(CC(=O)O)C(=O)O Amb27653604 [0,2,0,0,0,0|2,0,0]=4 3709 B9R0.39 NC(=O)CC(CO)C(=O)O Amb28411495 [0,2,0,0,0,0|2,0,0]=4 3710 B9R0.39 NC(=O)CC(NO)C(=O)O Amb27168203 [0,2,0,0,0,0|2,0,0]=4 3711 B9R0.39 NC(=O)C[C@H](NO)C(=O)O Amb28364297 [0,2,0,0,0,0|2,0,0]=4 3712 B9R0.39 NC(=O)N(CC(=O)O)N=O Amb25683110 [0,2,0,0,0,0|1,0,0]=3 3713 B9R0.39 NC(=O)NC(CF)C(=O)O Amb28187932 [0,2,0,0,0,0|1,0,0]=3 3714 B9R0.39 NC(=O)NC(CO)C(=O)O Amb1055147 [0,2,0,0,0,0|1,0,0]=3 3715 B9R0.39 NC(=O)NC(CS)C(=O)O Amb1119403 [0,2,0,0,0,0|1,0,0]=3 3716 B9R0.39 NC(=O)N[C@@H](CF)C(=O)O Amb26454171 [0,2,0,0,0,0|1,0,0]=3 3717 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O Amb17610484 [0,2,0,0,0,0|1,0,0]=3 3718 B9R0.39 NCC(CC(=O)O)C(=O)O Amb22546423 [0,2,0,0,0,0|2,0,0]=4 3719 B9R0.39 NCC(CC(=O)O)C(=O)O Amb24538047 [0,2,0,0,0,0|2,0,0]=4 3720 B9R0.39 NNC(CC(=O)O)C(=O)O Amb28070991 [0,2,0,0,0,0|2,0,0]=4 3721 B9R0.39 NN[C@@H](CC(=O)O)C(=O)O Amb24117193 [0,2,0,0,0,0|2,0,0]=4 3722 B9R0.39 N\C=C(\CC(=O)O)C(=O)O Amb28050321 [0,2,0,0,0,0|2,0,0]=4 3723 B9R0.39 O=C(O)CC(CBr)C(=O)O Amb22752144 [0,2,0,0,0,0|2,0,0]=4 3724 B9R0.39 O=C(O)CC(CF)C(=O)O Amb33379249 [0,2,0,0,0,0|2,0,0]=4 3725 B9R0.39 O=C(O)CC(NCl)C(=O)O Amb27953217 [0,2,0,0,0,0|2,0,0]=4 3726 B9R0.39 O=C(O)CC(NO)C(=O)O Amb24685872 [0,2,0,0,0,0|2,0,0]=4 3727 B9R0.39 O=C(O)CC(NS)C(=O)O Amb25808901 [0,2,0,0,0,0|2,0,0]=4 3728 B9R0.39 O=C(O)C[C@H](NCl)C(=O)O Amb27401859 [0,2,0,0,0,0|2,0,0]=4 3729 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24117497 [0,2,0,0,0,0|2,0,0]=4 3730 B9R0.39 O=C(O)C[C@H](NO)C(=O)O Amb24630025 [0,2,0,0,0,0|2,0,0]=4 3731 B9R0.39 O=C(O)C\C(=N/O)C(=O)O Amb24117074 [0,2,0,0,0,0|2,0,0]=4 3732 B9R0.39 O=C(O)C\C(=N\O)C(=O)O Amb27828721 [0,2,0,0,0,0|2,0,0]=4 3733 B9R0.57 CC(=O)N(C)CC(C)(C)O Amb24392062 [0,2,0,0,0,0|1,0,1]=4 3734 B9R0.57 CC(CP(C)(C)=O)C(=O)O Amb28050894 [0,2,0,0,0,0|2,0,0]=4 3735 B9R0.57 CC(CS(C)(=O)=O)C(=O)O Amb18971622 [0,2,0,0,0,0|2,0,0]=4 3736 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,2,0,0,0,0|1,0,1]=4 3737 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,2,0,0,0,0|1,0,1]=4 3738 B9R0.57 CC(NS(C)(=N)=O)C(=O)O Amb35680388 [0,2,0,0,0,0|1,0,0]=3 3739 B9R0.57 CC(NS(C)(=N)=O)C(N)=O Amb35710906 [0,2,0,0,0,0|2,0,0]=4 3740 B9R0.57 CC(NS(C)(=O)=O)C(=O)Cl Amb5742178 [0,2,0,0,0,0|2,0,0]=4 3741 B9R0.57 CC(NS(C)(=O)=O)C(=O)O Amb9705402 [0,2,0,0,0,0|1,0,0]=3 3742 B9R0.57 CC(NS(C)(=O)=O)C(N)=O Amb27424752 [0,2,0,0,0,0|2,0,0]=4 3743 B9R0.57 CC(NS(N)(=O)=O)C(=O)O Amb6281498 [0,2,0,0,0,0|2,0,0]=4 3744 B9R0.57 CC(N[Si](C)(C)C)C(=O)O Amb27984746 [0,2,0,0,0,0|1,1,0]=4 3745 B9R0.57 CP(=O)(O)CC(N)C(=O)O Amb27770381 [0,2,0,0,0,0|2,0,0]=4 3746 B9R0.57 CS(=O)(=O)CC(Cl)C(=O)O Amb27257814 [0,2,0,0,0,0|2,0,0]=4 3747 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb27983621 [0,2,0,0,0,0|2,0,0]=4 3748 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb32753509 [0,2,0,0,0,0|2,0,0]=4 3749 B9R0.57 CS(=O)(=O)CC(O)C(=O)O Amb24398186 [0,2,0,0,0,0|2,0,0]=4 3750 B9R0.57 CS(=O)(=O)C[C@@H](N)C(=O)O Amb27831327 [0,2,0,0,0,0|2,0,0]=4 3751 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb27231797 [0,2,0,0,0,0|2,0,0]=4 3752 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb32683294 [0,2,0,0,0,0|2,0,0]=4 3753 B9R0.57 C[C@@H](NS(C)(=N)=O)C(=O)O Amb35680524 [0,2,0,0,0,0|1,0,0]=3 3754 B9R0.57 C[C@@H](NS(C)(=N)=O)C(N)=O Amb35680543 [0,2,0,0,0,0|2,0,0]=4 3755 B9R0.57 C[C@@H](NS(N)(=O)=O)C(=O)O Amb28323679 [0,2,0,0,0,0|2,0,0]=4 3756 B9R0.57 C[C@H](NS(C)(=N)=O)C(=O)O Amb29867468 [0,2,0,0,0,0|1,0,0]=3 3757 B9R0.57 C[C@H](NS(C)(=N)=O)C(N)=O Amb35725162 [0,2,0,0,0,0|2,0,0]=4 3758 B9R0.57 C[C@H](NS(C)(=O)=O)C(=O)O Amb27649688 [0,2,0,0,0,0|1,0,0]=3 3759 B9R0.57 C[C@H](OS(C)(=O)=O)C(=O)O Amb25701707 [0,2,0,0,0,0|2,0,0]=4 3760 B9R0.79 C=C(C)C(C)C(C)C(=O)O Amb28042819 [0,2,0,0,0,0|2,0,0]=4 3761 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [0,2,0,0,0,0|2,0,0]=4 3762 B9R0.79 C=C(C)C(O)C(C)C(=O)O Amb18644101 [0,2,0,0,0,0|2,0,0]=4 3763 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,2,0,0,0,0|2,0,0]=4 3764 B9R0.79 C=C(C)[C@@H](C)[C@@H](C)C(=O)O Amb28050111 [0,2,0,0,0,0|2,0,0]=4 3765 B9R0.79 C=C(C)[C@@H](O)[C@@H](C)C(=O)O Amb28283987 [0,2,0,0,0,0|2,0,0]=4 3766 B9R0.79 CC(=O)C(=O)C(O)C(C)=O Amb25910745 [0,2,0,0,0,0|2,0,0]=4 3767 B9R0.79 CC(=O)C(C)C(C)C(C)=O Amb4016940 [0,2,0,0,0,0|2,0,0]=4 3768 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,2,0,0,0,0|1,0,0]=3 3769 B9R0.79 CC(=O)C(C)C(N)C(N)=O Amb27613013 [0,2,0,0,0,0|2,0,0]=4 3770 B9R0.79 CC(=O)C(Cl)C(=O)C(=O)O Amb27600115 [0,2,0,0,0,0|1,0,1]=4 3771 B9R0.79 CC(=O)C(O)C(O)C(=O)O Amb25292189 [0,2,0,0,0,0|1,0,0]=3 3772 B9R0.79 CC(=O)C(O)C(O)C(C)=O Amb17593650 [0,2,0,0,0,0|2,0,0]=4 3773 B9R0.79 CC(=O)N(C)C(C)C(N)=S Amb18800424 [0,2,0,0,0,0|1,1,0]=4 3774 B9R0.79 CC(=O)N(Cl)[C@@H](C)C(=O)O Amb28458454 [0,2,0,0,0,0|0,0,0]=2 3775 B9R0.79 CC(=O)[C@@H](C)[C@@H](O)C(=O)O Amb27661780 [0,2,0,0,0,0|1,0,0]=3 3776 B9R0.79 CC(=O)[C@@H](C)[C@H](O)C(=O)O Amb28050113 [0,2,0,0,0,0|1,0,0]=3 3777 B9R0.79 CC(=O)[C@H](C)[C@@H](C)C(C)=O Amb28202186 [0,2,0,0,0,0|2,0,0]=4 3778 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,2,0,0,0,0|1,0,0]=3 3779 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,2,0,0,0,0|1,1,0]=4 3780 B9R0.79 CC(C(=O)O)C(Br)C(=O)O Amb2612973 [0,2,0,0,0,0|2,0,0]=4 3781 B9R0.79 CC(C(=O)O)C(C)C(=O)O Amb8513150 [0,2,0,0,0,0|2,0,0]=4 3782 B9R0.79 CC(C(=O)O)C(N)C(=O)O Amb2099482 [0,2,0,0,0,0|2,0,0]=4 3783 B9R0.79 CC(C(=O)O)C(O)C(=O)O Amb17593680 [0,2,0,0,0,0|2,0,0]=4 3784 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,2,0,0,0,0|2,0,0]=4 3785 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,2,0,0,0,0|2,0,0]=4 3786 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,2,0,0,0,0|1,0,1]=4 3787 B9R0.79 C[C@@H](C(=O)O)C(N)C(=O)O Amb27877897 [0,2,0,0,0,0|2,0,0]=4 3788 B9R0.79 C[C@@H](C(=O)O)[C@@H](N)C(=O)O Amb27170727 [0,2,0,0,0,0|2,0,0]=4 3789 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O Amb25324829 [0,2,0,0,0,0|2,0,0]=4 3790 B9R0.79 C[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27243908 [0,2,0,0,0,0|2,0,0]=4 3791 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O Amb22801175 [0,2,0,0,0,0|2,0,0]=4 3792 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(N)=O Amb27771245 [0,2,0,0,0,0|2,0,0]=4 3793 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb27783086 [0,2,0,0,0,0|2,0,0]=4 3794 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O Amb31031234 [0,2,0,0,0,0|2,0,0]=4 3795 B9R0.79 C[C@H](C(=O)O)[C@H](Br)C(=O)O Amb27463297 [0,2,0,0,0,0|2,0,0]=4 3796 B9R0.79 C[C@H](C(=O)O)[C@H](C)C(=O)O Amb27460990 [0,2,0,0,0,0|2,0,0]=4 3797 B9R0.79 C[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27955233 [0,2,0,0,0,0|2,0,0]=4 3798 B9R0.79 NC(=O)C(N)C(N)C(=O)O Amb27424997 [0,2,0,0,0,0|2,0,0]=4 3799 B9R0.79 NC(=O)C(O)C(O)C(=O)O Amb24112928 [0,2,0,0,0,0|2,0,0]=4 3800 B9R0.79 NC(=O)[C@@H](O)[C@H](N)C(=O)O Amb24763774 [0,2,0,0,0,0|2,0,0]=4 3801 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(=O)O Amb28341817 [0,2,0,0,0,0|2,0,0]=4 3802 B9R0.79 NC(C(=O)O)C(F)C(=O)O Amb24061061 [0,2,0,0,0,0|2,0,0]=4 3803 B9R0.79 NC(C(=O)O)C(N)C(=O)O Amb24117894 [0,2,0,0,0,0|2,0,0]=4 3804 B9R0.79 NC(C(=O)O)C(O)C(=O)O Amb9871461 [0,2,0,0,0,0|2,0,0]=4 3805 