0 B8R0.9 BO\C(O)=C/CC(=O)O Amb27797365 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.9 C#CC(=C)CCC(C)=O Amb27179805 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.9 C#CC(=O)NCC(=O)O Amb6270091 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,0,0,0,0,0|2,0,2]=4 6 B8R0.9 C=C(Br)CNC(=O)CBr Amb23570568 [0,0,0,0,0,0|4,0,0]=4 7 B8R0.9 C=C(Br)CNC(=O)CC Amb27424062 [0,0,0,0,0,0|4,0,0]=4 8 B8R0.9 C=C(Br)CNC(=O)CN Amb23570566 [0,0,0,0,0,0|3,0,0]=3 9 B8R0.9 C=C(Br)CNC(=O)CS Amb27867130 [0,0,0,0,0,0|4,0,0]=4 10 B8R0.9 C=C(Br)COC(=O)CO Amb27837568 [0,0,0,0,0,0|4,0,0]=4 11 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,0,0,0,0,0|2,0,0]=2 12 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,0,0,0,0,0|3,0,1]=4 13 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,0,0,0,0,0|3,0,1]=4 14 B8R0.9 C=C(C)CNC(=O)CCl Amb25178055 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.9 C=C(C)CNC(=O)CN Amb27215165 [0,0,0,0,0,0|3,0,0]=3 16 B8R0.9 C=C(C)CNC(=O)CO Amb27866006 [0,0,0,0,0,0|4,0,0]=4 17 B8R0.9 C=C(C)CNC(=O)CS Amb28040754 [0,0,0,0,0,0|4,0,0]=4 18 B8R0.9 C=C(C)COC(=O)CC Amb25345772 [0,0,0,0,0,0|4,0,0]=4 19 B8R0.9 C=C(C)COC(=O)CO Amb28280952 [0,0,0,0,0,0|4,0,0]=4 20 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,0,0,0,0,0|2,0,1]=3 21 B8R0.9 C=C(CC)CNC(C)=O Amb27985317 [0,0,0,0,0,0|4,0,0]=4 22 B8R0.9 C=C(CC)CNC(N)=O Amb28342560 [0,0,0,0,0,0|4,0,0]=4 23 B8R0.9 C=C(CC)OCC(C)=O Amb27227543 [0,0,0,0,0,0|4,0,0]=4 24 B8R0.9 C=C(CN)CCN(C)C Amb33271981 [0,0,0,0,0,0|4,0,0]=4 25 B8R0.9 C=C(CS)SCC(C)=O Amb27844241 [0,0,0,0,0,0|4,0,0]=4 26 B8R0.9 C=C(Cl)CNC(=O)CO Amb27857427 [0,0,0,0,0,0|4,0,0]=4 27 B8R0.9 C=C(F)COC(=O)CCl Amb27945573 [0,0,0,0,0,0|4,0,0]=4 28 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,0,0,0,0,0|2,0,2]=4 29 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,0,0,0,0,0|2,0,1]=3 30 B8R0.9 C=CC(=O)COC(C)=O Amb17607380 [0,0,0,0,0,0|3,0,1]=4 31 B8R0.9 C=CC(=O)NCC(=O)O Amb33532656 [0,0,0,0,0,0|2,0,1]=3 32 B8R0.9 C=CC(=O)OCC(=O)O Amb27241348 [0,0,0,0,0,0|2,0,1]=3 33 B8R0.9 C=CC(=O)OCC(N)=O Amb27468552 [0,0,0,0,0,0|3,0,1]=4 34 B8R0.9 C=CC(=O)SCC(=O)O Amb27755823 [0,0,0,0,0,0|2,0,1]=3 35 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,0,0,0,0,0|2,0,2]=4 36 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,0,0,0,0,0|2,0,2]=4 37 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,0,0,0,0,0|1,0,3]=4 38 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,0,0,0,0,0|2,0,2]=4 39 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,0,0,0,0,0|2,0,2]=4 40 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,0,0,0,0,0|1,0,3]=4 41 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,0,0,0,0,0|2,0,2]=4 42 B8R0.9 CC(=N)SCC(=O)CCl Amb24113053 [0,0,0,0,0,0|4,0,0]=4 43 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,0,0,0,0,0|2,0,0]=2 44 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,0,0,0,0,0|3,0,0]=3 45 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,0,0,0,0,0|3,0,1]=4 46 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,0,0,0,0|3,0,1]=4 49 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,0,0,0,0,0|2,0,2]=4 50 B8R0.9 CC(=O)CNC(=O)CCl Amb27880921 [0,0,0,0,0,0|3,0,0]=3 51 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,0,0,0,0,0|2,0,0]=2 52 B8R0.9 CC(=O)COC(=O)CN Amb27168864 [0,0,0,0,0,0|2,0,0]=2 53 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,0,0,0,0,0|3,0,1]=4 54 B8R0.9 CC(=O)NCC(=O)CN Amb35789045 [0,0,0,0,0,0|2,0,0]=2 55 B8R0.9 CC(=O)NCC(=O)CN Amb35789904 [0,0,0,0,0,0|2,0,0]=2 56 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,0,0,0,0,0|3,0,0]=3 57 B8R0.9 CC(=O)NCC(=O)NN Amb24524168 [0,0,0,0,0,0|3,0,0]=3 58 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,0,0,0,0,0|4,0,0]=4 59 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,0,0,0,0,0|3,0,1]=4 60 B8R0.9 CC(=O)NNC(=N)CN Amb27971258 [0,0,0,0,0,0|4,0,0]=4 61 B8R0.9 CC(=O)NNC(=O)CBr Amb19957358 [0,0,0,0,0,0|4,0,0]=4 62 B8R0.9 CC(=O)NNC(=O)CCl Amb1154170 [0,0,0,0,0,0|4,0,0]=4 63 B8R0.9 CC(=O)NNC(=O)CN Amb17334122 [0,0,0,0,0,0|3,0,0]=3 64 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,0,0,0,0,0|3,0,0]=3 65 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,0,0,0,0,0|3,0,0]=3 66 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,0,0,0,0,0|3,0,0]=3 67 B8R0.9 CC(=O)OCC(=O)NN Amb27480937 [0,0,0,0,0,0|3,0,0]=3 68 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,0,0,0,0,0|1,0,3]=4 69 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,0,0,0,0,0|3,0,1]=4 70 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,0,0,0,0,0|2,0,1]=3 71 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,0,0,0,0,0|3,0,1]=4 72 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,0,0,0,0,0|3,0,1]=4 73 B8R0.9 CC(C)CNC(=O)CN Amb13951745 [0,0,0,0,0,0|3,0,1]=4 74 B8R0.9 CC(C)CNC(=O)CN Amb5783029 [0,0,0,0,0,0|3,0,1]=4 75 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,0,0,0,0,0|3,0,1]=4 76 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,0,0,0,0,0|3,0,1]=4 77 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,0,0,0,0,0|3,0,1]=4 78 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,0,0,0,0,0|3,0,1]=4 79 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,0,0,0,0,0|2,0,1]=3 80 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,0,0,0,0,0|1,0,1]=2 81 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,0,0,0,0,0|1,0,1]=2 82 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,0,0,0,0,0|3,0,1]=4 83 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,0,0,0,0,0|2,0,2]=4 84 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,0,0,0,0,0|3,0,1]=4 85 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,0,0,0,0,0|2,0,1]=3 86 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,0,0,0,0,0|2,0,1]=3 87 B8R0.9 CC(N)CCC(=O)NN Amb27945385 [0,0,0,0,0,0|3,0,1]=4 88 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,0,0,0,0,0|2,0,1]=3 89 B8R0.9 CC(O)CNC(=O)CCl Amb17324265 [0,0,0,0,0,0|3,0,1]=4 90 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,0,0,0,0,0|3,0,1]=4 91 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,0,0,0,0,0|1,0,3]=4 92 B8R0.9 CCC(=N)NCC(N)=O Amb28049684 [0,0,0,0,0,0|4,0,0]=4 93 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,0,0,0,0,0|3,0,0]=3 94 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,0,0,0,0|1,0,0]=1 95 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,0,0,0,0,0|2,0,0]=2 96 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,0,0,0,0,0|3,0,1]=4 97 B8R0.9 CCC(=O)CCC(C)N Amb27866596 [0,0,0,0,0,0|3,0,1]=4 98 B8R0.9 CCC(=O)COC(C)=O Amb3940673 [0,0,0,0,0,0|3,0,0]=3 99 B8R0.9 CCC(=O)CSC(C)=O Amb27180933 [0,0,0,0,0,0|3,0,0]=3 100 B8R0.9 CCC(=O)C\C=C(/C)Cl Amb27838754 [0,0,0,0,0,0|3,0,1]=4 101 B8R0.9 CCC(=O)NCB(O)O Amb8392098 [0,0,0,0,0,0|3,0,1]=4 102 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,0,0,0,0,0|2,0,0]=2 103 B8R0.9 CCC(=O)NCC(C)O Amb9275499 [0,0,0,0,0,0|3,0,1]=4 104 B8R0.9 CCC(=O)NCC(N)=O Amb17231864 [0,0,0,0,0,0|3,0,0]=3 105 B8R0.9 CCC(=O)NCC(N)=S Amb17232011 [0,0,0,0,0,0|3,1,0]=4 106 B8R0.9 CCC(=O)NNC(N)=O Amb27769108 [0,0,0,0,0,0|4,0,0]=4 107 B8R0.9 CCC(=O)OCC(C)=O Amb27662511 [0,0,0,0,0,0|3,0,0]=3 108 B8R0.9 CCC(=O)OCC(C)O Amb28184966 [0,0,0,0,0,0|3,0,1]=4 109 B8R0.9 CCC(=O)OCC(N)=O Amb26505774 [0,0,0,0,0,0|3,0,0]=3 110 B8R0.9 CCC(=O)OC[C@@H](C)O Amb28049124 [0,0,0,0,0,0|3,0,1]=4 111 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,0,0,0,0,0|1,0,2]=3 112 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,0,0,0,0,0|1,0,2]=3 113 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,0,0,0,0,0|2,0,1]=3 114 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,0,0,0,0,0|2,0,1]=3 115 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,0,0,0,0,0|3,0,1]=4 116 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,0,0,0,0,0|3,0,1]=4 117 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,0,0,0,0,0|3,0,1]=4 118 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,0,0,0,0,0|3,0,1]=4 119 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,0,0,0,0,0|3,0,1]=4 120 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,0,0,0,0,0|3,0,1]=4 121 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,0,0,0,0,0|2,0,1]=3 122 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,0,0,0,0,0|2,0,1]=3 123 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,0,0,0,0,0|2,0,1]=3 124 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,0,0,0,0,0|3,0,1]=4 125 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,0,0,0,0,0|1,0,2]=3 126 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,0,0,0,0,0|2,0,2]=4 127 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,0,0,0,0,0|1,1,1]=3 128 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,0,0,0,0,0|3,0,0]=3 129 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,0,0,0,0,0|3,0,0]=3 130 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,0,0,0,0,0|2,0,0]=2 131 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,0,0,0,0,0|3,0,0]=3 132 B8R0.9 CCS(=O)NCC(N)=O Amb27433455 [0,0,0,0,0,0|4,0,0]=4 133 B8R0.9 CCS(=O)\C=C\C(=O)O Amb28347741 [0,0,0,0,0,0|2,0,2]=4 134 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,0,0,0,0,0|2,0,1]=3 135 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,0,0,0,0,0|2,0,2]=4 136 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,0,0,0,0,0|3,0,1]=4 137 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,0,0,0,0,0|3,0,1]=4 138 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,0,0,0,0,0|1,0,2]=3 139 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,0,0,0,0,0|2,0,1]=3 140 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,0,0,0,0,0|2,0,2]=4 141 B8R0.9 CN(C)CCC(=O)CCl Amb33057681 [0,0,0,0,0,0|4,0,0]=4 142 B8R0.9 CN(C)CCC(=O)CN Amb18203194 [0,0,0,0,0,0|3,0,0]=3 143 B8R0.9 CN(C)CCC(=O)NN Amb396230 [0,0,0,0,0,0|4,0,0]=4 144 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,0,0,0,0,0|4,0,0]=4 145 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,0,0,0,0,0|2,0,0]=2 146 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,0,0,0,0,0|3,0,0]=3 147 B8R0.9 CNC(=O)CCC(C)O Amb17334125 [0,0,0,0,0,0|3,0,1]=4 148 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,0,0,0,0,0|3,0,0]=3 149 B8R0.9 CNC(=O)CC[C@H](C)O Amb27799232 [0,0,0,0,0,0|3,0,1]=4 150 B8R0.9 CNC(=O)CNC(C)=O Amb4034777 [0,0,0,0,0,0|4,0,0]=4 151 B8R0.9 CNC(=O)COC(C)=O Amb26872495 [0,0,0,0,0,0|4,0,0]=4 152 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,0,0,0,0,0|3,0,0]=3 153 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,0,0,0,0,0|3,0,0]=3 154 B8R0.9 CNC(=O)\C=C/C(=O)O Amb2720469 [0,0,0,0,0,0|2,0,2]=4 155 B8R0.9 CNC(=O)\C=C\C(=O)O Amb9277097 [0,0,0,0,0,0|2,0,2]=4 156 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,0,0,0,0,0|3,1,0]=4 157 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,0,0,0,0,0|3,0,1]=4 158 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,0,0,0,0,0|3,0,0]=3 159 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,0,0,0,0,0|2,0,0]=2 160 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,0,0,0,0,0|3,0,0]=3 161 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,0,0,0,0,0|3,0,1]=4 162 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,0,0,0,0,0|3,0,0]=3 163 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,0,0,0,0,0|3,1,0]=4 164 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [0,0,0,0,0,0|4,0,0]=4 165 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,0,0,0,0,0|3,0,0]=3 166 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [0,0,0,0,0,0|3,0,1]=4 167 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [0,0,0,0,0,0|4,0,0]=4 168 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [0,0,0,0,0,0|3,0,1]=4 169 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,0,0,0,0,0|4,0,0]=4 170 B8R0.9 COC(=O)CNC(N)=O Amb1126846 [0,0,0,0,0,0|4,0,0]=4 171 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,0,0,0,0,0|4,0,0]=4 172 B8R0.9 COC(=O)NCC(=O)Cl Amb28388481 [0,0,0,0,0,0|4,0,0]=4 173 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,0,0,0,0,0|3,0,0]=3 174 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,0,0,0,0,0|4,0,0]=4 175 B8R0.9 COC(=O)NCC(N)=O Amb27640170 [0,0,0,0,0,0|4,0,0]=4 176 B8R0.9 COC(=O)OCC(=O)Cl Amb8393900 [0,0,0,0,0,0|4,0,0]=4 177 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,0,0,0,0,0|3,0,0]=3 178 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [0,0,0,0,0,0|2,0,2]=4 179 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [0,0,0,0,0,0|2,0,2]=4 180 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,0,0,0,0,0|3,1,0]=4 181 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,0,0,0,0,0|3,0,1]=4 182 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,0,0,0,0,0|4,0,0]=4 183 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,0,0,0,0,0|3,0,1]=4 184 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,0,0,0,0,0|3,0,1]=4 185 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,0,0,0,0,0|3,0,1]=4 186 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,0,0,0,0,0|2,0,2]=4 187 B8R0.9 CSC(=O)CCC(C)O Amb28065144 [0,0,0,0,0,0|3,0,1]=4 188 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,0,0,0,0,0|3,0,1]=4 189 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,0,0,0,0,0|2,0,2]=4 190 B8R0.9 C[C@@H](O)CNC(=O)CBr Amb28049185 [0,0,0,0,0,0|3,0,1]=4 191 B8R0.9 C[C@@H](O)CNC(=O)CN Amb27495538 [0,0,0,0,0,0|2,0,1]=3 192 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,0,0,0,0,0|2,0,2]=4 193 B8R0.9 C[C@H](O)CNC(=O)CCl Amb28049186 [0,0,0,0,0,0|3,0,1]=4 194 B8R0.9 C[C@H](O)CNC(=O)CN Amb27399091 [0,0,0,0,0,0|2,0,1]=3 195 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,0,0,0,0,0|3,0,1]=4 196 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,0,0,0,0,0|1,0,3]=4 197 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,0,0,0,0,0|3,0,0]=3 198 B8R0.9 C\C(CN)=N/NC(N)=O Amb28388320 [0,0,0,0,0,0|4,0,0]=4 199 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,0,0,0,0,0|3,0,1]=4 200 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,0,0,0,0,0|1,0,3]=4 201 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,0,0,0,0,0|1,0,3]=4 202 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,0,0,0,0,0|3,0,0]=3 203 B8R0.9 N=C(CCl)NCC(N)=O Amb27483156 [0,0,0,0,0,0|4,0,0]=4 204 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,0,0,0,0,0|2,0,2]=4 205 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,0,0,0,0,0|3,0,1]=4 206 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,0,0,0,0,0|3,0,1]=4 207 B8R0.9 NC(=O)CNC(=O)C=O Amb27236949 [0,0,0,0,0,0|3,0,1]=4 208 B8R0.9 NC(=O)NNC(=O)CO Amb25328968 [0,0,0,0,0,0|4,0,0]=4 209 B8R0.9 NC(=O)NNC(=O)CS Amb27204540 [0,0,0,0,0,0|4,0,0]=4 210 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,0,0,0,0,0|2,0,1]=3 211 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,0,0,0,0,0|3,0,1]=4 212 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,0,0,0,0,0|2,0,1]=3 213 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,0,0,0,0,0|2,0,1]=3 214 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,0,0,0,0,0|2,0,1]=3 215 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,0,0,0,0,0|2,0,1]=3 216 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,0,0,0,0,0|2,0,1]=3 217 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,0,0,0,0,0|0,0,0]=0 218 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,0,0,0,0,0|0,0,0]=0 219 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,0,0,0,0,0|1,0,0]=1 220 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,0,0,0,0,0|1,0,0]=1 221 B8R0.9 NCC(=O)NCC(Cl)Cl Amb28253996 [0,0,0,0,0,0|3,0,1]=4 222 B8R0.9 NCC(=O)NCC(F)F Amb24184081 [0,0,0,0,0,0|3,0,1]=4 223 B8R0.9 NCC(=O)NCC(F)F Amb27477913 [0,0,0,0,0,0|3,0,1]=4 224 B8R0.9 NCC(=O)NNC(N)=O Amb28340955 [0,0,0,0,0,0|3,0,0]=3 225 B8R0.9 NCC(=O)OCC(N)=O Amb27829178 [0,0,0,0,0,0|2,0,0]=2 226 B8R0.9 NCC(=S)NCC(N)=S Amb27463228 [0,0,0,0,0,0|2,2,0]=4 227 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,0,0,0,0,0|1,0,1]=2 228 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,0,0,0,0,0|1,0,1]=2 229 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,0,0,0,0,0|0,0,2]=2 230 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,0,0,0,0,0|0,0,3]=3 231 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,0,0,0,0,0|2,0,2]=4 232 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,0,0,0,0,0|2,0,2]=4 233 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,0,0,0,0,0|0,0,2]=2 234 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,0,0,0,0,0|1,0,1]=2 235 B8R0.9 NNC(=O)CCC(N)=O Amb595603 [0,0,0,0,0,0|2,0,0]=2 236 B8R0.9 NNC(=O)CNC(N)=O Amb24477825 [0,0,0,0,0,0|3,0,0]=3 237 B8R0.9 NNC(=O)NCC(=O)O Amb27623574 [0,0,0,0,0,0|2,0,0]=2 238 B8R0.9 NNC(=O)NCC(N)=O Amb8854040 [0,0,0,0,0,0|3,0,0]=3 239 B8R0.9 NNC(=S)NCC(N)=O Amb7771588 [0,0,0,0,0,0|3,1,0]=4 240 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,0,0,0,0,0|2,0,1]=3 241 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,0,0,0,0,0|2,0,1]=3 242 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,0,0,0,0,0|2,0,1]=3 243 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,0,0,0,0,0|2,0,1]=3 244 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,0,0,0,0,0|1,0,0]=1 245 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,0,0,0,0,0|1,0,2]=3 246 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,0,0,0,0,0|1,1,1]=3 247 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,0,0,0,0,0|2,0,1]=3 248 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,0,0,0,0,0|2,0,0]=2 249 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,0,0,0,0,0|2,0,0]=2 250 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,0,0,0,0,0|2,0,0]=2 251 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,0,0,0,0,0|2,0,0]=2 252 B8R0.9 O=C(O)CS\C(Cl)=C\Cl Amb27858758 [0,0,0,0,0,0|3,0,1]=4 253 B8R0.9 O=C(O)\C=C\C(=O)NO Amb28060797 [0,0,0,0,0,0|2,0,2]=4 254 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,0,0,0,0,0|1,0,1]=2 255 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,0,0,0,0,0|3,0,1]=4 256 B7R0.3 C#CC(=C)CCC=O Amb27830103 [1,0,0,0,0,0|2,0,1]=4 257 B7R0.3 C#CC(=O)CCCO Amb27593195 [1,0,0,0,0,0|1,0,2]=4 258 B7R0.3 C#CCCC(=O)NN Amb18636071 [1,0,0,0,0,0|2,0,1]=4 259 B7R0.3 C#CCNC(=O)CN Amb13951829 [1,0,0,0,0,0|2,0,1]=4 260 B7R0.3 C#CCNC(=O)CN Amb6269640 [1,0,0,0,0,0|2,0,1]=4 261 B7R0.3 C#CCOC(=O)CN Amb25870900 [1,0,0,0,0,0|2,0,1]=4 262 B7R0.3 C#CCOC(=O)CN Amb33620294 [1,0,0,0,0,0|2,0,1]=4 263 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,0,0,0,0,0|2,0,0]=3 264 B7R0.3 C=C(CC)CCCO Amb26032857 [1,0,0,0,0,0|2,0,1]=4 265 B7R0.3 C=C(CN)CCCC Amb27630595 [1,0,0,0,0,0|2,0,1]=4 266 B7R0.3 C=C(CN)CCOC Amb33377483 [1,0,0,0,0,0|3,0,0]=4 267 B7R0.3 C=C(CN)CCSC Amb33198280 [1,0,0,0,0,0|3,0,0]=4 268 B7R0.3 C=CCCC(=O)C#N Amb27749803 [1,0,0,0,0,0|1,0,2]=4 269 B7R0.3 C=CCCC(=O)CBr Amb22059627 [1,0,0,0,0,0|2,0,0]=3 270 B7R0.3 C=CCCC(=O)CC Amb9031676 [1,0,0,0,0,0|2,0,0]=3 271 B7R0.3 C=CCCC(=O)CCl Amb22059504 [1,0,0,0,0,0|2,0,0]=3 272 B7R0.3 C=CCCC(=O)CF Amb28074643 [1,0,0,0,0,0|2,0,0]=3 273 B7R0.3 C=CCCC(=O)NC Amb25041195 [1,0,0,0,0,0|3,0,0]=4 274 B7R0.3 C=CCCC(=O)NN Amb27775332 [1,0,0,0,0,0|2,0,0]=3 275 B7R0.3 C=CCCC(=O)NN Amb27831946 [1,0,0,0,0,0|2,0,0]=3 276 B7R0.3 C=CCCC(=O)NO Amb28205003 [1,0,0,0,0,0|3,0,0]=4 277 B7R0.3 C=CCCC(=O)OC Amb2369959 [1,0,0,0,0,0|3,0,0]=4 278 B7R0.3 C=CCCC(C)CN Amb25189032 [1,0,0,0,0,0|2,0,1]=4 279 B7R0.3 C=CCCC(C)CN Amb33611653 [1,0,0,0,0,0|2,0,1]=4 280 B7R0.3 C=CCCC(N)CN Amb20667712 [1,0,0,0,0,0|2,0,1]=4 281 B7R0.3 C=CCCC(N)CN Amb27267278 [1,0,0,0,0,0|2,0,1]=4 282 B7R0.3 C=CCCC(O)CN Amb8630191 [1,0,0,0,0,0|1,0,2]=4 283 B7R0.3 C=CCC\C(C)=N/N Amb27595313 [1,0,0,0,0,0|3,0,0]=4 284 B7R0.3 C=CCNC(=O)CBr Amb2089072 [1,0,0,0,0,0|3,0,0]=4 285 B7R0.3 C=CCNC(=O)CCl Amb1151297 [1,0,0,0,0,0|3,0,0]=4 286 B7R0.3 C=CCNC(=O)CI Amb26023441 [1,0,0,0,0,0|3,0,0]=4 287 B7R0.3 C=CCNC(=O)CN Amb21958702 [1,0,0,0,0,0|2,0,0]=3 288 B7R0.3 C=CCNC(=O)CN Amb5783027 [1,0,0,0,0,0|2,0,0]=3 289 B7R0.3 C=CCNC(=O)CO Amb33531863 [1,0,0,0,0,0|3,0,0]=4 290 B7R0.3 C=CCNC(=O)NN Amb18559722 [1,0,0,0,0,0|3,0,0]=4 291 B7R0.3 C=CCOC(=O)CC Amb22050537 [1,0,0,0,0,0|3,0,0]=4 292 B7R0.3 C=CCOC(=O)CCl Amb8515844 [1,0,0,0,0,0|3,0,0]=4 293 B7R0.3 C=CCOC(=O)CI Amb26593247 [1,0,0,0,0,0|3,0,0]=4 294 B7R0.3 C=CCOC(=O)CN Amb18641828 [1,0,0,0,0,0|2,0,0]=3 295 B7R0.3 C=CCOC(=O)CN Amb33734248 [1,0,0,0,0,0|2,0,0]=3 296 B7R0.3 C=CCOC(=O)CS Amb27815024 [1,0,0,0,0,0|3,0,0]=4 297 B7R0.3 C=CCSC(=O)CC Amb22043318 [1,0,0,0,0,0|3,0,0]=4 298 B7R0.3 C=CC\C=C(\C)CN Amb28369166 [1,0,0,0,0,0|2,0,1]=4 299 B7R0.3 CC(CN)CCC=N Amb27640087 [1,0,0,0,0,0|2,0,1]=4 300 B7R0.3 CC(CN)CCCO Amb17569906 [1,0,0,0,0,0|1,0,2]=4 301 B7R0.3 CC(CN)CCCO Amb28934846 [1,0,0,0,0,0|1,0,2]=4 302 B7R0.3 CCC(=O)CCC#N Amb25321503 [1,0,0,0,0,0|2,0,1]=4 303 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,0,0,0,0,0|2,0,1]=4 304 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,0,0,0,0,0|2,0,1]=4 305 B7R0.3 CCC(=O)CCCN Amb18833012 [1,0,0,0,0,0|2,0,1]=4 306 B7R0.3 CCC(=O)CCNC Amb27963044 [1,0,0,0,0,0|3,0,0]=4 307 B7R0.3 CCC(=O)CCSC Amb25680024 [1,0,0,0,0,0|3,0,0]=4 308 B7R0.3 CCC(=O)C\C=C\Cl Amb28349318 [1,0,0,0,0,0|2,0,1]=4 309 B7R0.3 CCC(=O)NCC=O Amb17102054 [1,0,0,0,0,0|2,0,0]=3 310 B7R0.3 CCC(=O)NCCO Amb5797470 [1,0,0,0,0,0|2,0,1]=4 311 B7R0.3 CCC(=O)NNC=O Amb27835377 [1,0,0,0,0,0|3,0,0]=4 312 B7R0.3 CCC(=O)OCCO Amb27217859 [1,0,0,0,0,0|2,0,1]=4 313 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [1,0,0,0,0,0|1,0,2]=4 314 B7R0.3 CCC(Cl)CCC=O Amb27637733 [1,0,0,0,0,0|2,0,1]=4 315 B7R0.3 CCC(N)CCC=O Amb33036216 [1,0,0,0,0,0|2,0,1]=4 316 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,0,0,0,0,0|2,0,1]=4 317 B7R0.3 CCCCC(=O)CC Amb4605999 [1,0,0,0,0,0|2,0,1]=4 318 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,0,0,0,0,0|2,0,1]=4 319 B7R0.3 CCCCC(=O)CN Amb24473062 [1,0,0,0,0,0|1,0,1]=3 320 B7R0.3 CCCCC(=O)CO Amb26073501 [1,0,0,0,0,0|2,0,1]=4 321 B7R0.3 CCCCC(=O)NN Amb534136 [1,0,0,0,0,0|2,0,1]=4 322 B7R0.3 CCCNC(=O)CN Amb10781813 [1,0,0,0,0,0|2,0,1]=4 323 B7R0.3 CCCNC(=O)CN Amb426858 [1,0,0,0,0,0|2,0,1]=4 324 B7R0.3 CCCOC(=O)CN Amb9826861 [1,0,0,0,0,0|2,0,1]=4 325 B7R0.3 CCOCC(=O)CN Amb27453616 [1,0,0,0,0,0|2,0,1]=4 326 B7R0.3 CCSCC(=O)CN Amb33324079 [1,0,0,0,0,0|2,0,1]=4 327 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,0,0,0,0,0|2,0,1]=4 328 B7R0.3 CNC(=O)CCCO Amb17231829 [1,0,0,0,0,0|2,0,1]=4 329 B7R0.3 CNCCC(=O)NN Amb28143068 [1,0,0,0,0,0|3,0,0]=4 330 B7R0.3 COC(=O)CCC=O Amb18124259 [1,0,0,0,0,0|2,0,0]=3 331 B7R0.3 COC(=O)CNC=O Amb22000868 [1,0,0,0,0,0|3,0,0]=4 332 B7R0.3 COC(=O)NCC=O Amb27839038 [1,0,0,0,0,0|3,0,0]=4 333 B7R0.3 COC(=O)OCC=O Amb28208420 [1,0,0,0,0,0|3,0,0]=4 334 B7R0.3 COCCC(=O)CCl Amb20622320 [1,0,0,0,0,0|3,0,0]=4 335 B7R0.3 COCCC(=O)CN Amb26515688 [1,0,0,0,0,0|2,0,0]=3 336 B7R0.3 COCCC(=O)NN Amb2689273 [1,0,0,0,0,0|3,0,0]=4 337 B7R0.3 CSCCC(=O)CCl Amb25910902 [1,0,0,0,0,0|3,0,0]=4 338 B7R0.3 CSCCC(=O)CF Amb28316167 [1,0,0,0,0,0|3,0,0]=4 339 B7R0.3 CSCCC(=O)CN Amb33199125 [1,0,0,0,0,0|2,0,0]=3 340 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,0,0,0,0,0|1,0,2]=4 341 B7R0.3 N#CCCC(=O)CN Amb27240440 [1,0,0,0,0,0|1,0,1]=3 342 B7R0.3 N#CCNC(=O)CN Amb32652935 [1,0,0,0,0,0|2,0,1]=4 343 B7R0.3 N#CCNC(=O)CN Amb6274014 [1,0,0,0,0,0|2,0,1]=4 344 B7R0.3 NCC(=O)NCCF Amb27659897 [1,0,0,0,0,0|2,0,1]=4 345 B7R0.3 NCC(=O)NCCF Amb33473629 [1,0,0,0,0,0|2,0,1]=4 346 B7R0.3 NCC(=O)NCCO Amb9023087 [1,0,0,0,0,0|1,0,1]=3 347 B7R0.3 NCC(=O)OCCCl Amb4244115 [1,0,0,0,0,0|2,0,1]=4 348 B7R0.3 NCC(=O)OCCF Amb27964557 [1,0,0,0,0,0|2,0,1]=4 349 B7R0.3 NCC(O)CCC=O Amb27855481 [1,0,0,0,0,0|0,0,2]=3 350 B7R0.3 NCCCC(=O)NN Amb18061734 [1,0,0,0,0,0|2,0,1]=4 351 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,0,0,0,0,0|0,0,3]=4 352 B7R0.3 NC\C(F)=C\CCO Amb28411180 [1,0,0,0,0,0|1,0,2]=4 353 B7R0.3 NNC(=O)CCCCl Amb9818914 [1,0,0,0,0,0|2,0,1]=4 354 B7R0.3 NNC(=O)CCCO Amb535400 [1,0,0,0,0,0|1,0,1]=3 355 B7R0.3 NNC(=O)CCNO Amb25128022 [1,0,0,0,0,0|2,0,0]=3 356 B7R0.3 NNC(=O)CNC=O Amb28364902 [1,0,0,0,0,0|2,0,0]=3 357 B7R0.3 NNC(=O)OCCO Amb4020372 [1,0,0,0,0,0|2,0,1]=4 358 B7R0.3 O=C(CBr)CCCBr Amb27153779 [1,0,0,0,0,0|2,0,1]=4 359 B7R0.3 O=C(CBr)CCCCl Amb27875989 [1,0,0,0,0,0|2,0,1]=4 360 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,0,0,0,0,0|2,0,1]=4 361 B7R0.3 O=C(CCl)CCCCl Amb22395285 [1,0,0,0,0,0|2,0,1]=4 362 B7R0.3 O=C(CCl)NCCO Amb5716292 [1,0,0,0,0,0|2,0,1]=4 363 B7R0.3 O=C(CO)CCCO Amb27227084 [1,0,0,0,0,0|1,0,1]=3 364 B7R0.3 O=C(CO)NCCO Amb5798091 [1,0,0,0,0,0|2,0,1]=4 365 B7R0.3 O=C(CS)OCCO Amb26476359 [1,0,0,0,0,0|2,0,1]=4 366 B7R0.3 O=CC(=O)CCCO Amb27751348 [1,0,0,0,0,0|1,0,2]=4 367 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,0,0,0,0,0|1,0,0]=2 368 B7R0.3 O=CCC\C(Cl)=N\O Amb27751320 [1,0,0,0,0,0|3,0,0]=4 369 B7R0.3 O=C\C=C\C(=O)CO Amb24574003 [1,0,0,0,0,0|1,0,2]=4 370 B7R0.4 C#CCCCC(=O)O Amb2721705 [1,0,0,0,0,0|1,0,2]=4 371 B7R0.4 C=C=CCCC(C)=O Amb28315801 [1,0,0,0,0,0|2,0,1]=4 372 B7R0.4 C=C=CSCC(=O)O Amb27812092 [1,0,0,0,0,0|2,0,1]=4 373 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,0,0,0,0,0|1,0,2]=4 374 B7R0.4 C=CNCCC(=O)O Amb27429817 [1,0,0,0,0,0|2,0,1]=4 375 B7R0.4 C=COCCC(=O)O Amb28350126 [1,0,0,0,0,0|2,0,1]=4 376 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [1,0,0,0,0,0|1,0,2]=4 377 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,0,0,0,0,0|1,0,2]=4 378 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,0,0,0,0,0|2,0,1]=4 379 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,0,0,0,0,0|2,0,1]=4 380 B7R0.4 CC(=O)CCCCF Amb27490855 [1,0,0,0,0,0|2,0,1]=4 381 B7R0.4 CC(=O)CCCCN Amb27401218 [1,0,0,0,0,0|1,0,1]=3 382 B7R0.4 CC(=O)CCCCO Amb10603864 [1,0,0,0,0,0|2,0,1]=4 383 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [1,0,0,0,0,0|3,0,0]=4 384 B7R0.4 CC(=O)CSCCN Amb17500454 [1,0,0,0,0,0|2,0,1]=4 385 B7R0.4 CC(=O)NCCCN Amb10610286 [1,0,0,0,0,0|2,0,1]=4 386 B7R0.4 CC(=O)NCCCN Amb6664982 [1,0,0,0,0,0|2,0,1]=4 387 B7R0.4 CC(O)CCCCN Amb17569903 [1,0,0,0,0,0|1,0,2]=4 388 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,0,0,0,0,0|1,0,2]=4 389 B7R0.4 CCCCCC(=O)F Amb26061517 [1,0,0,0,0,0|2,0,1]=4 390 B7R0.4 CCCCCC(=O)O Amb3939846 [1,0,0,0,0,0|1,0,1]=3 391 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,0,0,0,0,0|1,0,2]=4 392 B7R0.4 CCCCCC(C)=O Amb6608885 [1,0,0,0,0,0|2,0,1]=4 393 B7R0.4 CCCNCC(=O)O Amb10609640 [1,0,0,0,0,0|2,0,1]=4 394 B7R0.4 CCCNCC(=O)O Amb1110628 [1,0,0,0,0,0|2,0,1]=4 395 B7R0.4 CCCOCC(=O)O Amb8874504 [1,0,0,0,0,0|2,0,1]=4 396 B7R0.4 CCCSCC(=O)O Amb1137113 [1,0,0,0,0,0|2,0,1]=4 397 B7R0.4 CCNCCC(=O)O Amb28934794 [1,0,0,0,0,0|2,0,0]=3 398 B7R0.4 CCNCCC(=O)O Amb7766402 [1,0,0,0,0,0|2,0,0]=3 399 B7R0.4 CCNCCC(C)=O Amb18641851 [1,0,0,0,0,0|3,0,0]=4 400 B7R0.4 CCNCCC(N)=O Amb33533384 [1,0,0,0,0,0|3,0,0]=4 401 B7R0.4 CCNCCC(N)=O Amb35749820 [1,0,0,0,0,0|3,0,0]=4 402 B7R0.4 CCNNCC(=O)O Amb28326075 [1,0,0,0,0,0|3,0,0]=4 403 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,0,0,0,0,0|3,0,0]=4 404 B7R0.4 CCOCCC(=O)O Amb3939859 [1,0,0,0,0,0|2,0,0]=3 405 B7R0.4 CCOCCC(C)=O Amb7764636 [1,0,0,0,0,0|3,0,0]=4 406 B7R0.4 CCSCCC(=O)O Amb6273140 [1,0,0,0,0,0|2,0,0]=3 407 B7R0.4 CCSCCC(C)=O Amb9655821 [1,0,0,0,0,0|3,0,0]=4 408 B7R0.4 CCSCCC(N)=O Amb27258252 [1,0,0,0,0,0|3,0,0]=4 409 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,0,0,0,0,0|1,0,1]=3 410 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,0,0,0,0,0|2,0,1]=4 411 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,0,0,0,0,0|2,0,1]=4 412 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,0,0,0,0,0|1,0,1]=3 413 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,0,0,0,0,0|2,0,1]=4 414 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,0,0,0,0,0|2,0,1]=4 415 B7R0.4 CNCCCC(=O)O Amb1153115 [1,0,0,0,0,0|2,0,1]=4 416 B7R0.4 CNCCCC(=O)O Amb4521435 [1,0,0,0,0,0|2,0,1]=4 417 B7R0.4 COCCCC(=O)O Amb6275629 [1,0,0,0,0,0|2,0,1]=4 418 B7R0.4 