B9R0.79 N[C@@H](C(=O)O)C(F)C(=O)O Amb27494927 [0,2,0,0,0,0|2,0,0]=4 3806 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O Amb17942870 [0,2,0,0,0,0|2,0,0]=4 3807 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O Amb27470435 [0,2,0,0,0,0|2,0,0]=4 3808 B9R0.79 N[C@H](C(=O)O)C(F)C(=O)O Amb27796116 [0,2,0,0,0,0|2,0,0]=4 3809 B9R0.79 N[C@H](C(=O)O)[C@@H](F)C(=O)O Amb27865514 [0,2,0,0,0,0|2,0,0]=4 3810 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O Amb10072362 [0,2,0,0,0,0|2,0,0]=4 3811 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24087715 [0,2,0,0,0,0|2,0,0]=4 3812 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O Amb24117974 [0,2,0,0,0,0|2,0,0]=4 3813 B9R0.79 N[C@H](C(=O)O)[C@H](Cl)C(=O)O Amb27796563 [0,2,0,0,0,0|2,0,0]=4 3814 B9R0.79 N[C@H](C(=O)O)[C@H](F)C(=O)O Amb26945975 [0,2,0,0,0,0|2,0,0]=4 3815 B9R0.79 N[C@H](C(=O)O)[C@H](N)C(=O)O Amb27173533 [0,2,0,0,0,0|2,0,0]=4 3816 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb17615140 [0,2,0,0,0,0|2,0,0]=4 3817 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O Amb33714683 [0,2,0,0,0,0|2,0,0]=4 3818 B9R0.79 O=C(O)C(Br)C(Br)C(=O)O Amb2686761 [0,2,0,0,0,0|2,0,0]=4 3819 B9R0.79 O=C(O)C(Cl)C(Cl)C(=O)O Amb26345874 [0,2,0,0,0,0|2,0,0]=4 3820 B9R0.79 O=C(O)C(F)C(Cl)C(=O)O Amb27875188 [0,2,0,0,0,0|2,0,0]=4 3821 B9R0.79 O=C(O)C(O)C(Cl)C(=O)O Amb17594225 [0,2,0,0,0,0|2,0,0]=4 3822 B9R0.79 O=C(O)C(O)C(F)C(=O)O Amb24479232 [0,2,0,0,0,0|2,0,0]=4 3823 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb24668916 [0,2,0,0,0,0|2,0,0]=4 3824 B9R0.79 O=C(O)C(O)C(O)C(=O)O Amb6608787 [0,2,0,0,0,0|2,0,0]=4 3825 B9R0.79 O=C(O)C(O)C(O)C(=O)S Amb28050895 [0,2,0,0,0,0|2,0,0]=4 3826 B9R0.79 O=C(O)C(S)C(S)C(=O)O Amb8627761 [0,2,0,0,0,0|2,0,0]=4 3827 B9R0.79 O=C(O)[C@@H](Cl)[C@H](O)C(=O)O Amb27845392 [0,2,0,0,0,0|2,0,0]=4 3828 B9R0.79 O=C(O)[C@@H](O)[C@@H](O)C(=O)O Amb22230832 [0,2,0,0,0,0|2,0,0]=4 3829 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb17616192 [0,2,0,0,0,0|2,0,0]=4 3830 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb19884028 [0,2,0,0,0,0|2,0,0]=4 3831 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22750609 [0,2,0,0,0,0|2,0,0]=4 3832 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb22756774 [0,2,0,0,0,0|2,0,0]=4 3833 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb34915014 [0,2,0,0,0,0|2,0,0]=4 3834 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O Amb5722339 [0,2,0,0,0,0|2,0,0]=4 3835 B9R0.79 O=C(O)[C@@H](S)[C@H](S)C(=O)O Amb28195042 [0,2,0,0,0,0|2,0,0]=4 3836 B9R0.79 O=C(O)[C@H](Br)[C@H](F)C(=O)O Amb28050029 [0,2,0,0,0,0|2,0,0]=4 3837 B9R0.79 O=C(O)[C@H](F)[C@H](F)C(=O)O Amb28365940 [0,2,0,0,0,0|2,0,0]=4 3838 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb19884026 [0,2,0,0,0,0|2,0,0]=4 3839 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20240604 [0,2,0,0,0,0|2,0,0]=4 3840 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb20670711 [0,2,0,0,0,0|2,0,0]=4 3841 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb34915016 [0,2,0,0,0,0|2,0,0]=4 3842 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O Amb8628435 [0,2,0,0,0,0|2,0,0]=4 3843 B9R0.79 O=C(O)[C@H](O)[C@H](Br)C(=O)O Amb28252354 [0,2,0,0,0,0|2,0,0]=4 3844 B9R0.79 O=C(O)[C@H](O)[C@H](Cl)C(=O)O Amb27477747 [0,2,0,0,0,0|2,0,0]=4 3845 B9R0.79 O=C(O)[C@H](S)[C@H](S)C(=O)O Amb8393135 [0,2,0,0,0,0|2,0,0]=4 3846 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb20246422 [0,2,0,0,0,0|2,0,0]=4 3847 B9R0.79 O=C([O-])C(O)C(O)C(=O)O Amb8517447 [0,2,0,0,0,0|2,0,0]=4 3848 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O Amb34915846 [0,2,0,0,0,0|2,0,0]=4 3849 B7R1.2 C=C1COC(=O)C1 Amb24589821 [1,0,0,1,0,0|2,0,0]=4 3850 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,0,0,1,0,0|2,0,0]=4 3851 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [1,0,0,1,0,0|1,0,0]=3 3852 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [1,0,0,1,0,0|2,0,0]=4 3853 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [1,0,0,1,0,0|1,0,1]=4 3854 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [1,0,0,1,0,0|2,0,0]=4 3855 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [1,0,0,1,0,0|2,0,0]=4 3856 B7R1.2 CC1=NC(=O)ON1 Amb22491279 [1,0,0,1,0,0|2,0,0]=4 3857 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [1,0,0,1,0,0|1,0,1]=4 3858 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [1,0,0,1,0,0|0,0,1]=3 3859 B7R1.2 CC1=NNC(=O)C1 Amb932788 [1,0,0,1,0,0|2,0,0]=4 3860 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [1,0,0,1,0,0|1,0,1]=4 3861 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [1,0,0,1,0,0|1,0,1]=4 3862 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|1,0,1]=4 3863 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|1,0,1]=4 3864 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|1,0,1]=4 3865 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|1,0,1]=4 3866 B7R1.2 CC1NCC(=O)N1 Amb28456791 [1,0,0,1,0,0|1,0,1]=4 3867 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|1,0,1]=4 3868 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|1,0,1]=4 3869 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,1]=4 3870 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|1,0,1]=4 3871 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|1,0,1]=4 3872 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|1,0,1]=4 3873 B7R1.2 N=C1CC(=O)CS1 Amb27227202 [1,0,0,1,0,0|2,0,0]=4 3874 B7R1.2 NC1=CC(=O)NC1 Amb27454229 [1,0,0,1,0,0|1,0,1]=4 3875 B7R1.2 NC1=NC(=O)CN1 Amb18639307 [1,0,0,1,0,0|2,0,0]=4 3876 B7R1.2 NC1=NC(=O)NC1 Amb22059492 [1,0,0,1,0,0|2,0,0]=4 3877 B7R1.2 NC1=NNC(=O)C1 Amb6409420 [1,0,0,1,0,0|2,0,0]=4 3878 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|1,0,1]=4 3879 B7R1.2 NC1CNC(=O)C1 Amb33544169 [1,0,0,1,0,0|1,0,1]=4 3880 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|1,0,1]=4 3881 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|1,0,1]=4 3882 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [1,0,0,1,0,0|1,0,1]=4 3883 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|1,0,1]=4 3884 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [1,0,0,1,0,0|1,0,1]=4 3885 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [1,0,0,1,0,0|1,0,1]=4 3886 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [1,0,0,1,0,0|1,0,1]=4 3887 B7R1.2 O=C1C=C(O)CN1 Amb20623530 [1,0,0,1,0,0|0,0,1]=3 3888 B7R1.2 O=C1C=C(O)CO1 Amb628324 [1,0,0,1,0,0|1,0,1]=4 3889 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [1,0,0,1,0,0|1,0,1]=4 3890 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [1,0,0,1,0,0|1,0,1]=4 3891 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [1,0,0,1,0,0|1,0,1]=4 3892 B7R1.2 O=C1CC(=O)NN1 Amb9809314 [1,0,0,1,0,0|1,0,0]=3 3893 B7R1.2 O=C1CC(=O)ON1 Amb33714889 [1,0,0,1,0,0|1,0,0]=3 3894 B7R1.2 O=C1CC(O)CN1 Amb19958404 [1,0,0,1,0,0|0,0,1]=3 3895 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,0,0,1,0,0|1,0,1]=4 3896 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|0,1,1]=4 3897 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [1,0,0,1,0,0|1,0,0]=3 3898 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [1,0,0,1,0,0|2,0,0]=4 3899 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [1,0,0,1,0,0|1,0,0]=3 3900 