CS(=O)CCCCN Amb17617794 [1,0,0,0,0,0|2,0,1]=4 419 B7R0.4 CSCCCC(=O)O Amb17503622 [1,0,0,0,0,0|2,0,1]=4 420 B7R0.4 CSSCCC(=O)O Amb26848465 [1,0,0,0,0,0|3,0,0]=4 421 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,0,0,0,0,0|2,0,1]=4 422 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,0,0,0,0,0|1,0,2]=4 423 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,0,0,0,0,0|1,0,1]=3 424 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,0,0,0,0,0|2,0,1]=4 425 B7R0.4 N#CCCCC(=O)O Amb33542831 [1,0,0,0,0,0|0,0,3]=4 426 B7R0.4 N#CNCCC(=O)O Amb30031691 [1,0,0,0,0,0|1,0,2]=4 427 B7R0.4 N=C(N)CCCCN Amb25714813 [1,0,0,0,0,0|2,0,1]=4 428 B7R0.4 N=C(N)CCCCN Amb33299438 [1,0,0,0,0,0|2,0,1]=4 429 B7R0.4 NC(=O)CCCCBr Amb27875083 [1,0,0,0,0,0|2,0,1]=4 430 B7R0.4 NC(=O)CCCCCl Amb7782532 [1,0,0,0,0,0|2,0,1]=4 431 B7R0.4 NC(=O)CCCCO Amb3939470 [1,0,0,0,0,0|2,0,1]=4 432 B7R0.4 NC(=O)CCCCS Amb27839239 [1,0,0,0,0,0|2,0,1]=4 433 B7R0.4 NC(=O)CCSCCl Amb27430706 [1,0,0,0,0,0|3,0,0]=4 434 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [1,0,0,0,0,0|2,0,1]=4 435 B7R0.4 NCC#CCC(=O)O Amb27976019 [1,0,0,0,0,0|0,0,2]=3 436 B7R0.4 NCCC#CC(=O)O Amb32656225 [1,0,0,0,0,0|0,0,3]=4 437 B7R0.4 NCCCCB(O)O Amb27436221 [1,0,0,0,0,0|1,0,2]=4 438 B7R0.4 NCCCCC(=O)Cl Amb26599615 [1,0,0,0,0,0|1,0,1]=3 439 B7R0.4 NCCCCC(=O)O Amb2780021 [1,0,0,0,0,0|0,0,1]=2 440 B7R0.4 NCCCCC(=O)O Amb3941646 [1,0,0,0,0,0|0,0,1]=2 441 B7R0.4 NCCCCC(=O)O Amb9825855 [1,0,0,0,0,0|0,0,1]=2 442 B7R0.4 NCCCCC(N)=O Amb18641897 [1,0,0,0,0,0|1,0,1]=3 443 B7R0.4 NCCCCC(N)=O Amb33552086 [1,0,0,0,0,0|1,0,1]=3 444 B7R0.4 NCCCCS(=O)O Amb27882127 [1,0,0,0,0,0|1,0,1]=3 445 B7R0.4 NCCCNC(=O)O Amb24093884 [1,0,0,0,0,0|1,0,1]=3 446 B7R0.4 NCCCNC(=O)S Amb27839485 [1,0,0,0,0,0|1,1,1]=4 447 B7R0.4 NCCCNC(N)=O Amb18296186 [1,0,0,0,0,0|2,0,1]=4 448 B7R0.4 NCCCNC(N)=O Amb20622408 [1,0,0,0,0,0|2,0,1]=4 449 B7R0.4 NCCCOC(N)=O Amb26334419 [1,0,0,0,0,0|2,0,1]=4 450 B7R0.4 NCCCOC(N)=O Amb33299259 [1,0,0,0,0,0|2,0,1]=4 451 B7R0.4 NCCCOS(=O)O Amb26007874 [1,0,0,0,0,0|2,0,1]=4 452 B7R0.4 NCCNCC(=O)O Amb17608063 [1,0,0,0,0,0|1,0,1]=3 453 B7R0.4 NCCNCC(=O)O Amb33339058 [1,0,0,0,0,0|1,0,1]=3 454 B7R0.4 NCCNCC(N)=O Amb28388338 [1,0,0,0,0,0|2,0,1]=4 455 B7R0.4 NCCOCC(=O)O Amb18630146 [1,0,0,0,0,0|1,0,1]=3 456 B7R0.4 NCCOCC(=O)O Amb33550947 [1,0,0,0,0,0|1,0,1]=3 457 B7R0.4 NCCOCC(N)=O Amb18523830 [1,0,0,0,0,0|2,0,1]=4 458 B7R0.4 NCCOCC(N)=O Amb33549549 [1,0,0,0,0,0|2,0,1]=4 459 B7R0.4 NCCSCC(=O)O Amb17500446 [1,0,0,0,0,0|1,0,1]=3 460 B7R0.4 NCCSCC(=O)O Amb20622325 [1,0,0,0,0,0|1,0,1]=3 461 B7R0.4 NCCSCC(N)=O Amb6266329 [1,0,0,0,0,0|2,0,1]=4 462 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [1,0,0,0,0,0|0,0,3]=4 463 B7R0.4 NOCCCC(=O)O Amb10975956 [1,0,0,0,0,0|1,0,1]=3 464 B7R0.4 NOCCCC(=O)O Amb22011795 [1,0,0,0,0,0|1,0,1]=3 465 B7R0.4 NOCCCC(=O)O Amb31283653 [1,0,0,0,0,0|1,0,1]=3 466 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [1,0,0,0,0,0|2,0,1]=4 467 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [1,0,0,0,0,0|2,0,1]=4 468 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,0,0,0,0,0|1,0,1]=3 469 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,0,0,0,0,0|1,0,1]=3 470 B7R0.4 O=C(O)CCCCF Amb26639920 [1,0,0,0,0,0|1,0,1]=3 471 B7R0.4 O=C(O)CCCCO Amb9214971 [1,0,0,0,0,0|1,0,1]=3 472 B7R0.4 O=C(O)CCCCS Amb17503767 [1,0,0,0,0,0|1,0,1]=3 473 B7R0.4 O=C(O)CCCNCl Amb27173950 [1,0,0,0,0,0|2,0,1]=4 474 B7R0.4 O=C(O)CCN=C=S Amb24562253 [1,0,0,0,0,0|2,0,1]=4 475 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,0,0,0,0,0|1,0,1]=3 476 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [1,0,0,0,0,0|2,0,0]=3 477 B7R0.4 O=C(O)CNCCF Amb28076282 [1,0,0,0,0,0|2,0,1]=4 478 B7R0.4 O=C(O)CNCCO Amb9325653 [1,0,0,0,0,0|2,0,1]=4 479 B7R0.4 O=C(O)COCCCl Amb21857870 [1,0,0,0,0,0|2,0,1]=4 480 B7R0.4 O=C(O)COCCF Amb27866609 [1,0,0,0,0,0|2,0,1]=4 481 B7R0.4 O=C(O)COCCO Amb6680914 [1,0,0,0,0,0|2,0,1]=4 482 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,0,0,0,0,0|2,0,1]=4 483 B7R0.4 O=C(O)CSSCCl Amb27983630 [1,0,0,0,0,0|3,0,0]=4 484 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,0,0,0,0,0|1,0,1]=3 485 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,0,0,0,0,0|1,0,1]=3 486 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,0,0,0,0,0|1,0,1]=3 487 B7R0.4 O=C([O-])CCCCF Amb33527827 [1,0,0,0,0,0|1,0,2]=4 488 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,0,0,0,0,0|1,0,2]=4 489 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,0,0,0,0,0|1,0,2]=4 490 B7R0.4 O=C=NCCC(=O)O Amb26053417 [1,0,0,0,0,0|2,0,1]=4 491 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,0,0,0,0,0|1,0,2]=4 492 B7R0.4 O=CNCCC(=O)O Amb18290434 [1,0,0,0,0,0|2,0,1]=4 493 B7R0.4 O=NSCCC(=O)O Amb28429846 [1,0,0,0,0,0|3,0,0]=4 494 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [1,0,0,0,0,0|1,0,1]=3 496 B7R0.6 C=C(Br)CNC(N)=O Amb27956072 [1,0,0,0,0,0|3,0,0]=4 497 B7R0.6 C=C(C)CCB(O)O Amb28316164 [1,0,0,0,0,0|2,0,1]=4 498 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [1,0,0,0,0,0|1,0,0]=2 499 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [1,0,0,0,0,0|2,0,0]=3 500 B7R0.6 C=C(C)CCC(C)O Amb24062974 [1,0,0,0,0,0|2,0,1]=4 501 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [1,0,0,0,0,0|2,0,0]=3 502 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [1,0,0,0,0,0|2,0,1]=4 503 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [1,0,0,0,0,0|2,0,1]=4 504 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [1,0,0,0,0,0|2,0,1]=4 505 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [1,0,0,0,0,0|3,0,0]=4 506 B7R0.6 C=C(C)CNC(O)=S Amb28240718 [1,0,0,0,0,0|2,1,0]=4 507 B7R0.6 C=C(C)COC(C)=O Amb16187121 [1,0,0,0,0,0|3,0,0]=4 508 B7R0.6 C=C(C)COC(N)=O Amb4017509 [1,0,0,0,0,0|3,0,0]=4 509 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [1,0,0,0,0,0|2,0,0]=3 510 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [1,0,0,0,0,0|3,0,0]=4 511 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [1,0,0,0,0,0|1,0,2]=4 512 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [1,0,0,0,0,0|1,0,1]=3 513 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [1,0,0,0,0,0|2,0,0]=3 514 B7R0.6 C=C(Cl)COC(C)=O Amb24744447 [1,0,0,0,0,0|3,0,0]=4 515 B7R0.6 C=C(Cl)CSC(C)=O Amb21960981 [1,0,0,0,0,0|3,0,0]=4 516 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [1,0,0,0,0,0|1,0,0]=2 517 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [1,0,0,0,0,0|3,0,0]=4 518 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [1,0,0,0,0,0|2,0,1]=4 519 B7R0.6 CC(=O)CCB(O)O Amb25095502 [1,0,0,0,0,0|1,0,1]=3 520 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,0,0,0,0,0|0,0,0]=1 521 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [1,0,0,0,0,0|1,1,0]=3 522 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [1,0,0,0,0,0|1,0,0]=2 523 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [1,0,0,0,0,0|1,1,0]=3 524 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [1,0,0,0,0,0|2,0,1]=4 525 B7R0.6 CC(=O)CCC(C)C Amb4605991 [1,0,0,0,0,0|2,0,1]=4 526 B7R0.6 CC(=O)CCC(C)O Amb25829594 [1,0,0,0,0,0|1,0,1]=3 527 B7R0.6 CC(=O)CCC(F)F Amb27413848 [1,0,0,0,0,0|2,0,1]=4 528 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [1,0,0,0,0,0|1,0,0]=2 529 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [1,0,0,0,0,0|0,1,0]=2 530 B7R0.6 CC(=O)CCN(C)C Amb1129203 [1,0,0,0,0,0|3,0,0]=4 531 B7R0.6 CC(=O)CCN(C)C Amb343601 [1,0,0,0,0,0|3,0,0]=4 532 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [1,0,0,0,0,0|1,0,1]=3 533 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [1,0,0,0,0,0|1,0,1]=3 534 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [1,0,0,0,0,0|2,0,0]=3 535 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [1,0,0,0,0,0|3,0,0]=4 536 B7R0.6 CC(=O)COC(C)=O Amb8517567 [1,0,0,0,0,0|2,0,0]=3 537 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [1,0,0,0,0,0|2,0,1]=4 538 B7R0.6 CC(=O)NCB(O)O Amb8392097 [1,0,0,0,0,0|2,0,1]=4 539 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,0,0|1,0,0]=2 540 B7R0.6 CC(=O)NCC(C)O Amb9276316 [1,0,0,0,0,0|2,0,1]=4 541 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [1,0,0,0,0,0|2,0,0]=3 542 B7R0.6 CC(=O)NCC(N)=S Amb17231879 [1,0,0,0,0,0|2,1,0]=4 543 B7R0.6 CC(=O)NNC(C)=O Amb8516143 [1,0,0,0,0,0|3,0,0]=4 544 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [1,0,0,0,0,0|2,0,0]=3 545 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,0,0|1,0,0]=2 546 B7R0.6 CC(=O)OCC(C)O Amb24056158 [1,0,0,0,0,0|2,0,1]=4 547 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [1,0,0,0,0,0|2,0,0]=3 548 B7R0.6 CC(=O)OCC(N)=S Amb9677330 [1,0,0,0,0,0|2,1,0]=4 549 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [1,0,0,0,0,0|2,0,1]=4 550 B7R0.6 CC(=O)ONC(N)=O Amb28456585 [1,0,0,0,0,0|3,0,0]=4 551 B7R0.6 CC(=O)SCB(O)O Amb27456620 [1,0,0,0,0,0|2,0,1]=4 552 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [1,0,0,0,0,0|2,0,0]=3 553 B7R0.6 CC(=O)SCC(C)O Amb27801534 [1,0,0,0,0,0|2,0,1]=4 554 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [1,0,0,0,0,0|2,0,0]=3 555 B7R0.6 CC(=O)SSC(C)=O Amb24099405 [1,0,0,0,0,0|3,0,0]=4 556 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [1,0,0,0,0,0|0,0,2]=3 557 B7R0.6 CC(=O)\C=C\C(C)=O Amb22346013 [1,0,0,0,0,0|1,0,2]=4 558 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [1,0,0,0,0,0|1,0,2]=4 559 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [1,0,0,0,0,0|1,0,1]=3 560 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [1,0,0,0,0,0|1,1,0]=3 561 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [1,0,0,0,0,0|1,1,0]=3 562 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,0,0,0,0,0|1,0,1]=3 563 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [1,0,0,0,0,0|1,0,1]=3 564 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [1,0,0,0,0,0|1,0,2]=4 565 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [1,0,0,0,0,0|3,0,0]=4 566 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [1,0,0,0,0,0|2,0,1]=4 567 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,0,0,0,0|1,0,1]=3 568 B7R0.6 CC(C)CCC(N)=O Amb8997711 [1,0,0,0,0,0|2,0,1]=4 569 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,0,0,0,0,0|2,0,1]=4 570 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,0,0,0,0,0|2,0,1]=4 571 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,0,0,0,0,0|2,0,1]=4 572 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,0,0,0,0,0|2,0,1]=4 573 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,0,0,0,0,0|2,0,1]=4 574 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,0,0,0,0,0|1,0,1]=3 575 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,0,0,0,0,0|1,0,1]=3 576 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,0,0,0,0,0|1,0,1]=3 577 B7R0.6 CC(N)CCS(=O)O Amb27839082 [1,0,0,0,0,0|2,0,1]=4 578 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [1,0,0,0,0,0|2,0,1]=4 579 B7R0.6 CC(N)SCC(=O)O Amb27401691 [1,0,0,0,0,0|2,0,1]=4 580 B7R0.6 CC(O)CCC(=N)N Amb29849256 [1,0,0,0,0,0|2,0,1]=4 581 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,0,0,0,0,0|0,0,2]=3 582 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [1,0,0,0,0,0|0,0,3]=4 583 B7R0.6 CC(O)CCC(N)=S Amb28078352 [1,0,0,0,0,0|1,1,1]=4 584 B7R0.6 CC(O)COC(N)=O Amb26359577 [1,0,0,0,0,0|2,0,1]=4 585 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,0,0,0,0,0|0,1,1]=3 586 B7R0.6 CC(S)CCC(N)=O Amb28399630 [1,0,0,0,0,0|1,1,1]=4 587 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [1,0,0,0,0,0|3,0,0]=4 588 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [1,0,0,0,0,0|3,0,0]=4 589 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,0,0,0,0,0|2,0,0]=3 590 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,0,0,0,0,0|2,0,0]=3 591 B7R0.6 CN(C)CCC(N)=O Amb17231825 [1,0,0,0,0,0|3,0,0]=4 592 B7R0.6 CN(C)OCC(=O)O Amb28120004 [1,0,0,0,0,0|3,0,0]=4 593 B7R0.6 CN(N)CCC(=O)O Amb2698078 [1,0,0,0,0,0|2,0,0]=3 594 B7R0.6 CN(O)CCC(N)=O Amb27390605 [1,0,0,0,0,0|2,0,0]=3 595 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [1,0,0,0,0,0|1,0,0]=2 596 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [1,0,0,0,0,0|3,0,0]=4 597 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [1,0,0,0,0,0|2,0,0]=3 598 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [1,0,0,0,0,0|1,0,2]=4 599 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,0,0,0,0,0|1,0,1]=3 600 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,0,0,0,0,0|1,0,1]=3 601 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [1,0,0,0,0,0|2,0,1]=4 602 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,0,0,0,0,0|1,0,1]=3 603 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,0,0,0,0,0|1,0,1]=3 604 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,0,0,0,0,0|0,0,2]=3 605 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,0,0,0,0,0|0,1,1]=3 606 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,0,0,0,0,0|2,0,0]=3 607 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [1,0,0,0,0,0|2,0,1]=4 608 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [1,0,0,0,0,0|2,0,1]=4 609 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [1,0,0,0,0,0|1,0,1]=3 610 B7R0.6 C\C(O)=N\NC(N)=O Amb17777869 [1,0,0,0,0,0|3,0,0]=4 611 B7R0.6 N=C(N)CCC(=N)N Amb2696658 [1,0,0,0,0,0|3,0,0]=4 612 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [1,0,0,0,0,0|2,0,0]=3 613 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [1,0,0,0,0,0|2,0,0]=3 614 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [1,0,0,0,0,0|2,0,0]=3 615 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [1,0,0,0,0,0|2,0,0]=3 616 B7R0.6 N=C(N)SCC(N)=O Amb22261500 [1,0,0,0,0,0|3,0,0]=4 617 B7R0.6 NC(=O)C#CC(N)=O Amb6366606 [1,0,0,0,0,0|1,0,2]=4 618 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [1,0,0,0,0,0|1,0,0]=2 619 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [1,0,0,0,0,0|0,0,0]=1 620 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [1,0,0,0,0,0|2,0,1]=4 621 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [1,0,0,0,0,0|1,0,0]=2 622 B7R0.6 NC(=O)CCC(O)O Amb27254204 [1,0,0,0,0,0|0,0,2]=3 623 B7R0.6 NC(=O)CNC(N)=S Amb9212104 [1,0,0,0,0,0|2,1,0]=4 624 B7R0.6 NC(=O)CO[PH](=O)O Amb27392553 [1,0,0,0,0,0|2,0,0]=3 625 B7R0.6 NC(=O)CSC(N)=S Amb27642551 [1,0,0,0,0,0|2,1,0]=4 626 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [1,0,0,0,0,0|1,0,0]=2 627 B7R0.6 NC(=O)NNC(N)=O Amb6366265 [1,0,0,0,0,0|3,0,0]=4 628 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [1,0,0,0,0,0|0,0,2]=3 629 B7R0.6 NC(=O)\C=C/C(N)=O Amb4292114 [1,0,0,0,0,0|1,0,2]=4 630 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [1,0,0,0,0,0|0,0,2]=3 631 B7R0.6 NC(=O)\C=C\C(N)=O Amb6334811 [1,0,0,0,0,0|1,0,2]=4 632 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [1,0,0,0,0,0|1,0,1]=3 633 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [1,0,0,0,0,0|0,1,0]=2 634 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [1,0,0,0,0,0|1,1,0]=3 635 B7R0.6 NC(=[NH2+])NCC(=O)[O-] Amb4244207 [1,0,0,0,0,0|2,0,1]=4 636 B7R0.6 NS(=O)CC[N+](=O)[O-] Amb32720434 [1,0,0,0,0,0|2,0,1]=4 637 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [1,0,0,0,0,0|2,0,0]=3 638 B7R0.6 O=C(O)C#CC(=O)O Amb6297768 [1,0,0,0,0,0|1,0,2]=4 639 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [1,0,0,0,0,0|2,0,1]=4 640 B7R0.6 O=C(O)CCB(O)O Amb24640288 [1,0,0,0,0,0|2,0,1]=4 641 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [1,0,0,0,0,0|1,0,0]=2 642 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [1,0,0,0,0,0|1,0,0]=2 643 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [1,0,0,0,0,0|2,0,1]=4 644 B7R0.6 O=C(O)CCC(F)F Amb20623135 [1,0,0,0,0,0|2,0,1]=4 645 B7R0.6 O=C(O)CCN(F)F Amb28370344 [1,0,0,0,0,0|3,0,0]=4 646 B7R0.6 O=C(O)CCP(O)O Amb27424479 [1,0,0,0,0,0|2,0,1]=4 647 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [1,0,0,0,0,0|2,0,0]=3 648 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [1,0,0,0,0,0|2,0,0]=3 649 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [1,0,0,0,0,0|2,0,0]=3 650 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [1,0,0,0,0,0|2,0,0]=3 651 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [1,0,0,0,0,0|3,0,0]=4 652 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [1,0,0,0,0,0|2,0,0]=3 653 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [1,0,0,0,0,0|1,0,2]=4 654 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [1,0,0,0,0,0|1,0,2]=4 655 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [1,0,0,0,0,0|1,0,2]=4 656 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [1,0,0,0,0,0|1,0,2]=4 657 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [1,0,0,0,0,0|1,0,2]=4 658 B7R0.6 O=C([O-])C#CC(=O)O Amb19748298 [1,0,0,0,0,0|1,0,2]=4 659 B7R0.6 O=C([O-])C#CC(=O)O Amb2721628 [1,0,0,0,0,0|1,0,2]=4 660 B7R0.6 O=C([O-])C#CC(=O)O Amb33620293 [1,0,0,0,0,0|1,0,2]=4 661 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [1,0,0,0,0,0|1,0,1]=3 662 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [1,0,0,0,0,0|1,0,1]=3 663 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [1,0,0,0,0,0|1,0,2]=4 664 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [1,0,0,0,0,0|1,0,2]=4 665 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [1,0,0,0,0,0|2,0,0]=3 666 B9R0.7 C=C(Br)CNC(=O)C(C)N Amb27399396 [0,1,0,0,0,0|3,0,0]=4 667 B9R0.7 C=C(C)C(=O)CCC(C)=O Amb28202297 [0,1,0,0,0,0|2,0,1]=4 668 B9R0.7 C=C(C)C(=O)NCC(=O)O Amb16232088 [0,1,0,0,0,0|2,0,1]=4 669 B9R0.7 C=C(C)C(=O)OCC(=O)O Amb18644056 [0,1,0,0,0,0|2,0,1]=4 670 B9R0.7 C=C(C)CCC(=O)C(C)C Amb9031731 [0,1,0,0,0,0|3,0,0]=4 671 B9R0.7 C=C(C)CCC(=O)C(C)N Amb28046434 [0,1,0,0,0,0|2,0,0]=3 672 B9R0.7 C=C(C)CCC(=O)C(F)F Amb27828458 [0,1,0,0,0,0|3,0,0]=4 673 B9R0.7 C=C(C)CNC(=O)[C@@H](C)N Amb28050424 [0,1,0,0,0,0|3,0,0]=4 674 B9R0.7 C=C(CCC(=O)O)C(=O)O Amb8391367 [0,1,0,0,0,0|2,0,1]=4 675 B9R0.7 C=C(CCC(=O)O)C(C)=O Amb27814984 [0,1,0,0,0,0|2,0,1]=4 676 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,1,0,0,0,0|2,0,0]=3 677 B9R0.7 CC(=O)C(=O)NCC(=O)O Amb17593639 [0,1,0,0,0,0|2,0,1]=4 678 B9R0.7 CC(=O)C(=O)OCC(=O)O Amb28126708 [0,1,0,0,0,0|2,0,1]=4 679 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,1,0,0,0,0|2,0,1]=4 680 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,1,0,0,0,0|2,0,0]=3 681 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,1,0,0,0,0|3,0,0]=4 682 B9R0.7 CC(=O)CNC(=O)C(C)Cl Amb26363906 [0,1,0,0,0,0|3,0,0]=4 683 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,1,0,0,0,0|3,0,0]=4 684 B9R0.7 CC(=O)COC(=O)C(F)F Amb28454640 [0,1,0,0,0,0|3,0,0]=4 685 B9R0.7 CC(=O)NNC(=O)C(C)N Amb17334234 [0,1,0,0,0,0|3,0,0]=4 686 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,1,0,0,0,0|3,0,0]=4 687 B9R0.7 CC(=O)OCC(=O)C(F)F Amb27802042 [0,1,0,0,0,0|3,0,0]=4 688 B9R0.7 CC(=O)OCC(=O)N(C)N Amb33191422 [0,1,0,0,0,0|3,0,0]=4 689 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,1,0,0,0,0|3,0,0]=4 690 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,1,0,0,0,0|2,0,0]=3 691 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,1,0,0,0,0|3,0,0]=4 692 B9R0.7 CC(C)C(=O)CNC(N)=O Amb27262218 [0,1,0,0,0,0|3,0,0]=4 693 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,1,0,0,0,0|2,0,0]=3 694 B9R0.7 CC(C)C(=O)NCC(N)=O Amb17231981 [0,1,0,0,0,0|3,0,0]=4 695 B9R0.7 CC(C)C(=O)\C=C\C(=O)O Amb25117573 [0,1,0,0,0,0|1,0,2]=4 696 B9R0.7 CC(C)C(=S)SCC(=O)O Amb27878469 [0,1,0,0,0,0|2,1,0]=4 697 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,1,0,0,0,0|2,0,1]=4 698 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,1,0,0,0,0|1,0,2]=4 699 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,1,0,0,0,0|3,0,0]=4 700 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,1,0,0,0,0|3,0,0]=4 701 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,1,0,0,0,0|1,0,2]=4 702 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,1,0,0,0,0|1,0,0]=2 703 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,1,0,0,0,0|2,0,0]=3 704 B9R0.7 CC(F)C(N)CCC(=O)O Amb27207659 [0,1,0,0,0,0|2,0,1]=4 705 B9R0.7 CC(N)C(=O)CCN(C)C Amb18831485 [0,1,0,0,0,0|3,0,0]=4 706 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,1,0,0,0,0|1,0,0]=2 707 B9R0.7 CC(N)C(=O)NCC(N)=O Amb6263248 [0,1,0,0,0,0|2,0,0]=3 708 B9R0.7 CC(N)C(=O)OCC(N)=O Amb27955239 [0,1,0,0,0,0|2,0,0]=3 709 B9R0.7 CC(N)C(O)CCC(=O)O Amb27881667 [0,1,0,0,0,0|0,0,2]=3 710 B9R0.7 CC(O)C(=O)NCC(N)=O Amb27188914 [0,1,0,0,0,0|3,0,0]=4 711 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,1,0,0,0,0|2,0,0]=3 712 B9R0.7 CC(O)C(C)CCC(=O)O Amb27424805 [0,1,0,0,0,0|2,0,1]=4 713 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,1,0,0,0,0|2,0,0]=3 714 B9R0.7 CN(C)C(=O)CCC(=O)Cl Amb27273505 [0,1,0,0,0,0|3,0,0]=4 715 B9R0.7 CN(C)C(=O)CCC(=O)O Amb1135807 [0,1,0,0,0,0|2,0,0]=3 716 B9R0.7 CN(C)C(=O)CCC(N)=O Amb17334218 [0,1,0,0,0,0|3,0,0]=4 717 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,1,0,0,0,0|3,0,0]=4 718 B9R0.7 CN(C)C(=O)SCC(=O)O Amb28199270 [0,1,0,0,0,0|3,0,0]=4 719 B9R0.7 CN(CCC(=O)O)C(=N)N Amb27389762 [0,1,0,0,0,0|2,0,1]=4 720 B9R0.7 CN(CCC(=O)O)C(N)=O Amb18984979 [0,1,0,0,0,0|2,0,1]=4 721 B9R0.7 CN(N)C(=S)NCC(=O)O Amb26318925 [0,1,0,0,0,0|2,1,0]=4 722 B9R0.7 CN(O)C(=O)CCC(=O)O Amb27460547 [0,1,0,0,0,0|2,0,0]=3 723 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,1,0,0,0,0|2,0,0]=3 724 B9R0.7 C[C@@H](F)[C@@H](N)CCC(=O)O Amb27604296 [0,1,0,0,0,0|2,0,1]=4 725 B9R0.7 C[C@@H](F)[C@H](O)CCC(=O)O Amb28256347 [0,1,0,0,0,0|1,0,2]=4 726 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,1,0,0,0,0|1,0,0]=2 727 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,1,0,0,0,0|1,0,0]=2 728 B9R0.7 C[C@@H](N)C(=O)NCC(N)=O Amb25242887 [0,1,0,0,0,0|2,0,0]=3 729 B9R0.7 C[C@@H](N)[C@@H](O)CCC(=O)O Amb27655533 [0,1,0,0,0,0|0,0,2]=3 730 B9R0.7 C[C@@H](O)C(=O)NCC(N)=O Amb28316066 [0,1,0,0,0,0|3,0,0]=4 731 B9R0.7 C[C@@H](O)CNC(=O)[C@@H](C)N Amb27396477 [0,1,0,0,0,0|2,0,1]=4 732 B9R0.7 C[C@@H](O)[C@H](O)CCC(=O)O Amb27628876 [0,1,0,0,0,0|1,0,2]=4 733 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,1,0,0,0,0|2,0,0]=3 734 B9R0.7 C[C@H](F)[C@H](O)CCC(=O)O Amb28126864 [0,1,0,0,0,0|1,0,2]=4 735 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,1,0,0,0,0|1,0,0]=2 736 B9R0.7 C[C@H](N)C(=O)NCC(N)=O Amb28399884 [0,1,0,0,0,0|2,0,0]=3 737 B9R0.7 C[C@H](N)C(=O)NC[C@@H](C)O Amb27834423 [0,1,0,0,0,0|2,0,1]=4 738 B9R0.7 C[C@H](N)C(=O)OCC(N)=O Amb28126942 [0,1,0,0,0,0|2,0,0]=3 739 B9R0.7 C[C@H](O)[C@H](N)CCC(=O)O Amb27217393 [0,1,0,0,0,0|2,0,1]=4 740 B9R0.7 C\C(=C/CC(=O)O)C(C)C Amb25866328 [0,1,0,0,0,0|2,0,1]=4 741 B9R0.7 N=C(N)C(=N)NCC(=O)O Amb27817484 [0,1,0,0,0,0|2,0,1]=4 742 B9R0.7 NC(=O)C(=O)NCC(=O)O Amb28050058 [0,1,0,0,0,0|1,0,1]=3 743 B9R0.7 NC(=O)C(N)CCC(=O)O Amb18644256 [0,1,0,0,0,0|1,0,2]=4 744 B9R0.7 NC(=O)CCC(=O)C(=O)O Amb26369364 [0,1,0,0,0,0|2,0,1]=4 745 B9R0.7 NC(=O)COC(=O)C(F)F Amb27399361 [0,1,0,0,0,0|3,0,0]=4 746 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O Amb22745051 [0,1,0,0,0,0|1,0,2]=4 747 B9R0.7 NC(=O)[C@H](N)CCC(=O)O Amb24557281 [0,1,0,0,0,0|1,0,2]=4 748 B9R0.7 NC(CCC(=O)O)C(F)F Amb19148415 [0,1,0,0,0,0|2,0,1]=4 749 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb1154117 [0,1,0,0,0,0|1,0,1]=3 750 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb16232496 [0,1,0,0,0,0|1,0,1]=3 751 B9R0.7 O=C(O)CCC(=O)C(=O)O Amb22746233 [0,1,0,0,0,0|1,0,1]=3 752 B9R0.7 O=C(O)CCC(=O)C(Cl)Cl Amb28343114 [0,1,0,0,0,0|1,0,0]=2 753 B9R0.7 O=C(O)CCC(=O)C(O)O Amb28429041 [0,1,0,0,0,0|1,0,0]=2 754 B9R0.7 O=C(O)CCC(Cl)=C(Cl)Cl Amb27621905 [0,1,0,0,0,0|2,0,1]=4 755 B9R0.7 O=C(O)CNC(=O)C(=O)O Amb2447304 [0,1,0,0,0,0|2,0,1]=4 756 B9R0.7 O=C(O)CNC(=O)C(Cl)Cl Amb24596966 [0,1,0,0,0,0|2,0,0]=3 757 B9R0.7 O=C(O)CNC(=O)C(F)F Amb26494307 [0,1,0,0,0,0|2,0,0]=3 758 B9R0.7 O=C(O)COC(=O)C(=O)O Amb28050116 [0,1,0,0,0,0|2,0,1]=4 759 B9R0.7 O=C([O-])CCC(=O)C(=O)O Amb22231405 [0,1,0,0,0,0|1,0,2]=4 760 B9R0.7 O=C([O-])CCC(=O)C(=O)[O-] Amb10072211 [0,1,0,0,0,0|1,0,2]=4 761 B9R0.21 C=C(CN)CCS(C)(=O)=O Amb33053946 [0,1,0,0,0,0|2,0,1]=4 762 B9R0.21 C=CC(=O)CCS(=O)(=O)O Amb28049856 [0,1,0,0,0,0|2,0,1]=4 763 B9R0.21 CC(C)(C)CCC(=O)CN Amb28126831 [0,1,0,0,0,0|2,0,1]=4 764 B9R0.21 CC(C)(O)CCC(=O)NN Amb27408014 [0,1,0,0,0,0|2,0,1]=4 765 B9R0.21 CC(C)(O)CNC(=O)CN Amb27614853 [0,1,0,0,0,0|2,0,1]=4 766 B9R0.21 CCC(=O)CCC(C)(C)O Amb28321026 [0,1,0,0,0,0|2,0,1]=4 767 B9R0.21 CCC(=O)NCP(=O)(O)O Amb28341012 [0,1,0,0,0,0|3,0,0]=4 768 B9R0.21 COC(=O)CCP(=O)(O)O Amb22388887 [0,1,0,0,0,0|3,0,0]=4 769 B9R0.21 COC(=O)CCS(=O)(=O)O Amb17400246 [0,1,0,0,0,0|3,0,0]=4 770 B9R0.21 CP(=O)(O)ONC(=O)CN Amb27803679 [0,1,0,0,0,0|3,0,0]=4 771 B9R0.21 CS(=O)(=O)CCC(=O)CCl Amb33053952 [0,1,0,0,0,0|2,0,1]=4 772 B9R0.21 CS(=O)(=O)CCC(=O)CN Amb27391397 [0,1,0,0,0,0|1,0,1]=3 773 B9R0.21 NCC(=O)CCC(F)(F)F Amb27875242 [0,1,0,0,0,0|2,0,1]=4 774 B9R0.21 O=C(CCl)NCP(=O)(O)O Amb27823588 [0,1,0,0,0,0|3,0,0]=4 775 B9R0.21 O=C(CO)CCP(=O)(O)O Amb27945519 [0,1,0,0,0,0|2,0,0]=3 776 B9R0.21 O=C(CO)CO[PH](=O)(=O)O Amb28190298 [0,1,0,0,0,0|3,0,0]=4 777 B9R0.21 O=C(CO)CSP(=O)(O)O Amb28050764 [0,1,0,0,0,0|3,0,0]=4 778 B9R0.21 O=C(CO)CS[PH](=O)(=O)O Amb27594796 [0,1,0,0,0,0|3,0,0]=4 779 B9R0.23 C=C(C)CN(C)C(=O)CN Amb25052537 [0,1,0,0,0,0|3,0,0]=4 780 B9R0.23 C=C(CC(=O)O)C(=O)OC Amb4034427 [0,1,0,0,0,0|2,0,1]=4 781 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,1,0,0,0,0|2,0,0]=3 782 B9R0.23 C=C(CC)C(N)CC(N)=O Amb28247069 [0,1,0,0,0,0|3,0,0]=4 783 B9R0.23 C=CC(=O)N(C)CC(=O)O Amb6267159 [0,1,0,0,0,0|2,0,1]=4 784 B9R0.23 C=CC(=O)N(O)CC(=O)O Amb27175200 [0,1,0,0,0,0|2,0,1]=4 785 B9R0.23 CC(=O)NC(C)C(=O)NN Amb8998040 [0,1,0,0,0,0|3,0,0]=4 786 B9R0.23 CC(=O)OC(C)C(=O)NN Amb27769604 [0,1,0,0,0,0|3,0,0]=4 787 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,1,0,0,0,0|2,0,1]=4 788 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,1,0,0,0,0|2,0,1]=4 789 B9R0.23 CC(O)CC(C)C(=O)NN Amb27666364 [0,1,0,0,0,0|2,0,1]=4 790 B9R0.23 CCC(=O)C(C)NC(N)=O Amb28350530 [0,1,0,0,0,0|3,0,0]=4 791 B9R0.23 CCC(=O)C(C)OC(C)=O Amb25909694 [0,1,0,0,0,0|3,0,0]=4 792 B9R0.23 CCC(=O)N(C)CC(=O)O Amb1113094 [0,1,0,0,0,0|2,0,0]=3 793 B9R0.23 CCC(=O)N(C)CC(C)=O Amb27448733 [0,1,0,0,0,0|3,0,0]=4 794 B9R0.23 CCC(=O)N(C)CC(N)=O Amb17231983 [0,1,0,0,0,0|3,0,0]=4 795 B9R0.23 CCC(=O)[C@H](C)NC(C)=O Amb27468250 [0,1,0,0,0,0|3,0,0]=4 796 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,1,0,0,0,0|2,0,1]=4 797 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,1,0,0,0,0|2,0,1]=4 798 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,1,0,0,0,0|2,0,1]=4 799 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,1,0,0,0,0|2,0,1]=4 800 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,1,0,0,0,0|2,0,1]=4 801 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,1,0,0,0,0|2,0,1]=4 802 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,1,0,0,0,0|2,0,1]=4 803 B9R0.23 CCN(C)C(C)CC(=O)O Amb22587145 [0,1,0,0,0,0|3,0,0]=4 804 B9R0.23 CCN(C)C(C)CC(=O)O Amb9399322 [0,1,0,0,0,0|3,0,0]=4 805 B9R0.23 CCS(=O)C(C)CC(=O)O Amb19012075 [0,1,0,0,0,0|2,0,0]=3 806 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,1,0,0,0,0|2,0,1]=4 807 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,1,0,0,0,0|2,0,1]=4 808 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,1,0,0,0,0|2,0,1]=4 809 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,1,0,0,0,0|2,0,1]=4 810 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,1,0,0,0,0|2,0,1]=4 811 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,1,0,0,0,0|2,0,1]=4 812 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,1,0,0,0,0|1,0,2]=4 813 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,1,0,0,0,0|2,0,1]=4 814 B9R0.23 CN(CC(=O)Cl)C(=O)CCl Amb28400001 [0,1,0,0,0,0|3,0,0]=4 815 B9R0.23 CN(CC(=O)O)C(=O)CCl Amb21956220 [0,1,0,0,0,0|2,0,0]=3 816 B9R0.23 CN(CC(=O)O)C(=O)CN Amb21929346 [0,1,0,0,0,0|1,0,0]=2 817 B9R0.23 CN(CC(=O)O)C(=O)CO Amb25848387 [0,1,0,0,0,0|2,0,0]=3 818 B9R0.23 CN(CC(=O)O)C(=O)CS Amb27406788 [0,1,0,0,0,0|2,0,0]=3 819 B9R0.23 CN(CC(N)=O)C(=O)CCl Amb8957103 [0,1,0,0,0,0|3,0,0]=4 820 B9R0.23 CN(CC(N)=O)C(=O)CS Amb27588532 [0,1,0,0,0,0|3,0,0]=4 821 B9R0.23 CNC(=O)C(C)CC(N)=O Amb17334220 [0,1,0,0,0,0|3,0,0]=4 822 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,1,0,0,0,0|2,0,0]=3 823 B9R0.23 CNC(=O)C(N)CC(N)=O Amb18968977 [0,1,0,0,0,0|3,0,0]=4 824 B9R0.23 COC(=O)C(Br)CC(=O)O Amb18656999 [0,1,0,0,0,0|2,0,0]=3 825 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [0,1,0,0,0,0|2,0,0]=3 826 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,1,0,0,0,0|3,0,0]=4 827 B9R0.23 COC(=O)C(C)C[PH](=O)O Amb27826336 [0,1,0,0,0,0|3,0,0]=4 828 B9R0.23 COC(=O)C(Cl)CC(=O)O Amb27589899 [0,1,0,0,0,0|2,0,0]=3 829 B9R0.23 COC(=O)C(F)CC(=O)O Amb27837974 [0,1,0,0,0,0|2,0,0]=3 830 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,1,0,0,0,0|2,0,0]=3 831 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,1,0,0,0,0|3,0,0]=4 832 B9R0.23 COC(=O)C(N)CC(N)=O Amb16243083 [0,1,0,0,0,0|3,0,0]=4 833 B9R0.23 COC(=O)C(N)CC(N)=O Amb17601698 [0,1,0,0,0,0|3,0,0]=4 834 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [0,1,0,0,0,0|2,0,0]=3 835 B9R0.23 COC(=O)C(O)CC(N)=O Amb27655536 [0,1,0,0,0,0|3,0,0]=4 836 B9R0.23 COC(=O)N(C)CC(=O)O Amb6668732 [0,1,0,0,0,0|3,0,0]=4 837 B9R0.23 COC(=O)[C@@H](Br)CC(N)=O Amb27789593 [0,1,0,0,0,0|3,0,0]=4 838 B9R0.23 COC(=O)[C@@H](F)CC(=O)O Amb27406311 [0,1,0,0,0,0|2,0,0]=3 839 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,1,0,0,0,0|2,0,0]=3 840 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,1,0,0,0,0|2,0,0]=3 841 B9R0.23 COC(=O)[C@@H](N)CC(=O)[O-] Amb22231950 [0,1,0,0,0,0|2,0,1]=4 842 B9R0.23 COC(=O)[C@@H](N)CC(N)=O Amb8390381 [0,1,0,0,0,0|3,0,0]=4 843 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [0,1,0,0,0,0|2,0,0]=3 844 B9R0.23 COC(=O)[C@H](C)CC(=O)Cl Amb28050543 [0,1,0,0,0,0|3,0,0]=4 845 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [0,1,0,0,0,0|2,0,0]=3 846 B9R0.23 COC(=O)[C@H](Cl)CC(=O)O Amb27232518 [0,1,0,0,0,0|2,0,0]=3 847 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,1,0,0,0,0|2,0,0]=3 848 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb19883963 [0,1,0,0,0,0|3,0,0]=4 849 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb27597987 [0,1,0,0,0,0|3,0,0]=4 850 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [0,1,0,0,0,0|2,0,0]=3 851 B9R0.23 COC(=O)[C@H](O)CC(N)=O Amb27623997 [0,1,0,0,0,0|3,0,0]=4 852 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,1,0,0,0,0|1,0,1]=3 853 B9R0.23 C\C(=C/N)C(N)CC(N)=O Amb28314171 [0,1,0,0,0,0|2,0,1]=4 854 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,1,0,0,0,0|3,0,0]=4 855 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,1,0,0,0,0|2,0,1]=4 856 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,1,0,0,0,0|1,0,2]=4 857 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,1,0,0,0,0|2,0,1]=4 858 B9R0.23 NNC(=O)C(N)CC(=O)O Amb26438038 [0,1,0,0,0,0|1,0,0]=2 859 B9R0.23 NNC(=O)C(N)CC(=O)O Amb35750707 [0,1,0,0,0,0|1,0,0]=2 860 B9R0.23 NNC(=O)C(N)CC(N)=O Amb27265356 [0,1,0,0,0,0|2,0,0]=3 861 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,1,0,0,0,0|2,0,1]=4 862 B9R0.23 N[C@H](CC(=O)O)C(=O)NO Amb27413035 [0,1,0,0,0,0|2,0,0]=3 863 B9R0.23 N\N=C(\N)N(N)CC(=O)O Amb24502285 [0,1,0,0,0,0|3,0,0]=4 864 B9R0.23 O=C(O)CC(Br)C(=O)CBr Amb15772353 [0,1,0,0,0,0|1,0,0]=2 865 B9R0.23 O=C(O)CC(S)C(=O)CS Amb27758589 [0,1,0,0,0,0|1,0,0]=2 866 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,1,0,0,0,0|1,0,2]=4 867 B9R0.24 C=C(C=O)CCC(=O)OC Amb27876497 [0,1,0,0,0,0|2,0,1]=4 868 B9R0.24 C=C(CC)CCC(=O)CC Amb27760965 [0,1,0,0,0,0|3,0,0]=4 869 B9R0.24 C=C(CC)CNC(=O)CN Amb27792144 [0,1,0,0,0,0|3,0,0]=4 870 B9R0.24 C=C(CO)COC(=O)OC Amb28050776 [0,1,0,0,0,0|3,0,0]=4 871 B9R0.24 CC(CO)CCC(=O)NN Amb28350052 [0,1,0,0,0,0|2,0,1]=4 872 B9R0.24 CC(CO)CNC(=O)CN Amb27197708 [0,1,0,0,0,0|2,0,1]=4 873 B9R0.24 CCC(=O)CCC(=O)CC Amb8391992 [0,1,0,0,0,0|2,0,0]=3 874 B9R0.24 CCC(=O)CCC(C)C=O Amb27424839 [0,1,0,0,0,0|2,0,1]=4 875 B9R0.24 CCC(=O)CCC(C)CN Amb28060686 [0,1,0,0,0,0|2,0,1]=4 876 B9R0.24 CCC(=O)CCC(O)CF Amb28437142 [0,1,0,0,0,0|2,0,1]=4 877 B9R0.24 CCC(=O)CNC(=O)CCl Amb24725631 [0,1,0,0,0,0|3,0,0]=4 878 B9R0.24 CCC(=O)CNC(=O)CO Amb27448700 [0,1,0,0,0,0|2,0,0]=3 879 B9R0.24 CCC(=O)COC(=O)CC Amb27598340 [0,1,0,0,0,0|3,0,0]=4 880 B9R0.24 CCC(=O)NCC(=O)NN Amb27982624 [0,1,0,0,0,0|3,0,0]=4 881 B9R0.24 CCC(=O)NNC(=O)CN Amb17334235 [0,1,0,0,0,0|3,0,0]=4 882 B9R0.24 CCC(Br)CCC(=O)OC Amb28049989 [0,1,0,0,0,0|2,0,1]=4 883 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,1,0,0,0,0|2,0,1]=4 884 B9R0.24 CCC(Cl)CCC(=O)OC Amb28076681 [0,1,0,0,0,0|2,0,1]=4 885 B9R0.24 CCC(N)CCC(=O)OC Amb26855249 [0,1,0,0,0,0|2,0,1]=4 886 B9R0.24 CCC(N)CCC(=O)OC Amb33483211 [0,1,0,0,0,0|2,0,1]=4 887 B9R0.24 CCC(O)CCC(=O)NN Amb6337544 [0,1,0,0,0,0|2,0,1]=4 888 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,1,0,0,0,0|1,0,2]=4 889 B9R0.24 CCC(O)CNC(=O)CN Amb27242062 [0,1,0,0,0,0|2,0,1]=4 890 B9R0.24 CCN(C)CCC(=O)OC Amb8890963 [0,1,0,0,0,0|3,0,0]=4 891 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,1,0,0,0,0|1,0,2]=4 892 B9R0.24 CNC(=O)CCC(=O)NC Amb4017621 [0,1,0,0,0,0|3,0,0]=4 893 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,1,0,0,0,0|2,0,0]=3 894 B9R0.24 CNC(=O)CNC(=O)CBr Amb27752218 [0,1,0,0,0,0|3,0,0]=4 895 B9R0.24 CNC(=O)CNC(=O)CCl Amb475203 [0,1,0,0,0,0|3,0,0]=4 896 B9R0.24 CNC(=O)CNC(=O)NN Amb32410410 [0,1,0,0,0,0|3,0,0]=4 897 B9R0.24 CNC(=O)COC(=O)CO Amb28315993 [0,1,0,0,0,0|3,0,0]=4 898 B9R0.24 CNC(=O)SCC(=O)OC Amb27180433 [0,1,0,0,0,0|3,0,0]=4 899 B9R0.24 COC(=O)CCC(=N)NO Amb27148692 [0,1,0,0,0,0|3,0,0]=4 900 B9R0.24 COC(=O)CCC(=O)CBr Amb33526898 [0,1,0,0,0,0|1,0,0]=2 901 B9R0.24 COC(=O)CCC(=O)CCl Amb26649344 [0,1,0,0,0,0|1,0,0]=2 902 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,1,0,0,0,0|0,0,0]=1 903 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,1,0,0,0,0|0,0,0]=1 904 B9R0.24 COC(=O)CCC(=O)NN Amb28046722 [0,1,0,0,0,0|1,0,0]=2 905 B9R0.24 COC(=O)CCC(=O)NO Amb28454716 [0,1,0,0,0,0|2,0,0]=3 906 B9R0.24 COC(=O)CCC(=O)OC Amb2793094 [0,1,0,0,0,0|2,0,0]=3 907 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,1,0,0,0,0|1,0,1]=3 908 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,1,0,0,0,0|2,0,1]=4 909 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,1,0,0,0,0|2,0,1]=4 910 B9R0.24 COC(=O)CCS(=O)OC Amb22728623 [0,1,0,0,0,0|3,0,0]=4 911 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,1,0,0,0,0|1,0,1]=3 912 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,1,0,0,0,0|2,0,1]=4 913 B9R0.24 COC(=O)CC[C@@H](O)CO Amb27761525 [0,1,0,0,0,0|1,0,2]=4 914 B9R0.24 COC(=O)CC[C@H](N)CF Amb27628411 [0,1,0,0,0,0|2,0,1]=4 915 B9R0.24 COC(=O)CC[C@H](O)CBr Amb27635803 [0,1,0,0,0,0|1,0,2]=4 916 B9R0.24 COC(=O)CC\C(C)=N\O Amb28064373 [0,1,0,0,0,0|3,0,0]=4 917 B9R0.24 COC(=O)CNC(=O)C#N Amb27426721 [0,1,0,0,0,0|1,0,2]=4 918 B9R0.24 COC(=O)CNC(=O)CBr Amb17329958 [0,1,0,0,0,0|2,0,0]=3 919 B9R0.24 COC(=O)CNC(=O)CCl Amb367447 [0,1,0,0,0,0|2,0,0]=3 920 B9R0.24 COC(=O)CNC(=O)CN Amb2701513 [0,1,0,0,0,0|1,0,0]=2 921 B9R0.24 COC(=O)CNC(=O)CN Amb5783125 [0,1,0,0,0,0|1,0,0]=2 922 B9R0.24 COC(=O)CNC(=O)CO Amb28410960 [0,1,0,0,0,0|2,0,0]=3 923 B9R0.24 COC(=O)CNC(=O)NN Amb32789579 [0,1,0,0,0,0|2,0,0]=3 924 B9R0.24 COC(=O)CNC(=O)OC Amb9265412 [0,1,0,0,0,0|3,0,0]=4 925 B9R0.24 COC(=O)CNC(=O)SC Amb24620395 [0,1,0,0,0,0|3,0,0]=4 926 B9R0.24 COC(=O)CNC(=S)NN Amb9205808 [0,1,0,0,0,0|2,1,0]=4 927 B9R0.24 COC(=O)COC(=O)CO Amb28206230 [0,1,0,0,0,0|2,0,0]=3 928 B9R0.24 COC(=O)CSC(=O)CCl Amb27407672 [0,1,0,0,0,0|2,0,0]=3 929 B9R0.24 COC(=O)CS\C(N)=N\N Amb28140185 [0,1,0,0,0,0|3,0,0]=4 930 B9R0.24 COC(=O)C\C=C(\C)CO Amb28050664 [0,1,0,0,0,0|2,0,1]=4 931 B9R0.24 COC(=O)NCC(=O)CBr Amb28122949 [0,1,0,0,0,0|2,0,0]=3 932 B9R0.24 COC(=O)NCC(=O)NN Amb27969172 [0,1,0,0,0,0|2,0,0]=3 933 B9R0.24 COC(=O)NCC(=O)NO Amb27211651 [0,1,0,0,0,0|3,0,0]=4 934 B9R0.24 COC(=O)\C=C\C(=O)CBr Amb26539741 [0,1,0,0,0,0|1,0,2]=4 935 B9R0.24 COC(C)CCC(=O)CN Amb27257316 [0,1,0,0,0,0|1,0,1]=3 936 B9R0.24 COC(C)CCC(=O)NN Amb27232398 [0,1,0,0,0,0|2,0,1]=4 937 B9R0.24 COC(C)CNC(=O)CN Amb27474446 [0,1,0,0,0,0|2,0,1]=4 938 B9R0.24 NCC(=O)CCC(=O)CCl Amb27767996 [0,1,0,0,0,0|1,0,0]=2 939 B9R0.24 NCC(=O)NCC(=O)NN Amb28060025 [0,1,0,0,0,0|2,0,0]=3 940 B9R0.24 NNC(=O)CCC(=O)NN Amb6335816 [0,1,0,0,0,0|2,0,0]=3 941 B9R0.24 NOC(=O)CCC(=O)ON Amb22346144 [0,1,0,0,0,0|1,0,0]=2 942 B9R0.24 O=CC(O)CNC(=O)CBr Amb27841938 [0,1,0,0,0,0|2,0,1]=4 943 B9R0.42 C#CC(=O)N[C@@H](C)C(=O)O Amb28060769 [0,1,0,0,0,0|2,0,1]=4 944 B9R0.42 C=C(C)[C@@H](O)CC(=O)CC Amb28126621 [0,1,0,0,0,0|3,0,0]=4 945 B9R0.42 C=C(C)[C@H](O)CC(=O)CC Amb27760878 [0,1,0,0,0,0|3,0,0]=4 946 B9R0.42 C=C(CC(=O)NC)C(=O)O Amb22269311 [0,1,0,0,0,0|2,0,1]=4 947 B9R0.42 C=C(CC(=O)OC)C(=O)O Amb4035034 [0,1,0,0,0,0|2,0,1]=4 948 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,1,0,0,0,0|2,0,0]=3 949 B9R0.42 C=C(CC)CC(N)C(N)=O Amb24429018 [0,1,0,0,0,0|3,0,0]=4 950 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,1,0,0,0,0|2,0,0]=3 951 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,1,0,0,0,0|2,0,0]=3 952 B9R0.42 C=C(NC(=O)CCl)C(=O)O Amb1951911 [0,1,0,0,0,0|2,0,1]=4 953 B9R0.42 C=C(NC(=O)CN)C(=O)O Amb25845451 [0,1,0,0,0,0|1,0,1]=3 954 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb3940875 [0,1,0,0,0,0|2,0,1]=4 955 B9R0.42 C=CC(=O)NC(O)C(=O)O Amb9790819 [0,1,0,0,0,0|2,0,1]=4 956 B9R0.42 C=CC(=O)OC(C)C(=O)O Amb27592472 [0,1,0,0,0,0|2,0,1]=4 957 B9R0.42 CC(=O)C(O)CC(=O)C=O Amb27480852 [0,1,0,0,0,0|2,0,1]=4 958 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [0,1,0,0,0,0|1,0,0]=2 959 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,1,0,0,0,0|2,0,1]=4 960 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,0,0,0,0|2,0,1]=4 961 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,0,0,0,0|2,0,1]=4 962 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,0,0,0,0|2,0,1]=4 963 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,0,0,0,0|2,0,1]=4 964 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,1,0,0,0,0|2,0,1]=4 965 B9R0.42 CC(NC(=O)C=O)C(=O)O Amb27830810 [0,1,0,0,0,0|2,0,1]=4 966 B9R0.42 CC(NC(=O)CBr)C(N)=O Amb27470048 [0,1,0,0,0,0|3,0,0]=4 967 B9R0.42 CC(NC(=O)CCl)C(=O)Cl Amb27201426 [0,1,0,0,0,0|3,0,0]=4 968 B9R0.42 CC(NC(=O)CCl)C(=O)O Amb3940604 [0,1,0,0,0,0|2,0,0]=3 969 B9R0.42 CC(NC(=O)CN)C(=O)O Amb533807 [0,1,0,0,0,0|1,0,0]=2 970 B9R0.42 CC(O)C(C)NC(=O)CN Amb27424140 [0,1,0,0,0,0|2,0,1]=4 971 B9R0.42 CC(O)C(O)CC(=O)CO Amb27615146 [0,1,0,0,0,0|2,0,1]=4 972 B9R0.42 CC(OC(=O)CCl)C(=O)O Amb28042677 [0,1,0,0,0,0|2,0,0]=3 973 B9R0.42 CC(OC(=O)CN)C(N)=O Amb27596266 [0,1,0,0,0,0|2,0,0]=3 974 B9R0.42 CC(OC(=O)CO)C(N)=O Amb28126899 [0,1,0,0,0,0|3,0,0]=4 975 B9R0.42 CC(S\C(N)=N\N)C(=O)O Amb28125235 [0,1,0,0,0,0|3,0,0]=4 976 B9R0.42 CCC(=O)CC(=O)C(C)=O Amb25110491 [0,1,0,0,0,0|2,0,1]=4 977 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,1,0,0,0,0|1,0,0]=2 978 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,1,0,0,0,0|1,0,0]=2 979 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,1,0,0,0,0|2,0,0]=3 980 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,1,0,0,0,0|1,0,0]=2 981 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,1,0,0,0,0|1,0,0]=2 982 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,1,0,0,0,0|1,0,0]=2 983 B9R0.42 CCC(=O)NC(C)C(=O)O Amb1116933 [0,1,0,0,0,0|2,0,0]=3 984 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Amb22901053 [0,1,0,0,0,0|2,0,0]=3 985 B9R0.42 CCC(=O)OC(C)C(C)=O Amb26063123 [0,1,0,0,0,0|3,0,0]=4 986 B9R0.42 CCC(=O)\C=C(/C)C(=O)O Amb27613306 [0,1,0,0,0,0|1,0,2]=4 987 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,1,0,0,0,0|2,0,1]=4 988 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,1,0,0,0,0|2,0,1]=4 989 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,1,0,0,0,0|2,0,1]=4 990 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,1,0,0,0,0|2,0,1]=4 991 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,1,0,0,0,0|2,0,1]=4 992 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,1,0,0,0,0|2,0,1]=4 993 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,1,0,0,0,0|2,0,1]=4 994 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,1,0,0,0,0|2,0,1]=4 995 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,1,0,0,0,0|2,0,1]=4 996 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,1,0,0,0,0|2,0,1]=4 997 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [0,1,0,0,0,0|2,0,1]=4 998 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,1,0,0,0,0|1,0,2]=4 999 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,1,0,0,0,0|1,0,2]=4 1000 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,1,0,0,0,0|1,0,2]=4 1001 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,1,0,0,0,0|1,0,2]=4 1002 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,1,0,0,0,0|1,0,2]=4 1003 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,1,0,0,0,0|1,0,2]=4 1004 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [0,1,0,0,0,0|3,0,0]=4 1005 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [0,1,0,0,0,0|3,0,0]=4 1006 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,1,0,0,0,0|3,0,0]=4 1007 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,1,0,0,0,0|2,0,0]=3 1008 B9R0.42 CCS(=O)CC(Cl)C(N)=O Amb28121099 [0,1,0,0,0,0|3,0,0]=4 1009 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,1,0,0,0,0|2,0,0]=3 1010 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,1,0,0,0,0|2,0,0]=3 1011 B9R0.42 CCS(=O)NC(C)C(=O)O Amb28319239 [0,1,0,0,0,0|3,0,0]=4 1012 B9R0.42 CCS(=O)N[C@@H](C)C(=O)O Amb27243800 [0,1,0,0,0,0|3,0,0]=4 1013 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,1,0,0,0,0|2,0,1]=4 1014 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,1,0,0,0,0|2,0,1]=4 1015 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,1,0,0,0,0|2,0,1]=4 1016 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,1,0,0,0,0|2,0,1]=4 1017 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,1,0,0,0,0|2,0,1]=4 1018 