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [1,0,0,1,0,0|1,1,0]=4 3901 B7R1.2 O=C1CCC(O)C1 Amb22057378 [1,0,0,1,0,0|1,0,1]=4 3902 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [1,0,0,1,0,0|2,0,0]=4 3903 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [1,0,0,1,0,0|1,0,1]=4 3904 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [1,0,0,1,0,0|1,0,1]=4 3905 B7R1.2 O=C1CN(Cl)CN1 Amb27795741 [1,0,0,1,0,0|2,0,0]=4 3906 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [1,0,0,1,0,0|0,0,0]=2 3907 B7R1.2 O=C1CNC(=O)N1 Amb3598086 [1,0,0,1,0,0|1,0,0]=3 3908 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [1,0,0,1,0,0|0,0,0]=2 3909 B7R1.2 O=C1CNC(=O)S1 Amb22372196 [1,0,0,1,0,0|0,1,0]=3 3910 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [1,0,0,1,0,0|1,1,0]=4 3911 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [1,0,0,1,0,0|0,1,0]=3 3912 B7R1.2 O=C1CNC(=S)S1 Amb621648 [1,0,0,1,0,0|0,2,0]=4 3913 B7R1.2 O=C1COC(=O)C1 Amb2721303 [1,0,0,1,0,0|1,0,0]=3 3914 B7R1.2 O=C1COC(=O)N1 Amb1625991 [1,0,0,1,0,0|2,0,0]=4 3915 B7R1.2 O=C1COC(=O)O1 Amb27837383 [1,0,0,1,0,0|1,0,0]=3 3916 B7R1.2 O=C1COC(=O)[N-]1 Amb32656005 [1,0,0,1,0,0|2,0,0]=4 3917 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [1,0,0,1,0,0|1,0,0]=3 3918 B7R1.2 O=C1CSC(=O)N1 Amb1853667 [1,0,0,1,0,0|2,0,0]=4 3919 B7R1.2 O=C1CSC(=O)[N-]1 Amb435911 [1,0,0,1,0,0|2,0,0]=4 3920 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [1,0,0,1,0,0|0,0,1]=3 3921 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,0,0,1,0,0|1,0,1]=4 3922 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|0,1,1]=4 3923 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [1,0,0,1,0,0|0,0,1]=3 3924 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,0,0,1,0,0|1,0,1]=4 3925 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|0,1,1]=4 3926 B7R1.2 O=C1NCC(=S)N1 Amb2794498 [1,0,0,1,0,0|1,1,0]=4 3927 B7R1.2 O=C1NCC(=S)S1 Amb27785367 [1,0,0,1,0,0|0,2,0]=4 3928 B7R1.2 O=C1NNC(=O)N1 Amb20660475 [1,0,0,1,0,0|2,0,0]=4 3929 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,0,0,1,0,0|2,0,0]=4 3930 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|1,0,1]=4 3931 B7R1.3 N=C1COCCN1 Amb24654396 [1,0,0,1,0,0|1,0,1]=4 3932 B7R1.3 N=C1COCCN1 Amb28468104 [1,0,0,1,0,0|1,0,1]=4 3933 B7R1.3 O=C1CCC=CN1 Amb26365285 [1,0,0,1,0,0|1,0,1]=4 3934 B7R1.3 O=C1CCCCN1 Amb6892006 [1,0,0,1,0,0|1,0,1]=4 3935 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|1,0,1]=4 3936 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|1,0,1]=4 3937 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|1,0,1]=4 3938 B7R1.3 O=C1CCCNC1 Amb19958010 [1,0,0,1,0,0|1,0,1]=4 3939 B7R1.3 O=C1CCCOC1 Amb19373430 [1,0,0,1,0,0|1,0,1]=4 3940 B7R1.3 O=C1CCNCN1 Amb27458283 [1,0,0,1,0,0|2,0,0]=4 3941 B7R1.3 O=C1CNC=NN1 Amb27817820 [1,0,0,1,0,0|2,0,0]=4 3942 B7R1.3 O=C1CNCCN1 Amb4138465 [1,0,0,1,0,0|1,0,1]=4 3943 B7R1.3 O=C1CNCCN1 Amb6334808 [1,0,0,1,0,0|1,0,1]=4 3944 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|0,0,1]=3 3945 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|0,0,1]=3 3946 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|0,0,1]=3 3947 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,1]=4 3948 B7R1.3 O=C1CSC=CN1 Amb2386683 [1,0,0,1,0,0|0,1,1]=4 3949 B7R1.3 O=C1CSCCN1 Amb674722 [1,0,0,1,0,0|0,1,1]=4 3950 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|1,0,1]=4 3951 B7R1.3 O=C1NNCCO1 Amb32683554 [1,0,0,1,0,0|1,0,1]=4 3952 B7R1.3 OC1=NCCNC1 Amb22330543 [1,0,0,1,0,0|1,0,1]=4 3953 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|2,0,0]=4 3954 B7R1.10 C=C1CC(C=O)C1 Amb22896623 [1,0,0,1,0,0|2,0,0]=4 3955 B7R1.10 C=C1CN(C=O)C1 Amb30028121 [1,0,0,1,0,0|2,0,0]=4 3956 B7R1.10 C=CC1CC(=O)C1 Amb26409138 [1,0,0,1,0,0|2,0,0]=4 3957 B7R1.10 C=CC1CC(=O)N1 Amb26507633 [1,0,0,1,0,0|1,0,0]=3 3958 B7R1.10 C=C[C@@H]1CC(=O)N1 Amb27589344 [1,0,0,1,0,0|1,0,0]=3 3959 B7R1.10 COC1CC(=O)N1 Amb27802279 [1,0,0,1,0,0|2,0,0]=4 3960 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 3961 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [1,0,0,1,0,0|2,0,0]=4 3962 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|1,0,1]=4 3963 B7R1.10 O=C1CC(CI)N1 Amb27838210 [1,0,0,1,0,0|1,0,1]=4 3964 B7R1.10 O=C1CC(CO)C1 Amb16231082 [1,0,0,1,0,0|1,0,1]=4 3965 B7R1.10 O=C1CC(CO)N1 Amb22388379 [1,0,0,1,0,0|0,0,1]=3 3966 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [1,0,0,1,0,0|0,0,1]=3 3967 B7R1.12 C=C1CC1C(=O)O Amb9774969 [1,0,0,1,0,0|1,0,1]=4 3968 B7R1.12 CC(=O)C1N=C1C Amb28050540 [1,0,0,1,0,0|1,0,1]=4 3969 B7R1.12 CC1=CC1C(=O)O Amb27157805 [1,0,0,1,0,0|1,0,0]=3 3970 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|1,0,1]=4 3971 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,1]=4 3972 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|1,0,1]=4 3973 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|1,0,1]=4 3974 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|1,0,1]=4 3975 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|1,0,1]=4 3976 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|0,0,1]=3 3977 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|1,0,1]=4 3978 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|1,0,1]=4 3979 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|1,0,1]=4 3980 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|1,0,1]=4 3981 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|1,0,1]=4 3982 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|1,0,1]=4 3983 B7R1.12 O=C(Cl)C1CC1=O Amb27838228 [1,0,0,1,0,0|2,0,0]=4 3984 B7R1.18 CC(=O)C1CCN1 Amb28142364 [1,0,0,1,0,0|1,0,1]=4 3985 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [1,0,0,1,0,0|1,0,0]=3 3986 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|1,0,1]=4 3987 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|1,0,1]=4 3988 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|1,0,1]=4 3989 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [1,0,0,1,0,0|1,0,1]=4 3990 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|1,0,1]=4 3991 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|0,0,1]=3 3992 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|0,0,1]=3 3993 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,1]=4 3994 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|1,0,1]=4 3995 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,1,0,0|2,0,0]=4 3996 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,1,0,0|2,0,0]=4 3997 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,1,0,0|2,0,0]=4 3998 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,1,0,0|2,0,0]=4 3999 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|0,0,1]=3 4000 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|0,0,1]=3 4001 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|1,0,1]=4 4002 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|0,0,1]=3 4003 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|0,0,1]=3 4004 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|1,0,1]=4 4005 B7R1.20 CC(=O)NC1CC1 Amb3366973 [1,0,0,1,0,0|1,0,1]=4 4006 B7R1.20 CC(=O)OC1CO1 Amb25261586 [1,0,0,1,0,0|1,0,1]=4 4007 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|1,0,1]=4 4008 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|2,0,0]=4 4009 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|2,0,0]=4 4010 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|2,0,0]=4 4011 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,1,0|1,0,1]=4 4012 B7R1.16 O=C1CS(=O)(=O)C1 Amb22756924 [0,0,0,1,1,0|1,0,1]=4 4013 B9R1.35 C=C(C)C1=NCC(=O)O1 Amb27770419 [0,0,0,1,0,1|1,0,1]=4 4014 B9R1.35 C=C(C)C1CNC(=O)C1 Amb25921040 [0,0,0,1,0,1|2,0,0]=4 4015 B9R1.35 C=C(C)C1CNC(=O)O1 Amb33199198 [0,0,0,1,0,1|2,0,0]=4 4016 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,1|2,0,0]=4 4017 B9R1.35 C=C1CCN(C(C)=O)C1 Amb29879291 [0,0,0,1,0,1|2,0,0]=4 4018 B9R1.35 C=C1CNC(C(N)=O)C1 Amb27640101 [0,0,0,1,0,1|2,0,0]=4 4019 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,1|1,0,0]=3 4020 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,1|1,0,0]=3 4021 B9R1.35 CC(=O)C1=CCC(=S)O1 Amb27261937 [0,0,0,1,0,1|1,1,0]=4 4022 B9R1.35 CC(=O)C1=NC(=O)CS1 Amb29850784 [0,0,0,1,0,1|2,0,0]=4 4023 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [0,0,0,1,0,1|2,0,0]=4 4024 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [0,0,0,1,0,1|1,0,0]=3 4025 B9R1.35 CC(=O)C1CN=C(C)O1 Amb26529070 [0,0,0,1,0,1|2,0,0]=4 4026 B9R1.35 CC(=O)C1CNC(=O)C1 Amb27488585 [0,0,0,1,0,1|1,0,0]=3 4027 B9R1.35 CC(=O)N1C=CC(=O)N1 Amb24481715 [0,0,0,1,0,1|1,0,1]=4 4028 B9R1.35 CC(=O)N1CCC(=O)C1 Amb18832698 [0,0,0,1,0,1|1,0,0]=3 4029 B9R1.35 CC(=O)N1CCC(=O)N1 Amb32721860 [0,0,0,1,0,1|1,0,0]=3 4030 B9R1.35 CC(=O)N1CCC(O)C1 Amb20622704 [0,0,0,1,0,1|1,0,1]=4 4031 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,1,0,1|1,0,1]=4 4032 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,1,0,1|1,0,1]=4 4033 B9R1.35 CC(=O)N1CSC(N)=N1 Amb25790048 [0,0,0,1,0,1|2,0,0]=4 4034 B9R1.35 CC(=O)N1C[C@@H](O)CO1 Amb27956502 [0,0,0,1,0,1|1,0,1]=4 4035 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [0,0,0,1,0,1|2,0,0]=4 4036 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [0,0,0,1,0,1|2,0,0]=4 4037 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,1|1,0,0]=3 4038 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [0,0,0,1,0,1|2,0,0]=4 4039 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [0,0,0,1,0,1|2,0,0]=4 4040 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [0,0,0,1,0,1|2,0,0]=4 4041 B9R1.35 CC(O)C1CC(=O)NN1 Amb28285281 [0,0,0,1,0,1|1,0,1]=4 4042 B9R1.35 CC(O)C1CNC(=O)C1 Amb27258070 [0,0,0,1,0,1|1,0,1]=4 4043 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,1|1,0,0]=3 4044 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,1,0,1|2,0,0]=4 4045 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,1,0,1|2,0,0]=4 4046 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,1,0,1|2,0,0]=4 4047 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,1|2,0,0]=4 4048 B9R1.35 CC1=NC(C(=O)O)CS1 Amb18124720 [0,0,0,1,0,1|2,0,0]=4 4049 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [0,0,0,1,0,1|1,0,1]=4 4050 B9R1.35 CC1=NCC(C(=O)O)S1 Amb27958674 [0,0,0,1,0,1|0,1,1]=4 4051 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [0,0,0,1,0,1|1,0,1]=4 4052 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,1,0,1|1,0,1]=4 4053 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,1,0,1|1,0,1]=4 4054 B9R1.35 CC1=N[C@@H](C(=O)O)CS1 Amb32676192 [0,0,0,1,0,1|2,0,0]=4 4055 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,1,0,1|2,0,0]=4 4056 B9R1.35 CC1=N[C@H](C(=O)O)CS1 Amb35648200 [0,0,0,1,0,1|2,0,0]=4 4057 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,1|1,0,1]=4 4058 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|1,0,1]=4 4059 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|1,0,1]=4 4060 B9R1.35 C[C@@H](O)C1CNC(=O)C1 Amb27390672 [0,0,0,1,0,1|1,0,1]=4 4061 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NN1 Amb27632305 [0,0,0,1,0,1|1,0,1]=4 4062 B9R1.35 C[C@@H](O)[C@H]1CC(=O)NN1 Amb27422060 [0,0,0,1,0,1|1,0,1]=4 4063 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|1,0,1]=4 4064 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|1,0,1]=4 4065 B9R1.35 C[C@H](O)C1CNC(=O)C1 Amb27838586 [0,0,0,1,0,1|1,0,1]=4 4066 B9R1.35 C[C@H](O)[C@H]1CC(=O)NN1 Amb27789842 [0,0,0,1,0,1|1,0,1]=4 4067 B9R1.35 C[C@H](O)[C@H]1CNC(=O)C1 Amb27968562 [0,0,0,1,0,1|1,0,1]=4 4068 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|1,0,1]=4 4069 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|1,0,1]=4 4070 B9R1.35 NC(=O)C1=CNC(=O)C1 Amb27638843 [0,0,0,1,0,1|1,0,1]=4 4071 B9R1.35 NC(=O)C1CCC(=O)O1 Amb24466803 [0,0,0,1,0,1|2,0,0]=4 4072 B9R1.35 NC(=O)C1CNC(=O)C1 Amb1803351 [0,0,0,1,0,1|1,0,0]=3 4073 B9R1.35 NC(=O)C1CNC(=O)O1 Amb27200796 [0,0,0,1,0,1|2,0,0]=4 4074 B9R1.35 NC(=O)C1CSC(=O)C1 Amb27837681 [0,0,0,1,0,1|2,0,0]=4 4075 B9R1.35 NC(=O)[C@@H]1CCC(=O)O1 Amb25146823 [0,0,0,1,0,1|2,0,0]=4 4076 B9R1.35 NC(=O)[C@H]1CCC(=O)O1 Amb26909560 [0,0,0,1,0,1|2,0,0]=4 4077 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,0,0,1,0,1|1,0,1]=4 4078 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,0,0,1,0,1|1,0,1]=4 4079 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,0,0,1,0,1|1,0,1]=4 4080 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,0,0,1,0,1|1,0,1]=4 4081 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,0,0,1,0,1|1,0,1]=4 4082 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,0,0,1,0,1|1,0,1]=4 4083 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,0,0,1,0,1|1,0,1]=4 4084 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,0,0,1,0,1|1,0,1]=4 4085 B9R1.35 O=C(O)C1CC(Br)=NO1 Amb26852251 [0,0,0,1,0,1|1,0,1]=4 4086 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,0,0,1,0,1|1,0,1]=4 4087 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,0,0,1,0,1|1,0,1]=4 4088 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,0,0,1,0,1|1,0,1]=4 4089 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,1,0,1|0,0,2]=4 4090 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,1,0,1|0,0,2]=4 4091 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,1,0,1|0,0,2]=4 4092 B9R1.35 O=C(O)C1CSS(=O)C1 Amb27165800 [0,0,0,1,0,1|2,0,0]=4 4093 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,1,0,1|0,0,2]=4 4094 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,1,0,1|0,0,2]=4 4095 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,0,0,1,0,1|0,1,1]=4 4096 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,0,0,1,0,1|1,0,1]=4 4097 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,0,0,1,0,1|1,0,1]=4 4098 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,0,0,1,0,1|1,0,1]=4 4099 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,1,0,1|0,0,2]=4 4100 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|0,1,1]=4 4101 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,0,0,1,0,1|1,0,1]=4 4102 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,0,0,1,0,1|1,0,1]=4 4103 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,0,0,1,0,1|1,0,1]=4 4104 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,0,0,1,0,1|1,0,1]=4 4105 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|1,0,1]=4 4106 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,1,0,1|0,0,2]=4 4107 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,1,0,1|0,0,2]=4 4108 