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,1,0,0,0,0|2,0,1]=4 1019 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,1,0,0,0,0|2,0,1]=4 1020 B9R0.42 CN(CC(=O)NN)C(N)=O Amb28320178 [0,1,0,0,0,0|3,0,0]=4 1021 B9R0.42 CNC(=O)CC(C)C(N)=O Amb17334219 [0,1,0,0,0,0|3,0,0]=4 1022 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,1,0,0,0,0|2,0,0]=3 1023 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,1,0,0,0,0|2,0,0]=3 1024 B9R0.42 CNC(=O)NC(C)C(=O)O Amb1130316 [0,1,0,0,0,0|3,0,0]=4 1025 B9R0.42 CNC(=O)N[C@@H](C)C(=O)O Amb24478025 [0,1,0,0,0,0|3,0,0]=4 1026 B9R0.42 CNC(=O)N[C@H](C)C(=O)O Amb24558529 [0,1,0,0,0,0|3,0,0]=4 1027 B9R0.42 CNC(=O)OC(C)C(=O)O Amb35655772 [0,1,0,0,0,0|3,0,0]=4 1028 B9R0.42 CNC(=O)O[C@@H](C)C(=O)O Amb35647450 [0,1,0,0,0,0|3,0,0]=4 1029 B9R0.42 CNC(=O)O[C@H](C)C(=O)O Amb29866286 [0,1,0,0,0,0|3,0,0]=4 1030 B9R0.42 COC(=O)CC(=O)C(=O)O Amb22728219 [0,1,0,0,0,0|2,0,1]=4 1031 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,1,0,0,0,0|2,0,0]=3 1032 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,1,0,0,0,0|3,0,0]=4 1033 B9R0.42 COC(=O)CC(Br)C(N)=O Amb27969234 [0,1,0,0,0,0|3,0,0]=4 1034 B9R0.42 COC(=O)CC(C)C(=O)Cl Amb27972299 [0,1,0,0,0,0|3,0,0]=4 1035 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,1,0,0,0,0|2,0,0]=3 1036 B9R0.42 COC(=O)CC(C)C(=O)[O-] Amb34915052 [0,1,0,0,0,0|2,0,1]=4 1037 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,1,0,0,0,0|2,0,0]=3 1038 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,1,0,0,0,0|3,0,0]=4 1039 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,1,0,0,0,0|2,0,0]=3 1040 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,1,0,0,0,0|2,0,0]=3 1041 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,1,0,0,0,0|2,0,0]=3 1042 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,1,0,0,0,0|2,0,0]=3 1043 B9R0.42 COC(=O)CC(O)C(N)=O Amb27830345 [0,1,0,0,0,0|3,0,0]=4 1044 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,1,0,0,0,0|2,0,0]=3 1045 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,1,0,0,0,0|3,0,0]=4 1046 B9R0.42 COC(=O)C[C@@H](C)C(N)=O Amb27169355 [0,1,0,0,0,0|3,0,0]=4 1047 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,1,0,0,0,0|2,0,0]=3 1048 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,1,0,0,0,0|2,0,0]=3 1049 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,1,0,0,0,0|2,0,0]=3 1050 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,1,0,0,0,0|2,0,0]=3 1051 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,1,0,0,0,0|2,0,0]=3 1052 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,1,0,0,0,0|3,0,0]=4 1053 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,1,0,0,0,0|2,0,0]=3 1054 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,1,0,0,0,0|2,0,0]=3 1055 B9R0.42 COC(=O)C[C@H](O)C(N)=O Amb28120921 [0,1,0,0,0,0|3,0,0]=4 1056 B9R0.42 COC(=O)NC(C)C(=O)O Amb6668789 [0,1,0,0,0,0|3,0,0]=4 1057 B9R0.42 COC(=O)N[C@@H](C)C(=O)O Amb24477985 [0,1,0,0,0,0|3,0,0]=4 1058 B9R0.42 COC(=O)N[C@H](C)C(=O)O Amb24381066 [0,1,0,0,0,0|3,0,0]=4 1059 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,0,0,0,0|2,0,1]=4 1060 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,1,0,0,0,0|0,0,2]=3 1061 B9R0.42 C[C@@H](NC(=O)CCl)C(=O)O Amb10842258 [0,1,0,0,0,0|2,0,0]=3 1062 B9R0.42 C[C@@H](NC(=O)CN)C(N)=O Amb27865946 [0,1,0,0,0,0|2,0,0]=3 1063 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,0,0,0,0|2,0,1]=4 1064 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,1,0,0,0,0|0,0,2]=3 1065 B9R0.42 C[C@H](NC(=O)CCl)C(=O)O Amb2781694 [0,1,0,0,0,0|2,0,0]=3 1066 B9R0.42 C[C@H](NC(=O)CN)C(=O)O Amb537542 [0,1,0,0,0,0|1,0,0]=2 1067 B9R0.42 C[C@H](NC(=O)CS)C(=O)O Amb27780474 [0,1,0,0,0,0|2,0,0]=3 1068 B9R0.42 C[C@H](OC(=O)CBr)C(N)=O Amb27985898 [0,1,0,0,0,0|3,0,0]=4 1069 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,1,0,0,0,0|2,0,1]=4 1070 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,1,0,0,0,0|2,0,1]=4 1071 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,1,0,0,0,0|2,0,1]=4 1072 B9R0.42 C\C(=N/C(=O)CO)C(=O)O Amb27426561 [0,1,0,0,0,0|2,0,1]=4 1073 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,1,0,0,0,0|2,0,1]=4 1074 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,1,0,0,0,0|1,0,0]=2 1075 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,1,0,0,0,0|1,0,0]=2 1076 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [0,1,0,0,0,0|2,0,0]=3 1077 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,1,0,0,0,0|2,0,1]=4 1078 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,1,0,0,0,0|1,0,2]=4 1079 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,1,0,0,0,0|1,0,2]=4 1080 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,1,0,0,0,0|1,0,2]=4 1081 B9R0.42 NC(C\C(Cl)=C\Cl)C(=O)O Amb27232854 [0,1,0,0,0,0|2,0,1]=4 1082 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [0,1,0,0,0,0|1,0,1]=3 1083 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,1,0,0,0,0|0,0,2]=3 1084 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,1,0,0,0,0|0,0,2]=3 1085 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,1,0,0,0,0|0,0,2]=3 1086 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [0,1,0,0,0,0|1,0,0]=2 1087 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,1,0,0,0,0|1,0,0]=2 1088 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,1,0,0,0,0|1,0,0]=2 1089 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,1,0,0,0,0|1,0,0]=2 1090 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [0,1,0,0,0,0|2,0,0]=3 1091 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,1,0,0,0,0|1,0,2]=4 1092 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,1,0,0,0,0|1,0,2]=4 1093 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,1,0,0,0,0|1,0,2]=4 1094 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,1,0,0,0,0|1,0,2]=4 1095 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,1,0,0,0,0|1,0,2]=4 1096 B9R0.42 N\C=C(/N)CC(N)C(=O)O Amb28250396 [0,1,0,0,0,0|1,0,1]=3 1097 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [0,1,0,0,0,0|1,0,0]=2 1098 B9R0.42 O=C(CCl)NC(O)C(=O)O Amb27598875 [0,1,0,0,0,0|2,0,0]=3 1099 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [0,1,0,0,0,0|2,0,1]=4 1100 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,1,0,0,0,0|1,0,2]=4 1101 B9R0.43 CCC(C#N)CCC(=O)O Amb18643712 [0,1,0,0,0,0|2,0,1]=4 1102 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [0,1,0,0,0,0|2,0,1]=4 1103 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,1,0,0,0,0|2,0,1]=4 1104 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,1,0,0,0,0|2,0,1]=4 1105 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,1,0,0,0,0|1,0,2]=4 1106 B9R0.43 CCN(C=O)CCC(C)=O Amb24458250 [0,1,0,0,0,0|3,0,0]=4 1107 B9R0.43 CCN(CC)CCC(=O)O Amb6651899 [0,1,0,0,0,0|3,0,0]=4 1108 B9R0.43 CCN(CC)CCC(=O)O Amb8513118 [0,1,0,0,0,0|3,0,0]=4 1109 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [0,1,0,0,0,0|2,0,1]=4 1110 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,1,0,0,0,0|1,0,1]=3 1111 B9R0.43 C\C=C(/CC)CCC(C)=O Amb25857597 [0,1,0,0,0,0|3,0,0]=4 1112 B9R0.43 N#C\C(CCC(=O)O)=N/O Amb27259756 [0,1,0,0,0,0|0,0,3]=4 1113 B9R0.48 C#CCC(=O)NCC(=O)O Amb27641047 [0,1,0,0,0,0|2,0,0]=3 1114 B9R0.48 C#CCN(C)CCC(=O)O Amb17561257 [0,1,0,0,0,0|3,0,0]=4 1115 B9R0.48 C=C(C)CCC(=O)CCN Amb27467366 [0,1,0,0,0,0|2,0,0]=3 1116 B9R0.48 C=C(C)CCC(=O)OCC Amb22270105 [0,1,0,0,0,0|3,0,0]=4 1117 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,1,0,0,0,0|2,0,0]=3 1118 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,1,0,0,0,0|2,0,1]=4 1119 B9R0.48 C=CNC(=O)CCC(=O)O Amb24505247 [0,1,0,0,0,0|1,0,1]=3 1120 B9R0.48 C=CNC(=O)CCC(N)=O Amb27831982 [0,1,0,0,0,0|2,0,1]=4 1121 B9R0.48 C=COC(=O)NCC(=O)O Amb28063004 [0,1,0,0,0,0|2,0,1]=4 1122 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [0,1,0,0,0,0|2,0,1]=4 1123 B9R0.48 CC(=O)COC(=O)CC#N Amb27652757 [0,1,0,0,0,0|2,0,1]=4 1124 B9R0.48 CC(=O)NNC(=O)CCN Amb17334233 [0,1,0,0,0,0|3,0,0]=4 1125 B9R0.48 CC(=O)OC\C(C)=C\CN Amb27626538 [0,1,0,0,0,0|3,0,0]=4 1126 B9R0.48 CC(=O)SCC(=O)NCS Amb27837955 [0,1,0,0,0,0|3,0,0]=4 1127 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,1,0,0,0,0|2,0,1]=4 1128 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,1,0,0,0,0|2,0,1]=4 1129 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,1,0,0,0,0|1,0,1]=3 1130 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,1,0,0,0,0|2,0,1]=4 1131 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,1,0,0,0,0|2,0,1]=4 1132 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,1,0,0,0,0|2,0,1]=4 1133 B9R0.48 CCCC(=O)CCB(O)O Amb28049896 [0,1,0,0,0,0|2,0,1]=4 1134 B9R0.48 CCCC(=O)CCC(C)=O Amb2721037 [0,1,0,0,0,0|2,0,0]=3 1135 B9R0.48 CCCC(=O)COC(C)=O Amb28437151 [0,1,0,0,0,0|3,0,0]=4 1136 B9R0.48 CCCC(=O)NCC(=O)O Amb5741675 [0,1,0,0,0,0|2,0,0]=3 1137 B9R0.48 CCCC(=O)NCC(N)=O Amb17231980 [0,1,0,0,0,0|3,0,0]=4 1138 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,1,0,0,0,0|2,0,0]=3 1139 B9R0.48 CCCC(=O)OCC(C)=O Amb28350457 [0,1,0,0,0,0|3,0,0]=4 1140 B9R0.48 CCCC(=O)SCC(=O)O Amb27400351 [0,1,0,0,0,0|2,0,0]=3 1141 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,1,0,0,0,0|2,0,1]=4 1142 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,1,0,0,0,0|2,0,1]=4 1143 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,1,0,0,0,0|1,0,2]=4 1144 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [0,1,0,0,0,0|3,0,0]=4 1145 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [0,1,0,0,0,0|3,0,0]=4 1146 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [0,1,0,0,0,0|2,0,1]=4 1147 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [0,1,0,0,0,0|2,0,0]=3 1148 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,1,0,0,0,0|1,0,2]=4 1149 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,1,0,0,0,0|2,0,1]=4 1150 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,1,0,0,0,0|1,0,2]=4 1151 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,1,0,0,0,0|1,0,0]=2 1152 B9R0.48 CCNC(=O)CCC(C)=O Amb17334212 [0,1,0,0,0,0|2,0,0]=3 1153 B9R0.48 CCNC(=O)CCC(C)O Amb17334243 [0,1,0,0,0,0|2,0,1]=4 1154 B9R0.48 CCNC(=O)CCC(N)=O Amb17142864 [0,1,0,0,0,0|2,0,0]=3 1155 B9R0.48 CCNC(=O)NCC(=O)O Amb1129570 [0,1,0,0,0,0|2,0,0]=3 1156 B9R0.48 CCNC(=O)NCC(C)=O Amb28194385 [0,1,0,0,0,0|3,0,0]=4 1157 B9R0.48 CCNC(=O)OCC(=O)O Amb27173452 [0,1,0,0,0,0|2,0,0]=3 1158 B9R0.48 CCNC(=O)OCC(C)=O Amb27660754 [0,1,0,0,0,0|3,0,0]=4 1159 B9R0.48 CCNC(=O)OCC(N)=O Amb28126696 [0,1,0,0,0,0|3,0,0]=4 1160 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [0,1,0,0,0,0|1,0,2]=4 1161 B9R0.48 CCNC(=O)\C=C\C(=O)O Amb9251696 [0,1,0,0,0,0|1,0,2]=4 1162 B9R0.48 CCNC(=S)NCC(=O)O Amb25857780 [0,1,0,0,0,0|2,1,0]=4 1163 B9R0.48 CCNC(=S)OCC(=O)O Amb28343116 [0,1,0,0,0,0|2,1,0]=4 1164 B9R0.48 CCOC(=O)CCB(O)O Amb25244100 [0,1,0,0,0,0|2,0,1]=4 1165 B9R0.48 CCOC(=O)CCC(=O)Cl Amb3939960 [0,1,0,0,0,0|2,0,0]=3 1166 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,1,0,0,0,0|1,0,0]=2 1167 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,1,0,0,0,0|2,0,0]=3 1168 B9R0.48 CCOC(=O)CCC(C)O Amb26877286 [0,1,0,0,0,0|2,0,1]=4 1169 B9R0.48 CCOC(=O)CCC(N)=O Amb8997750 [0,1,0,0,0,0|2,0,0]=3 1170 B9R0.48 CCOC(=O)CCS(=O)Cl Amb25945213 [0,1,0,0,0,0|3,0,0]=4 1171 B9R0.48 CCOC(=O)CCS(=O)O Amb24551974 [0,1,0,0,0,0|2,0,0]=3 1172 B9R0.48 CCOC(=O)CCS(=O)[O-] Amb26074084 [0,1,0,0,0,0|2,0,1]=4 1173 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,1,0,0,0,0|3,0,0]=4 1174 B9R0.48 CCOC(=O)CCS(N)=O Amb32719564 [0,1,0,0,0,0|3,0,0]=4 1175 B9R0.48 CCOC(=O)CC[C@@H](C)O Amb27486190 [0,1,0,0,0,0|2,0,1]=4 1176 B9R0.48 CCOC(=O)CC[C@H](C)O Amb28370101 [0,1,0,0,0,0|2,0,1]=4 1177 B9R0.48 CCOC(=O)CC[N+](=O)[O-] Amb22739667 [0,1,0,0,0,0|2,0,1]=4 1178 B9R0.48 CCOC(=O)CNC(C)=O Amb33534694 [0,1,0,0,0,0|3,0,0]=4 1179 B9R0.48 CCOC(=O)CNC(N)=O Amb2438049 [0,1,0,0,0,0|3,0,0]=4 1180 B9R0.48 CCOC(=O)COC(=O)Cl Amb27803973 [0,1,0,0,0,0|3,0,0]=4 1181 B9R0.48 CCOC(=O)NCC(=O)O Amb6246368 [0,1,0,0,0,0|2,0,0]=3 1182 B9R0.48 CCOC(=O)NCC(N)=O Amb27392498 [0,1,0,0,0,0|3,0,0]=4 1183 B9R0.48 CCOC(=O)OCC(=O)O Amb25367281 [0,1,0,0,0,0|2,0,0]=3 1184 B9R0.48 CCOC(=O)\C=C/C(=O)O Amb24462678 [0,1,0,0,0,0|1,0,2]=4 1185 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [0,1,0,0,0,0|1,0,2]=4 1186 B9R0.48 CCOC(=S)NCC(=O)O Amb26481347 [0,1,0,0,0,0|2,1,0]=4 1187 B9R0.48 CCOC(=S)SCC(=O)O Amb4017675 [0,1,0,0,0,0|2,1,0]=4 1188 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,1,0,0,0,0|2,0,1]=4 1189 B9R0.48 CCSC(=O)CCC(C)=O Amb28253786 [0,1,0,0,0,0|2,0,0]=3 1190 B9R0.48 CCSC(=O)CNC(C)=O Amb25146289 [0,1,0,0,0,0|3,0,0]=4 1191 B9R0.48 CCSC(=S)SCC(=O)O Amb28385725 [0,1,0,0,0,0|2,1,0]=4 1192 B9R0.48 CCS\C(S)=N/CC(=O)O Amb21862600 [0,1,0,0,0,0|2,1,0]=4 1193 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,1,0,0,0,0|2,0,0]=3 1194 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,1,0,0,0,0|3,0,0]=4 1195 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,1,0,0,0,0|2,0,0]=3 1196 B9R0.48 CN(C)CCC(=O)CCN Amb33272649 [0,1,0,0,0,0|3,0,0]=4 1197 B9R0.48 CN(CC#N)CCC(=O)O Amb17561163 [0,1,0,0,0,0|2,0,1]=4 1198 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [0,1,0,0,0,0|3,0,0]=4 1199 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,1,0,0,0,0|2,0,0]=3 1200 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [0,1,0,0,0,0|3,0,0]=4 1201 B9R0.48 CNCC(=O)CCC(C)C Amb28050435 [0,1,0,0,0,0|2,0,1]=4 1202 B9R0.48 CNCC(=O)CCN(C)C Amb33272624 [0,1,0,0,0,0|3,0,0]=4 1203 B9R0.48 CNCC(=O)NCC(=O)O Amb19010138 [0,1,0,0,0,0|1,0,0]=2 1204 B9R0.48 CNCC(=O)NCC(C)O Amb9360232 [0,1,0,0,0,0|2,0,1]=4 1205 B9R0.48 CNCC(=O)NNC(C)=O Amb27458705 [0,1,0,0,0,0|3,0,0]=4 1206 B9R0.48 CNOC(=O)CCC(=O)O Amb28126710 [0,1,0,0,0,0|1,0,0]=2 1207 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,1,0,0,0,0|1,0,0]=2 1208 B9R0.48 COCC(=O)COC(C)=O Amb27599018 [0,1,0,0,0,0|3,0,0]=4 1209 B9R0.48 COCC(=O)NCC(=O)O Amb1118442 [0,1,0,0,0,0|2,0,0]=3 1210 B9R0.48 COCC(=O)OCC(N)=O Amb27456203 [0,1,0,0,0,0|3,0,0]=4 1211 