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,1,0,1|0,0,2]=4 4109 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,0,0,1,0,1|0,1,1]=4 4110 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,0,0,1,0,1|0,1,1]=4 4111 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,0,0,1,0,1|1,0,1]=4 4112 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,0,0,1,0,1|1,0,1]=4 4113 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,0,0,1,0,1|1,0,1]=4 4114 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,1,0,1|0,0,2]=4 4115 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,1,0,1|0,0,2]=4 4116 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,0,0,1,0,1|1,0,1]=4 4117 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,0,0,1,0,1|1,0,1]=4 4118 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,1,0,1|0,0,2]=4 4119 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,1,0,1|0,0,2]=4 4120 B9R1.35 O=C1C=C(C(=O)O)CC1 Amb13883804 [0,0,0,1,0,1|1,0,1]=4 4121 B9R1.35 O=C1C=C(C(=O)O)NN1 Amb18944048 [0,0,0,1,0,1|0,0,2]=4 4122 B9R1.35 O=C1C=C(C(=O)O)ON1 Amb19889163 [0,0,0,1,0,1|0,0,2]=4 4123 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,1,0,1|1,0,0]=3 4124 B9R1.35 O=C1C=CC(C(=O)O)N1 Amb27775192 [0,0,0,1,0,1|2,0,0]=4 4125 B9R1.35 O=C1CC(C(=O)O)=CN1 Amb18832707 [0,0,0,1,0,1|0,0,1]=3 4126 B9R1.35 O=C1CC(C(=O)O)=CO1 Amb3499387 [0,0,0,1,0,1|1,0,1]=4 4127 B9R1.35 O=C1CC(C(=O)O)=NN1 Amb18278720 [0,0,0,1,0,1|0,0,1]=3 4128 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,1,0,1|0,0,0]=2 4129 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,1,0,1|1,0,0]=3 4130 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,1,0,1|1,0,0]=3 4131 B9R1.35 O=C1CC(C(=O)O)NN1 Amb18642739 [0,0,0,1,0,1|0,0,0]=2 4132 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [0,0,0,1,0,1|2,0,0]=4 4133 B9R1.35 O=C1CCC(C(=O)Cl)O1 Amb24648754 [0,0,0,1,0,1|2,0,0]=4 4134 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,1|1,0,0]=3 4135 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [0,0,0,1,0,1|2,0,0]=4 4136 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [0,0,0,1,0,1|2,0,0]=4 4137 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [0,0,0,1,0,1|2,0,0]=4 4138 B9R1.35 O=C1CC[C@@H](C(=O)Cl)O1 Amb22388653 [0,0,0,1,0,1|2,0,0]=4 4139 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,1|1,0,0]=3 4140 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [0,0,0,1,0,1|2,0,0]=4 4141 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [0,0,0,1,0,1|2,0,0]=4 4142 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [0,0,0,1,0,1|2,0,0]=4 4143 B9R1.35 O=C1CC[C@H](C(=O)Cl)O1 Amb22747149 [0,0,0,1,0,1|2,0,0]=4 4144 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,1|1,0,0]=3 4145 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [0,0,0,1,0,1|2,0,0]=4 4146 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [0,0,0,1,0,1|2,0,0]=4 4147 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,1|0,0,0]=2 4148 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,1|0,0,0]=2 4149 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,1|0,0,0]=2 4150 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,1|0,0,0]=2 4151 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,1,0,1|1,0,0]=3 4152 B9R1.35 O=C1CSC(C(=O)Cl)O1 Amb25724287 [0,0,0,1,0,1|2,0,0]=4 4153 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,1,0,1|1,0,0]=3 4154 B9R1.35 O=C1CSC(C(=O)O)O1 Amb25063335 [0,0,0,1,0,1|2,0,0]=4 4155 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,1,0,1|0,0,0]=2 4156 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,1,0,1|1,0,0]=3 4157 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,1,0,1|0,0,0]=2 4158 B9R1.35 O=C1N=C(C(=O)Cl)CN1 Amb26587208 [0,0,0,1,0,1|2,0,0]=4 4159 B9R1.35 O=C1N=C(C(=O)O)NN1 Amb18944041 [0,0,0,1,0,1|1,0,1]=4 4160 B9R1.35 O=C1NC(C(=O)O)CO1 Amb15701690 [0,0,0,1,0,1|2,0,0]=4 4161 B9R1.35 O=C1NC(C(=O)O)CS1 Amb3319393 [0,0,0,1,0,1|2,0,0]=4 4162 B9R1.35 O=C1NC=C(C(=O)O)N1 Amb18278248 [0,0,0,1,0,1|1,0,1]=4 4163 B9R1.35 O=C1NC=C(C(=O)O)S1 Amb33531086 [0,0,0,1,0,1|1,0,1]=4 4164 B9R1.35 O=C1NCC(C(=O)O)N1 Amb2780032 [0,0,0,1,0,1|1,0,0]=3 4165 B9R1.35 O=C1NCC(C(=O)O)O1 Amb24112958 [0,0,0,1,0,1|1,0,0]=3 4166 B9R1.35 O=C1NCC(C(=O)O)S1 Amb24084914 [0,0,0,1,0,1|1,0,0]=3 4167 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 Amb3997304 [0,0,0,1,0,1|1,0,0]=3 4168 B9R1.35 O=C1NC[C@@H](C(=O)O)O1 Amb25146207 [0,0,0,1,0,1|1,0,0]=3 4169 B9R1.35 O=C1NC[C@H](C(=O)O)N1 Amb24079612 [0,0,0,1,0,1|1,0,0]=3 4170 B9R1.35 O=C1NC[C@H](C(=O)O)O1 Amb27771494 [0,0,0,1,0,1|1,0,0]=3 4171 B9R1.35 O=C1NN=C(C(=O)O)N1 Amb19205315 [0,0,0,1,0,1|1,0,1]=4 4172 B9R1.35 O=C1NN=C(C(=O)O)N1 Amb21955579 [0,0,0,1,0,1|1,0,1]=4 4173 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 Amb24340149 [0,0,0,1,0,1|2,0,0]=4 4174 B9R1.35 O=C1N[C@@H](C(=O)O)CS1 Amb537246 [0,0,0,1,0,1|2,0,0]=4 4175 B9R1.35 O=C1N[C@H](C(=O)O)CO1 Amb19517080 [0,0,0,1,0,1|2,0,0]=4 4176 B9R1.35 O=C1N[C@H](C(=O)O)CS1 Amb1157856 [0,0,0,1,0,1|2,0,0]=4 4177 B9R1.35 O=C1OCC(C(=O)O)O1 Amb25767974 [0,0,0,1,0,1|2,0,0]=4 4178 B9R1.35 O=C1SCC(C(=O)O)S1 Amb23504458 [0,0,0,1,0,1|2,0,0]=4 4179 B9R1.46 O=C(O)CCC1=C(Br)C1 Amb27650642 [0,0,0,1,0,1|2,0,0]=4 4180 B9R1.49 O=C1CCC(=O)COC1 Amb2707216 [0,0,0,1,0,1|2,0,0]=4 4181 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,0,0,1,0,1|1,0,1]=4 4182 B9R1.49 O=C1CCNC(=O)CC1 Amb22490261 [0,0,0,1,0,1|1,0,0]=3 4183 B9R1.49 O=C1CCS(=O)CCN1 Amb26480169 [0,0,0,1,0,1|2,0,0]=4 4184 B9R1.49 O=C1COC(=O)CCN1 Amb27168286 [0,0,0,1,0,1|0,0,0]=2 4185 B9R1.53 C=C1CC(CC(=O)O)C1 Amb35788335 [0,0,0,1,0,1|2,0,0]=4 4186 B9R1.53 C=C1CN(CC(=O)O)C1 Amb30026788 [0,0,0,1,0,1|1,0,0]=3 4187 B9R1.53 CC(=O)CC1CC(=O)N1 Amb26593659 [0,0,0,1,0,1|1,0,0]=3 4188 B9R1.53 CC(=O)OC1CC(=O)C1 Amb21961279 [0,0,0,1,0,1|2,0,0]=4 4189 B9R1.53 CC(=O)OC1CC(=O)N1 Amb8383894 [0,0,0,1,0,1|1,0,0]=3 4190 B9R1.53 CC(=O)O[C@@H]1CC(=O)N1 Amb27961491 [0,0,0,1,0,1|1,0,0]=3 4191 B9R1.53 CC(=O)SC1CC(=O)N1 Amb27225587 [0,0,0,1,0,1|1,0,0]=3 4192 B9R1.53 CC(O)CC1CC(=O)N1 Amb26596056 [0,0,0,1,0,1|1,0,1]=4 4193 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,0,0,1,0,1|1,0,1]=4 4194 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,0,0,1,0,1|1,0,1]=4 4195 B9R1.53 NC(=O)CC1CC(=O)N1 Amb27186130 [0,0,0,1,0,1|1,0,0]=3 4196 B9R1.53 O=C(O)CC1CC(=O)C1 Amb27493654 [0,0,0,1,0,1|1,0,0]=3 4197 B9R1.53 O=C(O)CC1CC(=O)N1 Amb24351879 [0,0,0,1,0,1|0,0,0]=2 4198 B9R1.53 O=C(O)CN1CC(O)C1 Amb25339150 [0,0,0,1,0,1|0,0,2]=4 4199 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,0,0,1,0,1|1,0,1]=4 4200 B9R1.66 O=C1CS(=O)(=O)CCN1 Amb21912472 [0,0,0,1,0,1|1,0,1]=4 4201 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,0,0,1,0,1|1,0,1]=4 4202 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,0,0,1,0,1|1,0,1]=4 4203 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,0,0,1,0,1|1,0,1]=4 4204 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,0,0,1,0,1|1,0,1]=4 4205 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [0,0,0,1,0,1|2,0,0]=4 4206 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [0,0,0,1,0,1|2,0,0]=4 4207 B9R1.161 CC(=O)C1=NC1C(C)=O Amb25728261 [0,0,0,1,0,1|1,0,1]=4 4208 B9R1.161 CC(=O)C1CC1C(C)=O Amb27861276 [0,0,0,1,0,1|2,0,0]=4 4209 B9R1.161 CC(=O)C1OC1C(N)=O Amb28383609 [0,0,0,1,0,1|2,0,0]=4 4210 B9R1.161 CC(=O)[C@@H]1C[C@H]1C(C)=O Amb28246517 [0,0,0,1,0,1|2,0,0]=4 4211 B9R1.161 CC(=O)[C@@H]1O[C@@H]1C(N)=O Amb27194051 [0,0,0,1,0,1|2,0,0]=4 4212 B9R1.161 CC(=O)[C@H]1C[C@H]1C(C)=O Amb28248083 [0,0,0,1,0,1|2,0,0]=4 4213 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [0,0,0,1,0,1|2,0,0]=4 4214 B9R1.161 NC(=O)C1OC1C(=O)O Amb25695985 [0,0,0,1,0,1|2,0,0]=4 4215 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(=O)O Amb24623178 [0,0,0,1,0,1|2,0,0]=4 4216 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(=O)O Amb27447217 [0,0,0,1,0,1|2,0,0]=4 4217 B9R1.161 NC(=O)[C@H]1C[C@H]1C(=O)O Amb27436130 [0,0,0,1,0,1|2,0,0]=4 4218 B9R1.161 O=C(O)C1CC1C(=O)Cl Amb26959493 [0,0,0,1,0,1|2,0,0]=4 4219 B9R1.161 O=C(O)C1CC1C(=O)O Amb1350467 [0,0,0,1,0,1|2,0,0]=4 4220 B9R1.161 O=C(O)C1OC1C(=O)O Amb4001391 [0,0,0,1,0,1|2,0,0]=4 4221 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O Amb22901897 [0,0,0,1,0,1|2,0,0]=4 4222 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O Amb22799776 [0,0,0,1,0,1|2,0,0]=4 4223 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Amb25979295 [0,0,0,1,0,1|2,0,0]=4 4224 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O Amb3442175 [0,0,0,1,0,1|2,0,0]=4 4225 B9R1.161 O=C(O)[C@H]1O[C@@H]1C(=O)O Amb22262951 [0,0,0,1,0,1|2,0,0]=4 4226 B9R1.161 O=C([O-])[C@@H]1N[C@H]1C(=O)[O-] Amb24120358 [0,0,0,1,0,1|1,0,1]=4 4227 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,0,0,1,0,1|1,0,1]=4 4228 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,0,0,1,0,1|1,0,1]=4 4229 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,0,0,1,0,1|1,0,1]=4 4230 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,0,0,1,0,1|1,0,1]=4 4231 B9R1.1 CCC1CNC(=O)CO1 Amb27427622 [0,1,0,1,0,0|1,0,1]=4 4232 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,1]=4 4233 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,1,0,1,0,0|1,0,1]=4 4234 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,1,0,1,0,0|1,0,1]=4 4235 B9R1.1 O=C1CC=C(CO)CC1 Amb28253672 [0,1,0,1,0,0|2,0,0]=4 4236 B9R1.1 O=C1CCC(CO)CN1 Amb19958990 [0,1,0,1,0,0|1,0,1]=4 4237 B9R1.1 O=C1CC\C(=N/O)CN1 Amb27168983 [0,1,0,1,0,0|1,0,0]=3 4238 B9R1.1 O=C1COC(CBr)CN1 Amb28281419 [0,1,0,1,0,0|1,0,1]=4 4239 B9R1.1 O=C1COC(CO)CN1 Amb22236094 [0,1,0,1,0,0|0,0,2]=4 4240 B9R1.1 O=C1CO[C@H](CO)CN1 Amb10067153 [0,1,0,1,0,0|0,0,2]=4 4241 B9R1.1 O=CC1=CNC(=O)NC1 Amb27455585 [0,1,0,1,0,0|2,0,0]=4 4242 B9R1.10 CC1(C)CNC(=O)CO1 Amb26423126 [0,1,0,1,0,0|1,0,1]=4 4243 B9R1.10 O=C1CCP(=O)(O)CC1 Amb27838625 [0,1,0,1,0,0|2,0,0]=4 4244 B9R1.55 C=C(C)[C@@H]1NC(=O)[C@@H]1C Amb28129030 [0,1,0,1,0,0|2,0,0]=4 4245 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,1,0,1,0,0|2,0,0]=4 4246 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,1,0,0|1,0,1]=4 4247 B9R1.55 CN1CC(C(=O)O)C1=O Amb17593354 [0,1,0,1,0,0|2,0,0]=4 4248 B9R1.55 CS(=O)[C@H]1NC(=O)[C@@H]1Cl Amb28458469 [0,1,0,1,0,0|2,0,0]=4 4249 B9R1.55 NC(=O)C1NC(=O)C1N Amb27445718 [0,1,0,1,0,0|1,0,0]=3 4250 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [0,1,0,1,0,0|0,0,0]=2 4251 B9R1.67 C=C(C)CN1CCC1=O Amb27161514 [0,1,0,1,0,0|2,0,0]=4 4252 B9R1.67 CC(O)CN1CCC1=O Amb27963094 [0,1,0,1,0,0|1,0,1]=4 4253 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,1]=4 4254 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,1]=4 4255 B9R1.67 NC(=O)CN1CCC1=O Amb28049662 [0,1,0,1,0,0|1,0,0]=3 4256 B9R1.69 C=C1NC(=O)CNC1=O Amb24515642 [0,1,0,1,0,0|1,0,1]=4 4257 B9R1.69 CC1=CC(=O)C(O)=CN1 Amb22552444 [0,1,0,1,0,0|1,0,1]=4 4258 B9R1.69 CC1=CC(=O)CCC1=O Amb28455194 [0,1,0,1,0,0|2,0,0]=4 4259 B9R1.69 CC1=CC(=O)NNC1=O Amb19657930 [0,1,0,1,0,0|2,0,0]=4 4260 B9R1.69 CC1=CNC(=O)C(C)N1 Amb27758403 [0,1,0,1,0,0|2,0,0]=4 4261 B9R1.69 CC1=CNC(=O)C(C)O1 Amb27801351 [0,1,0,1,0,0|1,0,1]=4 4262 B9R1.69 CC1=CNC(=O)CC1=O Amb27246493 [0,1,0,1,0,0|1,0,1]=4 4263 B9R1.69 CC1=CNC(=O)OC1=O Amb28208149 [0,1,0,1,0,0|2,0,0]=4 4264 B9R1.69 CC1=N[C@@H](C)C(=O)OC1 Amb27656381 [0,1,0,1,0,0|1,0,1]=4 4265 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,1,0,0|1,0,1]=4 4266 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,1,0,0|1,0,1]=4 4267 B9R1.69 CC1CNC(=O)C(C)O1 Amb25831184 [0,1,0,1,0,0|1,0,1]=4 4268 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 4269 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,1,0,1,0,0|1,0,1]=4 4270 B9R1.69 CC1NC(=O)CCC1=O Amb27874094 [0,1,0,1,0,0|1,0,0]=3 4271 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|1,0,1]=4 4272 B9R1.69 CC1NC(=O)CNC1=O Amb24477892 [0,1,0,1,0,0|1,0,0]=3 4273 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [0,1,0,1,0,0|0,0,0]=2 4274 B9R1.69 CC1NC(=O)COC1C Amb27440075 [0,1,0,1,0,0|1,0,1]=4 4275 B9R1.69 CC1NCC(=O)NC1=O Amb26514613 [0,1,0,1,0,0|1,0,1]=4 4276 B9R1.69 CC1OC(=O)C=CC1=O Amb27948593 [0,1,0,1,0,0|1,0,1]=4 4277 B9R1.69 CC1OC(=O)COC1=O Amb27421415 [0,1,0,1,0,0|1,0,0]=3 4278 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,1,0,1,0,0|1,0,1]=4 4279 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,1,0,1,0,0|1,0,0]=3 4280 B9R1.69 CN1CC(=O)NCC1=O Amb24271107 [0,1,0,1,0,0|1,0,0]=3 4281 B9R1.69 CN1CC(N)=NCC1=O Amb26968686 [0,1,0,1,0,0|2,0,0]=4 4282 B9R1.69 CN1CC(O)CCC1=O Amb22304825 [0,1,0,1,0,0|1,0,1]=4 4283 B9R1.69 CN1CNC(=O)CC1=O Amb27267762 [0,1,0,1,0,0|2,0,0]=4 4284 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)O1 Amb28287913 [0,1,0,1,0,0|1,0,1]=4 4285 B9R1.69 C[C@@H]1N=C(N)CNC1=O Amb25031882 [0,1,0,1,0,0|2,0,0]=4 4286 B9R1.69 C[C@@H]1NC(=O)CNC1=O Amb22233064 [0,1,0,1,0,0|1,0,0]=3 4287 B9R1.69 C[C@@H]1NC(=O)COC1=O Amb28059067 [0,1,0,1,0,0|0,0,0]=2 4288 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [0,1,0,1,0,0|1,0,1]=4 4289 B9R1.69 C[C@@H]1O[C@H](C)CNC1=O Amb24561641 [0,1,0,1,0,0|1,0,1]=4 4290 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,1,0,0|1,0,1]=4 4291 B9R1.69 C[C@H]1CNC(=O)[C@H](C)O1 Amb24629269 [0,1,0,1,0,0|1,0,1]=4 4292 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,1,0,1,0,0|1,0,1]=4 4293 B9R1.69 C[C@H]1NC(=O)CNC1=O Amb25726602 [0,1,0,1,0,0|1,0,0]=3 4294 B9R1.69 C[C@H]1OC(=O)C=CC1=O Amb28351021 [0,1,0,1,0,0|1,0,1]=4 4295 B9R1.69 N=C1CC(=O)NNC1=O Amb27392548 [0,1,0,1,0,0|2,0,0]=4 4296 B9R1.69 NC1=NC(=O)NCC1=O Amb21963698 [0,1,0,1,0,0|2,0,0]=4 4297 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,1,0,1,0,0|1,0,1]=4 4298 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,1,0,1,0,0|1,0,1]=4 4299 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,1,0,1,0,0|1,0,1]=4 4300 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,1,0,1,0,0|1,0,1]=4 4301 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,1,0,1,0,0|1,0,1]=4 4302 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,1,0,1,0,0|1,0,1]=4 4303 B9R1.69 O=C1CCC(=O)C(Br)C1 Amb25775016 [0,1,0,1,0,0|2,0,0]=4 4304 B9R1.69 O=C1CCC(=O)C(Cl)C1 Amb24452362 [0,1,0,1,0,0|2,0,0]=4 4305 B9R1.69 O=C1CCC(=O)N(P)C1 Amb25854386 [0,1,0,1,0,0|1,0,0]=3 4306 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [0,1,0,1,0,0|1,0,1]=4 4307 B9R1.69 O=C1CCS(=O)CC1O Amb29847922 [0,1,0,1,0,0|2,0,0]=4 4308 B9R1.69 O=C1CNC(=O)C(=O)N1 Amb22263199 [0,1,0,1,0,0|1,0,1]=4 4309 B9R1.69 O=C1CNC(=O)C(Br)N1 Amb26341108 [0,1,0,1,0,0|1,0,0]=3 4310 B9R1.69 