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [0,1,0,0,0,0|2,0,1]=4 1212 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [0,1,0,0,0,0|2,0,1]=4 1213 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [0,1,0,0,0,0|1,0,2]=4 1214 B9R0.48 CONC(=O)CCC(=O)O Amb27839045 [0,1,0,0,0,0|2,0,0]=3 1215 B9R0.48 CSCC(=O)NCC(N)=O Amb28189006 [0,1,0,0,0,0|3,0,0]=4 1216 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [0,1,0,0,0,0|2,0,1]=4 1217 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [0,1,0,0,0,0|1,0,2]=4 1218 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,1,0,0,0,0|1,0,2]=4 1219 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,1,0,0,0,0|2,0,1]=4 1220 B9R0.48 C\C(=C/CO)CCC(=O)O Amb27630663 [0,1,0,0,0,0|2,0,0]=3 1221 B9R0.48 C\C=C\C(=O)NCC(=O)O Amb9719598 [0,1,0,0,0,0|2,0,1]=4 1222 B9R0.48 C\C=C\C(=O)SCC(=O)O Amb27400187 [0,1,0,0,0,0|2,0,1]=4 1223 B9R0.48 C\C=N\C(=O)CCC(=O)O Amb27217285 [0,1,0,0,0,0|1,0,1]=3 1224 B9R0.48 N#CCC(=O)CCC(=O)O Amb24053663 [0,1,0,0,0,0|0,0,1]=2 1225 B9R0.48 N#CCC(=O)NCC(N)=O Amb6270334 [0,1,0,0,0,0|2,0,1]=4 1226 B9R0.48 N#CCS(=O)CCC(N)=O Amb27655959 [0,1,0,0,0,0|2,0,1]=4 1227 B9R0.48 N#C\C=C(/N)CCC(=O)O Amb24053667 [0,1,0,0,0,0|1,0,2]=4 1228 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [0,1,0,0,0,0|2,0,1]=4 1229 B9R0.48 NCCC(=O)NCC(=O)O Amb28555431 [0,1,0,0,0,0|1,0,0]=2 1230 B9R0.48 NCCC(=O)NCC(=O)O Amb4035945 [0,1,0,0,0,0|1,0,0]=2 1231 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [0,1,0,0,0,0|1,0,1]=3 1232 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [0,1,0,0,0,0|0,0,0]=1 1233 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [0,1,0,0,0,0|2,0,1]=4 1234 B9R0.48 O=C(O)CCC(=O)NCO Amb28132582 [0,1,0,0,0,0|1,0,0]=2 1235 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [0,1,0,0,0,0|1,0,2]=4 1236 B9R0.48 O=C(O)CNC(=O)C#CBr Amb27867573 [0,1,0,0,0,0|2,0,1]=4 1237 B9R0.48 O=C(O)\C=C\C(=O)NCO Amb28346249 [0,1,0,0,0,0|1,0,2]=4 1238 B9R0.48 O=CCC(=O)CCC(=O)O Amb18644074 [0,1,0,0,0,0|1,0,0]=2 1239 B9R0.48 [N-]=[N+]=NC(=O)CCC(N)=O Amb24477439 [0,1,0,0,0,0|2,0,1]=4 1240 B9R0.64 C=CS(=O)(=O)CCC(=O)O Amb27201337 [0,1,0,0,0,0|2,0,1]=4 1241 B9R0.64 CC(=O)CCS(=O)(=O)CF Amb27793848 [0,1,0,0,0,0|3,0,0]=4 1242 B9R0.64 CC(=O)NCP(=O)(O)CN Amb28367174 [0,1,0,0,0,0|3,0,0]=4 1243 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,1,0,0,0,0|1,0,1]=3 1244 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,1,0,0,0,0|2,0,1]=4 1245 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,1,0,0,0,0|2,0,1]=4 1246 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,1,0,0,0,0|2,0,1]=4 1247 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,1,0,0,0,0|1,0,2]=4 1248 B9R0.64 CCP(N)(=O)CCC(N)=O Amb27975054 [0,1,0,0,0,0|3,0,0]=4 1249 B9R0.64 CCS(=O)(=O)CCC(=O)O Amb6266853 [0,1,0,0,0,0|2,0,0]=3 1250 B9R0.64 CCS(=O)(=O)CCC(C)=O Amb28189559 [0,1,0,0,0,0|3,0,0]=4 1251 B9R0.64 CCS(=O)(=O)CCC(N)=O Amb28315921 [0,1,0,0,0,0|3,0,0]=4 1252 B9R0.64 CCS(=O)(=O)NCC(=O)O Amb1112815 [0,1,0,0,0,0|3,0,0]=4 1253 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,1,0,0,0,0|1,0,2]=4 1254 B9R0.64 CNS(=O)(=O)CCC(=O)O Amb6741778 [0,1,0,0,0,0|3,0,0]=4 1255 B9R0.64 NC(=O)CCS(=O)(=O)CCl Amb27489753 [0,1,0,0,0,0|3,0,0]=4 1256 B9R0.64 O=C(O)CCC(F)(F)CCl Amb27477848 [0,1,0,0,0,0|2,0,1]=4 1257 B9R0.64 O=C(O)CCC(F)(F)CO Amb33620699 [0,1,0,0,0,0|2,0,1]=4 1258 B9R0.64 O=C(O)CCP(=O)(O)CCl Amb27615065 [0,1,0,0,0,0|2,0,0]=3 1259 B9R0.64 O=C(O)CCS(=O)(=O)CF Amb27793811 [0,1,0,0,0,0|2,0,0]=3 1260 B9R0.64 O=C(O)CNS(=O)(=O)CBr Amb27219748 [0,1,0,0,0,0|3,0,0]=4 1261 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,0,0,1,0,0|2,0,1]=4 1262 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,0,0,1,0,0|2,0,1]=4 1263 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,0,0,1,0,0|2,0,1]=4 1264 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,0,0,1,0,0|2,0,1]=4 1265 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,0,0,1,0,0|2,0,1]=4 1266 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,0,0,1,0,0|2,0,1]=4 1267 B9R1.1 NNC1=NNC(=O)CC1 Amb28285103 [0,0,0,1,0,0|3,0,0]=4 1268 B9R1.1 O=C1CC=C(CO)CC1 Amb28253672 [0,0,0,1,0,0|3,0,0]=4 1269 B9R1.10 CC1(O)CCC(=O)CC1 Amb22235468 [0,0,0,1,0,0|2,0,1]=4 1270 B9R1.10 CP1(=O)CCC(=O)CC1 Amb26489398 [0,0,0,1,0,0|3,0,0]=4 1271 B9R1.10 N=S1(=O)CCC(=O)CC1 Amb28315233 [0,0,0,1,0,0|3,0,0]=4 1272 B9R1.10 O=C1CCP(=O)(O)CC1 Amb27838625 [0,0,0,1,0,0|2,0,0]=3 1273 B9R1.10 O=C1CCS(=O)(=O)CC1 Amb6358719 [0,0,0,1,0,0|2,0,1]=4 1274 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,0|2,0,0]=3 1275 B9R1.35 C=C1CCC(C(C)=O)C1 Amb27476121 [0,0,0,1,0,0|3,0,0]=4 1276 B9R1.35 C=C1CNC(C(N)=O)C1 Amb27640101 [0,0,0,1,0,0|2,0,0]=3 1277 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,0|1,0,0]=2 1278 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,0|1,0,0]=2 1279 B9R1.35 CC(=O)C1CCC(=O)C1 Amb24423910 [0,0,0,1,0,0|2,0,0]=3 1280 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [0,0,0,1,0,0|3,0,0]=4 1281 B9R1.35 CC(=O)C1CNC(=O)C1 Amb27488585 [0,0,0,1,0,0|3,0,0]=4 1282 B9R1.35 CC(=O)N1CCC(=O)C1 Amb18832698 [0,0,0,1,0,0|3,0,0]=4 1283 B9R1.35 CC(=O)[C@@H]1CCC(=O)C1 Amb24407171 [0,0,0,1,0,0|2,0,0]=3 1284 B9R1.35 CC(=O)[C@@H]1CCC(=O)N1 Amb27167616 [0,0,0,1,0,0|3,0,0]=4 1285 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,0|3,0,0]=4 1286 B9R1.35 CC(=O)[C@H]1CCC(=O)C1 Amb26590768 [0,0,0,1,0,0|2,0,0]=3 1287 B9R1.35 CC(=O)[C@H]1CCC(=O)N1 Amb27877407 [0,0,0,1,0,0|3,0,0]=4 1288 B9R1.35 CC(=O)[C@H]1COC(=O)C1 Amb18832647 [0,0,0,1,0,0|3,0,0]=4 1289 B9R1.35 CC(O)C1CC(=O)NN1 Amb28285281 [0,0,0,1,0,0|2,0,1]=4 1290 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,0|1,0,1]=3 1291 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,1,0,0|2,0,1]=4 1292 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,1,0,0|3,0,0]=4 1293 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,1,0,0|3,0,0]=4 1294 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,1,0,0|3,0,0]=4 1295 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,1,0,0|3,0,0]=4 1296 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,1,0,0|3,0,0]=4 1297 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,0|2,0,1]=4 1298 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [0,0,0,1,0,0|2,0,1]=4 1299 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,0|1,0,1]=3 1300 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,0|1,0,1]=3 1301 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,0|2,0,1]=4 1302 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,0,0,1,0,0|3,0,0]=4 1303 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,0,0,1,0,0|3,0,0]=4 1304 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,0,0,1,0,0|3,0,0]=4 1305 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,0,0,1,0,0|3,0,0]=4 1306 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,0,0,1,0,0|3,0,0]=4 1307 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NN1 Amb27632305 [0,0,0,1,0,0|2,0,1]=4 1308 B9R1.35 C[C@@H](O)[C@H]1CC(=O)NN1 Amb27422060 [0,0,0,1,0,0|2,0,1]=4 1309 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,0|2,0,1]=4 1310 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,0|2,0,1]=4 1311 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,0|1,0,1]=3 1312 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,0|1,0,1]=3 1313 B9R1.35 C[C@H](O)[C@H]1CC(=O)NN1 Amb27789842 [0,0,0,1,0,0|2,0,1]=4 1314 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,0|1,0,1]=3 1315 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,0|1,0,1]=3 1316 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,1,0,0|2,0,1]=4 1317 B9R1.35 NC(=O)C1CC(F)CN1 Amb32666337 [0,0,0,1,0,0|2,0,1]=4 1318 B9R1.35 NC(=O)C1CC(O)CN1 Amb1152420 [0,0,0,1,0,0|1,0,2]=4 1319 B9R1.35 NC(=O)C1CC(O)CN1 Amb32668520 [0,0,0,1,0,0|1,0,2]=4 1320 B9R1.35 NC(=O)C1CCC(=O)N1 Amb17142856 [0,0,0,1,0,0|3,0,0]=4 1321 B9R1.35 NC(=O)C1CCC(=O)O1 Amb24466803 [0,0,0,1,0,0|3,0,0]=4 1322 B9R1.35 NC(=O)C1CNC(=O)C1 Amb1803351 [0,0,0,1,0,0|3,0,0]=4 1323 B9R1.35 NC(=O)C1CSC(=O)C1 Amb27837681 [0,0,0,1,0,0|3,0,0]=4 1324 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,1,0,0|2,0,1]=4 1325 B9R1.35 NC(=O)[C@@H]1CC(O)CN1 Amb28054059 [0,0,0,1,0,0|1,0,2]=4 1326 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 Amb4018786 [0,0,0,1,0,0|3,0,0]=4 1327 B9R1.35 NC(=O)[C@@H]1CCC(=O)O1 Amb25146823 [0,0,0,1,0,0|3,0,0]=4 1328 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,1,0,0|2,0,1]=4 1329 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,1,0,0|2,0,1]=4 1330 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,1,0,0|1,0,2]=4 1331 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb28985696 [0,0,0,1,0,0|1,0,2]=4 1332 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb10808100 [0,0,0,1,0,0|2,0,1]=4 1333 B9R1.35 NC(=O)[C@@H]1C[C@H](O)CN1 Amb27476480 [0,0,0,1,0,0|1,0,2]=4 1334 B9R1.35 NC(=O)[C@H]1CCC(=O)N1 Amb27961076 [0,0,0,1,0,0|3,0,0]=4 1335 B9R1.35 NC(=O)[C@H]1CCC(=O)O1 Amb26909560 [0,0,0,1,0,0|3,0,0]=4 1336 B9R1.35 NC(=O)[C@H]1C[C@@H](O)CN1 Amb27628841 [0,0,0,1,0,0|1,0,2]=4 1337 B9R1.35 NC(=O)[C@H]1C[C@H](F)CN1 Amb27205380 [0,0,0,1,0,0|2,0,1]=4 1338 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,1,0,0|1,0,2]=4 1339 B9R1.35 NC1=NC(C(=O)O)CC1 Amb32718833 [0,0,0,1,0,0|3,0,0]=4 1340 B9R1.35 NC1=N[C@@H](C(=O)O)CC1 Amb27202599 [0,0,0,1,0,0|3,0,0]=4 1341 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,0,0,1,0,0|2,0,1]=4 1342 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,0,0,1,0,0|2,0,1]=4 1343 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,0,0,1,0,0|1,0,1]=3 1344 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,0,0,1,0,0|2,0,1]=4 1345 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [0,0,0,1,0,0|2,0,1]=4 1346 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,0,0,1,0,0|2,0,1]=4 1347 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,0,0,1,0,0|2,0,1]=4 1348 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,0,0,1,0,0|2,0,1]=4 1349 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,0,0,1,0,0|2,0,1]=4 1350 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,0,0,1,0,0|2,0,1]=4 1351 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,0,0,1,0,0|1,0,1]=3 1352 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,0,0,1,0,0|1,0,1]=3 1353 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,0,0,1,0,0|1,0,1]=3 1354 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,0,0,1,0,0|1,0,1]=3 1355 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,0,0,1,0,0|2,0,1]=4 1356 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,0,0,1,0,0|2,0,1]=4 1357 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,0,0,1,0,0|2,0,1]=4 1358 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,0,0,1,0,0|2,0,1]=4 1359 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,0,0,1,0,0|2,0,1]=4 1360 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,0,0,1,0,0|1,0,1]=3 1361 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,0,0,1,0,0|1,0,1]=3 1362 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,0,0,1,0,0|1,0,1]=3 1363 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,0,0,1,0,0|2,0,1]=4 1364 B9R1.35 O=C(O)C1CC(Br)=NO1 Amb26852251 [0,0,0,1,0,0|3,0,0]=4 1365 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,0,0,1,0,0|1,0,1]=3 1366 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,0,0,1,0,0|1,0,1]=3 1367 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,0,0,1,0,0|1,0,1]=3 1368 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,1,0,0|0,0,2]=3 1369 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,1,0,0|0,0,2]=3 1370 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,1,0,0|0,0,2]=3 1371 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,0,0,1,0,0|1,0,2]=4 1372 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,0,0,1,0,0|2,0,1]=4 1373 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,0|2,0,1]=4 1374 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,0|2,0,1]=4 1375 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,1,0,0|1,0,2]=4 1376 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,0,0,1,0,0|1,1,1]=4 1377 B9R1.35 O=C(O)C1CSS(=O)C1 Amb27165800 [0,0,0,1,0,0|3,0,0]=4 1378 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,1,0,0|0,0,2]=3 1379 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,1,0,0|0,0,2]=3 1380 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,0,0,1,0,0|0,1,1]=3 1381 B9R1.35 O=C(O)[C@@H]1CCC(=S)N1 Amb26857015 [0,0,0,1,0,0|2,1,0]=4 1382 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,1,0,0|1,0,2]=4 1383 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,1,0,0|1,0,2]=4 1384 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,0,0,1,0,0|1,1,1]=4 1385 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,0,0,1,0,0|1,0,1]=3 1386 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,0,0,1,0,0|1,0,1]=3 1387 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,0,0,1,0,0|1,0,1]=3 1388 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,1,0,0|0,0,2]=3 1389 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,0,0,1,0,0|1,0,2]=4 1390 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,0|0,1,1]=3 1391 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,0,0,1,0,0|1,0,1]=3 1392 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,0,0,1,0,0|1,0,1]=3 1393 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,0,0,1,0,0|1,0,1]=3 1394 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,0,0,1,0,0|1,0,1]=3 1395 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,0|1,0,1]=3 1396 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,1,0,0|0,0,2]=3 1397 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,1,0,0|0,0,2]=3 1398 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,1,0,0|0,0,2]=3 1399 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,0,0,1,0,0|0,1,1]=3 1400 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,0,0,1,0,0|0,1,1]=3 1401 