O=C1CNC(=O)C(O)N1 Amb27204459 [0,1,0,1,0,0|1,0,0]=3 4311 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,1,0,1,0,0|0,0,2]=4 4312 B9R1.69 O=C1NC=C(O)C(=O)N1 Amb19517092 [0,1,0,1,0,0|1,0,1]=4 4313 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,1,0,1,0,0|1,0,1]=4 4314 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,1,0,1,0,0|1,0,1]=4 4315 B9R1.69 O=C1NN=C(O)C(=O)N1 Amb28368145 [0,1,0,1,0,0|2,0,0]=4 4316 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,1]=4 4317 B9R1.80 COC(=O)CNC1CC1 Amb6706354 [0,1,0,1,0,0|1,0,1]=4 4318 B9R1.80 O=C(CNC1CC1)NO Amb27395406 [0,1,0,1,0,0|1,0,1]=4 4319 B9R1.82 C=C1CC(C(=O)OC)C1 Amb21962131 [0,1,0,1,0,0|2,0,0]=4 4320 B9R1.82 C=C1CN(C(=O)CBr)C1 Amb29879466 [0,1,0,1,0,0|2,0,0]=4 4321 B9R1.82 C=C1CN(C(=O)CC)C1 Amb35608822 [0,1,0,1,0,0|2,0,0]=4 4322 B9R1.82 C=C1CN(C(=O)CCl)C1 Amb29879424 [0,1,0,1,0,0|2,0,0]=4 4323 B9R1.82 C=C1CN(C(=O)CN)C1 Amb35625953 [0,1,0,1,0,0|2,0,0]=4 4324 B9R1.82 C=C1CN(C(=O)CS)C1 Amb35642161 [0,1,0,1,0,0|2,0,0]=4 4325 B9R1.82 C=C1CN(C(=O)NC)C1 Amb35642030 [0,1,0,1,0,0|2,0,0]=4 4326 B9R1.82 C=C1CN(C(=O)OC)C1 Amb35642031 [0,1,0,1,0,0|2,0,0]=4 4327 B9R1.82 C=CC(=O)N1CC(=O)C1 Amb27206624 [0,1,0,1,0,0|1,0,1]=4 4328 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,0]=3 4329 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,1,0,1,0,0|0,0,0]=2 4330 B9R1.82 COC(=O)C1CC(C)N1 Amb33743739 [0,1,0,1,0,0|1,0,1]=4 4331 B9R1.82 COC(=O)C1CC(C)N1 Amb33743758 [0,1,0,1,0,0|1,0,1]=4 4332 B9R1.82 COC(=O)N1CC(O)C1 Amb24056451 [0,1,0,1,0,0|1,0,1]=4 4333 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,1,0,1,0,0|0,0,0]=2 4334 B9R1.82 COC(=O)[C@@H]1CC(=S)N1 Amb24478569 [0,1,0,1,0,0|0,1,0]=3 4335 B9R1.82 COC(C)C1CC(=O)N1 Amb28320401 [0,1,0,1,0,0|1,0,1]=4 4336 B9R1.82 C[C@@H](C=O)C1CC(=O)N1 Amb28184488 [0,1,0,1,0,0|1,0,1]=4 4337 B9R1.82 C[C@@H](CO)[C@@H]1CC(=O)N1 Amb28059566 [0,1,0,1,0,0|1,0,1]=4 4338 B9R1.82 NCC(=O)N1CC(O)C1 Amb28049187 [0,1,0,1,0,0|1,0,1]=4 4339 B9R1.82 NNC(=O)C1CC(=O)C1 Amb28049790 [0,1,0,1,0,0|2,0,0]=4 4340 B9R1.82 O=C(CBr)N1CC(O)C1 Amb27495597 [0,1,0,1,0,0|1,0,1]=4 4341 B9R1.82 O=C(CCl)N1CC(O)C1 Amb25884848 [0,1,0,1,0,0|1,0,1]=4 4342 B9R1.82 O=C1CC(C(=O)NO)C1 Amb27163827 [0,1,0,1,0,0|1,0,0]=3 4343 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,1,0,1,0,0|1,0,1]=4 4344 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,1]=4 4345 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|0,0,2]=4 4346 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|0,1,1]=4 4347 B9R1.95 CC(=O)N1CC(C=O)C1 Amb27832803 [0,1,0,1,0,0|1,0,1]=4 4348 B9R1.95 CC(=O)N1CC(CO)C1 Amb26549681 [0,1,0,1,0,0|1,0,1]=4 4349 B9R1.95 NN=C1CC(C(=O)O)C1 Amb23570285 [0,1,0,1,0,0|2,0,0]=4 4350 B9R1.95 O=C[C@H]1C[C@@H](C(=O)O)C1 Amb33309677 [0,1,0,1,0,0|1,0,1]=4 4351 B9R1.125 CC1(C=O)CCC(=O)O1 Amb28348513 [0,1,0,1,0,0|1,0,1]=4 4352 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,1,0,1,0,0|1,0,1]=4 4353 B9R1.138 CC1(C)NCC(=O)N1O Amb27945580 [0,1,0,1,0,0|1,0,1]=4 4354 B9R1.147 CC1(NCC(=O)O)CC1 Amb27444501 [0,1,0,1,0,0|1,0,1]=4 4355 B9R1.36 CN1CC(C)(O)CC1=O Amb27779571 [0,1,0,1,0,0|1,0,1]=4 4356 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,1,0,1,0,0|2,0,0]=4 4357 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,1,0,1,0,0|2,0,0]=4 4358 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [0,1,0,1,0,0|2,0,0]=4 4359 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [0,1,0,1,0,0|2,0,0]=4 4360 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,1,0,1,0,0|2,0,0]=4 4361 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,1,0,1,0,0|1,0,1]=4 4362 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,1,0,1,0,0|1,0,1]=4 4363 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,1,0,1,0,0|1,0,1]=4 4364 B9R1.152 C=C(C)C1(C)CC(=O)N1 Amb25791049 [0,1,0,1,0,0|2,0,0]=4 4365 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [0,1,0,1,0,0|2,0,0]=4 4366 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,1,0,1,0,0|2,0,0]=4 4367 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [0,1,0,1,0,0|2,0,0]=4 4368 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [0,1,0,1,0,0|1,0,0]=3 4369 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [0,1,0,1,0,0|1,0,0]=3 4370 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,1,0,1,0,0|1,0,1]=4 4371 B9R1.164 O=C(O)C1CP(=O)(O)C1 Amb4297467 [0,1,0,1,0,0|2,0,0]=4 4372 B9R1.164 O=C(O)C1CS(=O)(=O)C1 Amb8439029 [0,1,0,1,0,0|2,0,0]=4 4373 B9R2.19 O=C1NC[C@H]2C[C@@H]1O2 Amb27841075 [0,0,0,2,0,0|1,0,1]=4 4374 B9R2.35 CC1=C[C@@H]2C(=O)N[C@H]12 Amb28133669 [0,0,0,2,0,0|2,0,0]=4 4375 B9R2.35 O=C1NC2C(O)CC12 Amb28368878 [0,0,0,2,0,0|1,0,1]=4 4376 B5R0.5 C=C(Br)C(=O)O Amb20620403 [0,0,0,0,2,0|1,0,1]=4 4377 B5R0.5 C=C(Br)C(C)=O Amb17593709 [0,0,0,0,2,0|2,0,0]=4 4378 B5R0.5 C=C(C)C(=O)Cl Amb534203 [0,0,0,0,2,0|2,0,0]=4 4379 B5R0.5 C=C(C)C(=O)O Amb6608998 [0,0,0,0,2,0|1,0,0]=3 4380 B5R0.5 C=C(C)C(C)=O Amb17593021 [0,0,0,0,2,0|2,0,0]=4 4381 B5R0.5 C=C(C)C(N)=O Amb6609019 [0,0,0,0,2,0|2,0,0]=4 4382 B5R0.5 C=C(Cl)C(=O)O Amb17933971 [0,0,0,0,2,0|1,0,1]=4 4383 B5R0.5 C=C(Cl)C(C)=O Amb28284771 [0,0,0,0,2,0|2,0,0]=4 4384 B5R0.5 C=C(F)C(=O)O Amb2688008 [0,0,0,0,2,0|1,0,1]=4 4385 B5R0.5 C=C(F)C(C)=O Amb17593032 [0,0,0,0,2,0|2,0,0]=4 4386 B5R0.5 CC(=O)C(=N)N Amb24409561 [0,0,0,0,2,0|2,0,0]=4 4387 B5R0.5 CC(=O)C(=O)Cl Amb17593107 [0,0,0,0,2,0|1,0,0]=3 4388 B5R0.5 CC(=O)C(=O)O Amb932807 [0,0,0,0,2,0|0,0,0]=2 4389 B5R0.5 CC(=O)C(=O)[O-] Amb22043412 [0,0,0,0,2,0|0,0,1]=3 4390 B5R0.5 CC(=O)C(C)=O Amb6608675 [0,0,0,0,2,0|1,0,0]=3 4391 B5R0.5 CC(=O)C(C)=S Amb27632834 [0,0,0,0,2,0|1,1,0]=4 4392 B5R0.5 CC(=O)C(C)O Amb6608962 [0,0,0,0,2,0|1,0,1]=4 4393 B5R0.5 CC(=O)C(N)=O Amb17593028 [0,0,0,0,2,0|1,0,0]=3 4394 B5R0.5 CC(=O)C(N)=S Amb33528965 [0,0,0,0,2,0|1,1,0]=4 4395 B5R0.5 CC(=O)C(O)O Amb22436762 [0,0,0,0,2,0|0,0,2]=4 4396 B5R0.5 CC(=O)N(C)O Amb24066817 [0,0,0,0,2,0|2,0,0]=4 4397 B5R0.5 CC(=S)C(=O)O Amb27424126 [0,0,0,0,2,0|0,1,0]=3 4398 B5R0.5 CC(Br)C(=O)O Amb2795764 [0,0,0,0,2,0|1,0,1]=4 4399 B5R0.5 CC(C)C(=O)O Amb3939822 [0,0,0,0,2,0|1,0,1]=4 4400 B5R0.5 CC(Cl)C(=O)O Amb3940363 [0,0,0,0,2,0|1,0,1]=4 4401 B5R0.5 CC(F)C(=O)O Amb10605770 [0,0,0,0,2,0|1,0,1]=4 4402 B5R0.5 CC(I)C(=O)O Amb26450528 [0,0,0,0,2,0|1,0,1]=4 4403 B5R0.5 CC(N)C(=O)O Amb32724352 [0,0,0,0,2,0|1,0,1]=4 4404 B5R0.5 CC(N)C(=O)O Amb5716847 [0,0,0,0,2,0|1,0,1]=4 4405 B5R0.5 CC(O)C(=O)O Amb9703100 [0,0,0,0,2,0|0,0,2]=4 4406 B5R0.5 CC(S)C(=O)O Amb6608753 [0,0,0,0,2,0|0,1,1]=4 4407 B5R0.5 CN(C)C(=O)O Amb22348477 [0,0,0,0,2,0|2,0,0]=4 4408 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [0,0,0,0,2,0|1,0,1]=4 4409 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [0,0,0,0,2,0|1,0,1]=4 4410 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [0,0,0,0,2,0|1,0,1]=4 4411 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [0,0,0,0,2,0|1,0,1]=4 4412 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [0,0,0,0,2,0|0,0,2]=4 4413 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [0,0,0,0,2,0|1,0,1]=4 4414 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [0,0,0,0,2,0|1,0,1]=4 4415 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [0,0,0,0,2,0|1,0,1]=4 4416 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [0,0,0,0,2,0|1,0,1]=4 4417 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [0,0,0,0,2,0|1,0,1]=4 4418 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [0,0,0,0,2,0|0,0,2]=4 4419 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [0,0,0,0,2,0|0,1,1]=4 4420 B5R0.5 N=C(S)C(=O)O Amb18640468 [0,0,0,0,2,0|1,1,0]=4 4421 B5R0.5 NC(=O)C(=O)O Amb32666615 [0,0,0,0,2,0|1,0,0]=3 4422 B5R0.5 NC(=O)C(=O)O Amb3940455 [0,0,0,0,2,0|1,0,0]=3 4423 B5R0.5 NC(=O)C(=O)[O-] Amb22053860 [0,0,0,0,2,0|1,0,1]=4 4424 B5R0.5 NC(=O)C(=O)[O-] Amb22730546 [0,0,0,0,2,0|1,0,1]=4 4425 B5R0.5 NC(=O)C(N)=O Amb3886526 [0,0,0,0,2,0|2,0,0]=4 4426 B5R0.5 O=C(Br)C(=O)Br Amb8513454 [0,0,0,0,2,0|2,0,0]=4 4427 B5R0.5 O=C(Cl)C(=O)Cl Amb2793009 [0,0,0,0,2,0|2,0,0]=4 4428 B5R0.5 O=C(F)C(=O)F Amb10840380 [0,0,0,0,2,0|2,0,0]=4 4429 B5R0.5 O=C(O)C(=O)Br Amb27863598 [0,0,0,0,2,0|1,0,0]=3 4430 B5R0.5 O=C(O)C(=O)O Amb10608980 [0,0,0,0,2,0|1,0,0]=3 4431 B5R0.5 O=C(O)C(=O)O Amb19374136 [0,0,0,0,2,0|1,0,0]=3 4432 B5R0.5 O=C(O)C(=O)O Amb22231343 [0,0,0,0,2,0|1,0,0]=3 4433 B5R0.5 O=C(O)C(=O)O Amb22394874 [0,0,0,0,2,0|1,0,0]=3 4434 B5R0.5 O=C(O)C(=O)O Amb22436461 [0,0,0,0,2,0|1,0,0]=3 4435 B5R0.5 O=C(O)C(=O)O Amb7755827 [0,0,0,0,2,0|1,0,0]=3 4436 B5R0.5 O=C(O)C(=O)O Amb8513282 [0,0,0,0,2,0|1,0,0]=3 4437 B5R0.5 O=C([O-])C(=O)[O-] Amb17943075 [0,0,0,0,2,0|1,0,1]=4 4438 B5R0.5 O=C([O-])C(=O)[O-] Amb21963194 [0,0,0,0,2,0|1,0,1]=4 4439 B5R0.5 O=C([O-])C(=O)[O-] Amb22002099 [0,0,0,0,2,0|1,0,1]=4 4440 B5R0.5 O=C([O-])C(=O)[O-] Amb22045394 [0,0,0,0,2,0|1,0,1]=4 4441 B5R0.5 O=C([O-])C(=O)[O-] Amb22053543 [0,0,0,0,2,0|1,0,1]=4 4442 B5R0.5 O=C([O-])C(=O)[O-] Amb22053547 [0,0,0,0,2,0|1,0,1]=4 4443 B5R0.5 O=C([O-])C(=O)[O-] Amb8514326 [0,0,0,0,2,0|1,0,1]=4 4444 B5R0.5 O=C([O-])C(=O)[O-] Amb8514363 [0,0,0,0,2,0|1,0,1]=4 4445 B5R0.5 O=C([O-])C(=O)[O-] Amb8514364 [0,0,0,0,2,0|1,0,1]=4 4446 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [0,0,0,0,2,0|1,1,0]=4 4447 B9R0.55 C=C(C)CCNCC(N)=O Amb27615175 [0,0,0,0,0,2|2,0,0]=4 4448 B9R0.55 C=C(C)CCONC(C)=O Amb28072263 [0,0,0,0,0,2|2,0,0]=4 4449 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [0,0,0,0,0,2|2,0,0]=4 4450 B9R0.55 C=C(C)COCCC(=O)O Amb27882463 [0,0,0,0,0,2|2,0,0]=4 4451 B9R0.55 C=C(C)CONCC(=O)O Amb27969663 [0,0,0,0,0,2|1,0,0]=3 4452 B9R0.55 C=C(C)CONCC(N)=O Amb27969598 [0,0,0,0,0,2|2,0,0]=4 4453 B9R0.55 C=C(Cl)CNCCC(=O)O Amb9326413 [0,0,0,0,0,2|1,0,1]=4 4454 B9R0.55 CC(=O)C#CCOC(C)=O Amb27615142 [0,0,0,0,0,2|2,0,0]=4 4455 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [0,0,0,0,0,2|1,0,0]=3 4456 B9R0.55 CC(=O)CCCCC(C)=O Amb17593600 [0,0,0,0,0,2|2,0,0]=4 4457 B9R0.55 CC(=O)CCCNC(C)=O Amb28194645 [0,0,0,0,0,2|1,0,0]=3 4458 B9R0.55 CC(=O)CCCNS(C)=O Amb27774835 [0,0,0,0,0,2|2,0,0]=4 4459 B9R0.55 CC(=O)CCCOC(C)=O Amb1033031 [0,0,0,0,0,2|2,0,0]=4 4460 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,0,0,0,0,2|0,0,0]=2 4461 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,0,0,0,0,2|1,0,0]=3 4462 B9R0.55 CC(=O)CCSCC(=O)O Amb24443138 [0,0,0,0,0,2|1,0,0]=3 4463 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,0,0,0,0,2|1,0,0]=3 4464 B9R0.55 CC(=O)C\C=N\NC(N)=O Amb27618068 [0,0,0,0,0,2|2,0,0]=4 4465 B9R0.55 CC(=O)NCCCC(=N)N Amb27461138 [0,0,0,0,0,2|2,0,0]=4 4466 B9R0.55 CC(=O)NCCCC(=O)O Amb2778749 [0,0,0,0,0,2|0,0,0]=2 4467 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [0,0,0,0,0,2|1,0,1]=4 4468 B9R0.55 CC(=O)NCCCS(C)=O Amb27786571 [0,0,0,0,0,2|2,0,0]=4 4469 B9R0.55 CC(=O)NCCNC(=S)S Amb27441747 [0,0,0,0,0,2|0,2,0]=4 4470 B9R0.55 CC(=O)NCCNC(C)=O Amb2522644 [0,0,0,0,0,2|1,0,0]=3 4471 B9R0.55 CC(=O)NCCOC(C)=O Amb2781669 [0,0,0,0,0,2|1,0,0]=3 4472 B9R0.55 CC(=O)NCCSC(=N)N Amb27603878 [0,0,0,0,0,2|2,0,0]=4 4473 B9R0.55 CC(=O)NC\C=C\C(=O)O Amb27259093 [0,0,0,0,0,2|0,0,0]=2 4474 B9R0.55 CC(=O)NOCCC(=O)O Amb27252126 [0,0,0,0,0,2|0,0,0]=2 4475 B9R0.55 CC(=O)N\C=C/CC(N)=O Amb27214099 [0,0,0,0,0,2|1,0,0]=3 4476 B9R0.55 CC(=O)N\C=C/NC(C)=O Amb27424993 [0,0,0,0,0,2|1,0,1]=4 4477 B9R0.55 CC(=O)N\C=C\NC(C)=O Amb27468649 [0,0,0,0,0,2|1,0,1]=4 4478 B9R0.55 CC(=O)OCC#CC(=O)O Amb28411497 [0,0,0,0,0,2|1,0,0]=3 4479 B9R0.55 CC(=O)OCCCC(=O)O Amb24480808 [0,0,0,0,0,2|1,0,0]=3 4480 B9R0.55 CC(=O)OCCOC(C)=O Amb8513772 [0,0,0,0,0,2|2,0,0]=4 4481 B9R0.55 CC(=O)OCCOC(N)=O Amb27168669 [0,0,0,0,0,2|2,0,0]=4 4482 B9R0.55 CC(=O)OC\C=C\C(=O)O Amb24454652 [0,0,0,0,0,2|1,0,0]=3 4483 B9R0.55 CC(=O)SCCCC(=O)O Amb26356321 [0,0,0,0,0,2|1,0,0]=3 4484 B9R0.55 CC(=O)\C=C\C=C\C(=O)O Amb27205327 [0,0,0,0,0,2|1,0,1]=4 4485 B9R0.55 CC(C)=CCOCC(=O)O Amb18644115 [0,0,0,0,0,2|2,0,0]=4 4486 B9R0.55 CC(C)=C\C=C\CC(=O)O Amb27473342 [0,0,0,0,0,2|2,0,0]=4 4487 B9R0.55 CC(C)=NOCCC(=O)O Amb27596064 [0,0,0,0,0,2|1,0,1]=4 4488 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,0,0,0,0,2|1,0,1]=4 4489 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,0,0,0,0,2|1,0,1]=4 4490 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,0,0,0,0,2|1,0,1]=4 4491 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,0,0,0,0,2|1,0,1]=4 4492 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,0,0,0,0,2|1,0,1]=4 4493 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [0,0,0,0,0,2|1,0,1]=4 4494 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,0,0,0,0,2|2,0,0]=4 4495 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [0,0,0,0,0,2|2,0,0]=4 4496 B9R0.55 CS(=O)CCNCC(N)=O Amb28140353 [0,0,0,0,0,2|2,0,0]=4 4497 B9R0.55 CS(=O)CCSCC(=O)O Amb27236300 [0,0,0,0,0,2|2,0,0]=4 4498 B9R0.55 CS(=O)NC\C=C\C(=O)O Amb28195221 [0,0,0,0,0,2|1,0,0]=3 4499 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [0,0,0,0,0,2|2,0,0]=4 4500 B9R0.55 C\C(Cl)=C/CSCC(=O)O Amb27865640 [0,0,0,0,0,2|2,0,0]=4 4501 B9R0.55 N=C(N)NCCCC(=O)O Amb9813713 [0,0,0,0,0,2|2,0,0]=4 4502 B9R0.55 NC(=O)CCCCC(=O)O Amb9391119 [0,0,0,0,0,2|2,0,0]=4 4503 B9R0.55 NC(=O)CNOCC(N)=O Amb27194913 [0,0,0,0,0,2|2,0,0]=4 4504 B9R0.55 NC(=O)CONCC(=O)O Amb27215866 [0,0,0,0,0,2|1,0,0]=3 4505 B9R0.55 NC(=O)CSCCC(=O)O Amb6664956 [0,0,0,0,0,2|2,0,0]=4 4506 B9R0.55 NC(=O)NCCCC(=O)O Amb1104859 [0,0,0,0,0,2|1,0,0]=3 4507 B9R0.55 NC(=O)NCCNC(N)=O Amb1146040 [0,0,0,0,0,2|2,0,0]=4 4508 B9R0.55 NC(=O)NCNCC(=O)O Amb27446531 [0,0,0,0,0,2|1,0,0]=3 4509 B9R0.55 NC(=O)NC\C=C\C(=O)O Amb27817537 [0,0,0,0,0,2|1,0,0]=3 4510 B9R0.55 NC(=O)N\N=C\CC(=O)O Amb28366218 [0,0,0,0,0,2|1,0,0]=3 4511 B9R0.55 NC(=S)NCCCC(=O)O Amb27649643 [0,0,0,0,0,2|1,1,0]=4 4512 B9R0.55 O=C(O)C#CCCC(=O)O Amb28050167 [0,0,0,0,0,2|2,0,0]=4 4513 B9R0.55 O=C(O)CCCCC(=O)Cl Amb27614847 [0,0,0,0,0,2|2,0,0]=4 4514 B9R0.55 O=C(O)CCCCC(=O)O Amb22167453 [0,0,0,0,0,2|2,0,0]=4 4515 B9R0.55 O=C(O)CCCCC(=O)O Amb22336279 [0,0,0,0,0,2|2,0,0]=4 4516 B9R0.55 O=C(O)CCCCC(=O)O Amb2793031 [0,0,0,0,0,2|2,0,0]=4 4517 B9R0.55 O=C(O)CCNCC(=O)O Amb18098292 [0,0,0,0,0,2|1,0,0]=3 4518 B9R0.55 O=C(O)CNNCC(=O)O Amb23438062 [0,0,0,0,0,2|1,0,0]=3 4519 B9R0.55 O=C(O)CSSCC(=O)O Amb8395267 [0,0,0,0,0,2|2,0,0]=4 4520 B9R0.55 O=C(O)C\C=C\CC(=O)O Amb4037278 [0,0,0,0,0,2|2,0,0]=4 4521 B9R0.55 O=C(O)C\N=N/CC(=O)O Amb28188728 [0,0,0,0,0,2|1,0,1]=4 4522 B9R0.55 O=C(O)C\N=N\CC(=O)O Amb27882019 [0,0,0,0,0,2|1,0,1]=4 4523 B9R0.55 O=C(O)\C=C\CCC(=O)O Amb20622952 [0,0,0,0,0,2|2,0,0]=4 4524 B9R0.55 O=C(O)\C=C\SCC(=O)O Amb18645625 [0,0,0,0,0,2|2,0,0]=4