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,0,0,1,0,0|1,0,1]=3 1402 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,1,0,0|1,0,2]=4 1403 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,0,0,1,0,0|1,0,1]=3 1404 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,0,0,1,0,0|1,0,1]=3 1405 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,1,0,0|0,0,2]=3 1406 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,1,0,0|0,0,2]=3 1407 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,0,0,1,0,0|1,0,1]=3 1408 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,0,0,1,0,0|1,0,1]=3 1409 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,1,0,0|0,0,2]=3 1410 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,1,0,0|0,0,2]=3 1411 B9R1.35 O=C1C=C(C(=O)O)CC1 Amb13883804 [0,0,0,1,0,0|1,0,2]=4 1412 B9R1.35 O=C1C=C(C(=O)O)NN1 Amb18944048 [0,0,0,1,0,0|1,0,2]=4 1413 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,1,0,0|1,0,1]=3 1414 B9R1.35 O=C1C=CC(C(=O)O)N1 Amb27775192 [0,0,0,1,0,0|2,0,1]=4 1415 B9R1.35 O=C1CC(C(=O)O)=CN1 Amb18832707 [0,0,0,1,0,0|2,0,1]=4 1416 B9R1.35 O=C1CC(C(=O)O)=CO1 Amb3499387 [0,0,0,1,0,0|2,0,1]=4 1417 B9R1.35 O=C1CC(C(=O)O)=NN1 Amb18278720 [0,0,0,1,0,0|1,0,2]=4 1418 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,1,0,0|2,0,0]=3 1419 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,1,0,0|2,0,0]=3 1420 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,1,0,0|2,0,0]=3 1421 B9R1.35 O=C1CC(C(=O)O)NN1 Amb18642739 [0,0,0,1,0,0|1,0,0]=2 1422 B9R1.35 O=C1CCC(B(O)O)C1 Amb27866777 [0,0,0,1,0,0|2,0,1]=4 1423 B9R1.35 O=C1CCC(C(=O)Cl)C1 Amb25282784 [0,0,0,1,0,0|2,0,0]=3 1424 B9R1.35 O=C1CCC(C(=O)Cl)N1 Amb17142869 [0,0,0,1,0,0|3,0,0]=4 1425 B9R1.35 O=C1CCC(C(=O)Cl)O1 Amb24648754 [0,0,0,1,0,0|3,0,0]=4 1426 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,0|1,0,0]=2 1427 B9R1.35 O=C1CCC(C(=O)O)N1 Amb9703102 [0,0,0,1,0,0|2,0,0]=3 1428 B9R1.35 O=C1CCC(C(=O)O)O1 Amb20623076 [0,0,0,1,0,0|2,0,0]=3 1429 B9R1.35 O=C1CCC(C(=O)O)S1 Amb23439315 [0,0,0,1,0,0|2,0,0]=3 1430 B9R1.35 O=C1CCC(C(=O)[O-])N1 Amb8514777 [0,0,0,1,0,0|2,0,1]=4 1431 B9R1.35 O=C1CC[C@@H](C(=O)Cl)O1 Amb22388653 [0,0,0,1,0,0|3,0,0]=4 1432 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,0|1,0,0]=2 1433 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb1995036 [0,0,0,1,0,0|2,0,0]=3 1434 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 Amb24099403 [0,0,0,1,0,0|2,0,0]=3 1435 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 Amb2722887 [0,0,0,1,0,0|2,0,0]=3 1436 B9R1.35 O=C1CC[C@@H](C(=O)[O-])N1 Amb8395173 [0,0,0,1,0,0|2,0,1]=4 1437 B9R1.35 O=C1CC[C@H](C(=O)Cl)O1 Amb22747149 [0,0,0,1,0,0|3,0,0]=4 1438 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,0|1,0,0]=2 1439 B9R1.35 O=C1CC[C@H](C(=O)O)N1 Amb2694994 [0,0,0,1,0,0|2,0,0]=3 1440 B9R1.35 O=C1CC[C@H](C(=O)O)O1 Amb2720513 [0,0,0,1,0,0|2,0,0]=3 1441 B9R1.35 O=C1CN=C(C(=O)O)N1 Amb24387402 [0,0,0,1,0,0|1,0,2]=4 1442 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,0|0,0,0]=1 1443 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,0|0,0,0]=1 1444 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,0|0,0,0]=1 1445 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,0|0,0,0]=1 1446 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,1,0,0|1,0,0]=2 1447 B9R1.35 O=C1CSC(C(=O)Cl)O1 Amb25724287 [0,0,0,1,0,0|3,0,0]=4 1448 B9R1.35 O=C1CSC(C(=O)O)=N1 Amb27211941 [0,0,0,1,0,0|2,0,1]=4 1449 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,1,0,0|1,0,0]=2 1450 B9R1.35 O=C1CSC(C(=O)O)O1 Amb25063335 [0,0,0,1,0,0|2,0,0]=3 1451 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,1,0,0|2,0,0]=3 1452 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,1,0,0|2,0,0]=3 1453 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,1,0,0|2,0,0]=3 1454 B9R1.35 O=C1N=C(C(=O)O)NN1 Amb18944041 [0,0,0,1,0,0|2,0,1]=4 1455 B9R1.35 O=C1NC(C(=O)O)CO1 Amb15701690 [0,0,0,1,0,0|3,0,0]=4 1456 B9R1.35 O=C1NC(C(=O)O)CS1 Amb3319393 [0,0,0,1,0,0|3,0,0]=4 1457 B9R1.35 O=C1NCC(C(=O)O)N1 Amb2780032 [0,0,0,1,0,0|3,0,0]=4 1458 B9R1.35 O=C1NCC(C(=O)O)O1 Amb24112958 [0,0,0,1,0,0|3,0,0]=4 1459 B9R1.35 O=C1NCC(C(=O)O)S1 Amb24084914 [0,0,0,1,0,0|3,0,0]=4 1460 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 Amb3997304 [0,0,0,1,0,0|3,0,0]=4 1461 B9R1.35 O=C1NC[C@@H](C(=O)O)O1 Amb25146207 [0,0,0,1,0,0|3,0,0]=4 1462 B9R1.35 O=C1NC[C@H](C(=O)O)N1 Amb24079612 [0,0,0,1,0,0|3,0,0]=4 1463 B9R1.35 O=C1NC[C@H](C(=O)O)O1 Amb27771494 [0,0,0,1,0,0|3,0,0]=4 1464 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 Amb24340149 [0,0,0,1,0,0|3,0,0]=4 1465 B9R1.35 O=C1N[C@@H](C(=O)O)CS1 Amb537246 [0,0,0,1,0,0|3,0,0]=4 1466 B9R1.35 O=C1N[C@H](C(=O)O)CO1 Amb19517080 [0,0,0,1,0,0|3,0,0]=4 1467 B9R1.35 O=C1N[C@H](C(=O)O)CS1 Amb1157856 [0,0,0,1,0,0|3,0,0]=4 1468 B9R1.35 O=C1OCC(C(=O)O)O1 Amb25767974 [0,0,0,1,0,0|3,0,0]=4 1469 B9R1.35 O=C1SCC(C(=O)O)S1 Amb23504458 [0,0,0,1,0,0|3,0,0]=4 1470 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,0,0,1,0,0|2,0,1]=4 1471 B9R1.46 O=C(O)CCC1=C(Br)C1 Amb27650642 [0,0,0,1,0,0|2,0,1]=4 1472 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,0,0,1,0,0|3,0,0]=4 1473 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,0,1,0,0|2,0,1]=4 1474 B9R1.49 O=C1CCC(=O)COC1 Amb2707216 [0,0,0,1,0,0|2,0,0]=3 1475 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,0,0,1,0,0|1,0,2]=4 1476 B9R1.49 O=C1CCCS(=O)CC1 Amb26476534 [0,0,0,1,0,0|3,0,0]=4 1477 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,0,0,1,0,0|2,0,1]=4 1478 B9R1.49 O=C1CCNC(=O)CC1 Amb22490261 [0,0,0,1,0,0|2,0,0]=3 1479 B9R1.49 O=C1CCS(=O)CCN1 Amb26480169 [0,0,0,1,0,0|3,0,0]=4 1480 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,0,0,1,0,0|2,0,1]=4 1481 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,0,0,1,0,0|2,0,1]=4 1482 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,0,0,1,0,0|2,0,1]=4 1483 B9R1.49 O=C1COC(=O)CCN1 Amb27168286 [0,0,0,1,0,0|3,0,0]=4 1484 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,0,0,1,0,0|1,0,0]=2 1485 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,0,0,1,0,0|2,0,1]=4 1486 B9R1.55 NC(=O)C1NC(=O)C1N Amb27445718 [0,0,0,1,0,0|2,0,0]=3 1487 B9R1.55 NC1C(=O)NC1C(=O)O Amb25871338 [0,0,0,1,0,0|1,0,0]=2 1488 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,0,0,1,0,0|0,0,2]=3 1489 B9R1.67 NC(=O)CN1CCC1=O Amb28049662 [0,0,0,1,0,0|3,0,0]=4 1490 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,0,0,1,0,0|2,0,1]=4 1491 B9R1.69 CC1=CC(=O)CCC1=O Amb28455194 [0,0,0,1,0,0|2,0,1]=4 1492 B9R1.69 CC1CC(=O)CCS1=O Amb28461149 [0,0,0,1,0,0|3,0,0]=4 1493 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,0,0,1,0,0|2,0,1]=4 1494 B9R1.69 CC1NC(=O)CCC1=O Amb27874094 [0,0,0,1,0,0|2,0,0]=3 1495 B9R1.69 CC1NC(=O)CNC1=O Amb24477892 [0,0,0,1,0,0|3,0,0]=4 1496 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [0,0,0,1,0,0|3,0,0]=4 1497 B9R1.69 CC1OC(=O)C=CC1=O Amb27948593 [0,0,0,1,0,0|1,0,2]=4 1498 B9R1.69 CC1OC(=O)CCC1Br Amb27875143 [0,0,0,1,0,0|2,0,1]=4 1499 B9R1.69 CC1OC(=O)COC1=O Amb27421415 [0,0,0,1,0,0|2,0,0]=3 1500 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,0,0,1,0,0|3,0,0]=4 1501 B9R1.69 CN1CCC(=O)C(N)C1 Amb18832618 [0,0,0,1,0,0|3,0,0]=4 1502 B9R1.69 C[C@@H]1NC(=O)CNC1=O Amb22233064 [0,0,0,1,0,0|3,0,0]=4 1503 B9R1.69 C[C@@H]1NC(=O)COC1=O Amb28059067 [0,0,0,1,0,0|3,0,0]=4 1504 B9R1.69 C[C@@H]1OC(O)CCC1=O Amb28351368 [0,0,0,1,0,0|1,0,2]=4 1505 B9R1.69 C[C@H]1C[C@@H](O)CCC1=O Amb28253634 [0,0,0,1,0,0|2,0,1]=4 1506 B9R1.69 C[C@H]1NC(=O)CNC1=O Amb25726602 [0,0,0,1,0,0|3,0,0]=4 1507 B9R1.69 C[C@H]1OC(=O)C=CC1=O Amb28351021 [0,0,0,1,0,0|1,0,2]=4 1508 B9R1.69 NC1=NC(=O)NCC1=O Amb21963698 [0,0,0,1,0,0|2,0,1]=4 1509 B9R1.69 NC1CC(O)CCC1=O Amb28430066 [0,0,0,1,0,0|1,0,1]=3 1510 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,0,0,1,0,0|2,0,1]=4 1511 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,0,0,1,0,0|2,0,1]=4 1512 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,0,0,1,0,0|2,0,1]=4 1513 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,0,0,1,0,0|2,0,1]=4 1514 B9R1.69 O=C1CCC(=O)C(Br)C1 Amb25775016 [0,0,0,1,0,0|2,0,0]=3 1515 B9R1.69 O=C1CCC(=O)C(Cl)C1 Amb24452362 [0,0,0,1,0,0|2,0,0]=3 1516 B9R1.69 O=C1CCC(=O)N(P)C1 Amb25854386 [0,0,0,1,0,0|2,1,0]=4 1517 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,0,0,1,0,0|2,0,1]=4 1518 B9R1.69 O=C1CCS(=O)CC1O Amb29847922 [0,0,0,1,0,0|3,0,0]=4 1519 B9R1.69 O=C1CNC(=O)C(Br)N1 Amb26341108 [0,0,0,1,0,0|3,0,0]=4 1520 B9R1.69 O=C1CNC(=O)C(O)N1 Amb27204459 [0,0,0,1,0,0|3,0,0]=4 1521 B9R1.78 CC1CC1CC(=O)CN Amb33132711 [0,0,0,1,0,0|2,0,1]=4 1522 B9R1.80 NCC(=O)CCC1CC1 Amb25245782 [0,0,0,1,0,0|2,0,1]=4 1523 B9R1.80 NCC(=O)CCC1CO1 Amb33307827 [0,0,0,1,0,0|1,0,1]=3 1524 B9R1.82 C=C1CN(C(=O)CN)C1 Amb35625953 [0,0,0,1,0,0|3,0,0]=4 1525 B9R1.82 CC(CO)C1CC(=O)O1 Amb28315511 [0,0,0,1,0,0|2,0,1]=4 1526 B9R1.82 CC1CC(C(=O)CN)C1 Amb30032039 [0,0,0,1,0,0|2,0,1]=4 1527 B9R1.82 CCC(Br)C1CC(=O)O1 Amb27636202 [0,0,0,1,0,0|2,0,1]=4 1528 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,0,0,1,0,0|3,0,0]=4 1529 B9R1.82 COC(=O)C1CC(=O)N1 Amb24711580 [0,0,0,1,0,0|3,0,0]=4 1530 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Amb22747568 [0,0,0,1,0,0|3,0,0]=4 1531 B9R1.82 NCC(=O)N1CC(O)C1 Amb28049187 [0,0,0,1,0,0|2,0,1]=4 1532 B9R1.82 NNC(=O)C1CC(=O)C1 Amb28049790 [0,0,0,1,0,0|2,0,0]=3 1533 B9R1.82 O=C1CC(C(=O)NO)C1 Amb27163827 [0,0,0,1,0,0|3,0,0]=4 1534 B9R1.84 CC(=O)CCC1CNC1 Amb33307594 [0,0,0,1,0,0|2,0,1]=4 1535 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,0,0,1,0,0|2,0,1]=4 1536 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,0,0,1,0,0|1,0,2]=4 1537 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [0,0,0,1,0,0|3,0,0]=4 1538 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,0,0,1,0,0|2,0,1]=4 1539 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,0,0,1,0,0|3,0,0]=4 1540 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,0,0,1,0,0|2,0,1]=4 1541 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,0,0,1,0,0|2,0,1]=4 1542 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,0,0,1,0,0|2,0,1]=4 1543 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,0,0,1,0,0|2,0,1]=4 1544 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,0,0,1,0,0|2,0,1]=4 1545 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,0,0,1,0,0|2,0,1]=4 1546 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,0,0,1,0,0|3,0,0]=4 1547 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,0,0,1,0,0|1,0,1]=3 1548 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,0,0,1,0,0|1,0,1]=3 1549 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,0,0,1,0,0|1,0,1]=3 1550 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,0,0,1,0,0|1,0,1]=3 1551 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,0,0,1,0,0|1,0,1]=3 1552 B9R1.95 NN=C1CC(C(=O)O)C1 Amb23570285 [0,0,0,1,0,0|2,0,0]=3 1553 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,0,0,1,0,0|2,0,1]=4 1554 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,0,0,1,0,0|2,0,1]=4 1555 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,0,0,1,0,0|2,0,1]=4 1556 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,0,0,1,0,0|2,0,1]=4 1557 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,0,0,1,0,0|2,0,1]=4 1558 B9R1.125 CC1(CN)CCC(=O)N1 Amb28935017 [0,0,0,1,0,0|2,0,1]=4 1559 B9R1.125 CC1(CN)CCC(=O)O1 Amb27815595 [0,0,0,1,0,0|1,0,1]=3 1560 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,0,0,1,0,0|1,0,1]=3 1561 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,0,0,1,0,0|2,0,1]=4 1562 B9R1.138 CC1(O)CCC(=O)C1O Amb28128781 [0,0,0,1,0,0|2,0,1]=4 1563 B9R1.138 CC1C(=O)CCS1(=O)=O Amb27751418 [0,0,0,1,0,0|2,0,1]=4 1564 B9R1.138 C[C@H]1C(=O)CC[C@@]1(C)O Amb28194858 [0,0,0,1,0,0|2,0,1]=4 1565 B9R1.138 O=C1CCS(=O)(=O)C1Br Amb24122669 [0,0,0,1,0,0|2,0,1]=4 1566 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,0,0,1,0,0|2,0,1]=4 1567 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,0,0,1,0,0|2,0,1]=4 1568 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,0,0,1,0,0|2,0,1]=4 1569 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,0,0,1,0,0|2,0,1]=4 1570 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,0,0,1,0,0|1,0,2]=4 1571 B7R0.2 C#CC(=O)CC(C)=O Amb27453576 [0,0,0,0,1,0|2,0,1]=4 1572 B7R0.2 C=C(C)CC(=O)CC Amb27600284 [0,0,0,0,1,0|3,0,0]=4 1573 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,0,0,0,1,0|2,0,0]=3 1574 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [0,0,0,0,1,0|3,0,0]=4 1575 B7R0.2 C=CC(=O)CC(C)=O Amb27470884 [0,0,0,0,1,0|2,0,1]=4 1576 B7R0.2 CC(=O)CC(=O)C#N Amb25328629 [0,0,0,0,1,0|1,0,2]=4 1577 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [0,0,0,0,1,0|2,0,0]=3 1578 B7R0.2 CC(=O)CC(C)CN Amb18251072 [0,0,0,0,1,0|2,0,1]=4 1579 B7R0.2 CC(=O)C\C(C)=N\N Amb28048941 [0,0,0,0,1,0|3,0,0]=4 1580 B7R0.2 CC(=O)NC(=O)CBr Amb33541733 [0,0,0,0,1,0|3,0,0]=4 1581 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [0,0,0,0,1,0|3,0,0]=4 1582 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [0,0,0,0,1,0|2,0,0]=3 1583 B7R0.2 CC(=O)OC(=O)CCl Amb27977084 [0,0,0,0,1,0|3,0,0]=4 1584 B7R0.2 CC(=O)OC(=O)CN Amb28240797 [0,0,0,0,1,0|2,0,0]=3 1585 B7R0.2 CC(C)CC(=O)CN Amb18641847 [0,0,0,0,1,0|2,0,1]=4 1586 B7R0.2 CC(C)CC(=O)CN Amb30982570 [0,0,0,0,1,0|2,0,1]=4 1587 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,0,0,0,1,0|2,0,1]=4 1588 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,0,0,0,1,0|2,0,1]=4 1589 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,0,0,0,1,0|2,0,1]=4 1590 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,0,0,0,1,0|1,0,1]=3 1591 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,0,0,0,1,0|1,0,1]=3 1592 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,0,0,0,1,0|1,0,1]=3 1593 B7R0.2 CC(CN)CC(N)=O Amb18641899 [0,0,0,0,1,0|2,0,1]=4 1594 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,0,0,0,1,0|2,0,1]=4 1595 B7R0.2 CC(Cl)CC(=O)CN Amb28048961 [0,0,0,0,1,0|2,0,1]=4 1596 B7R0.2 CC(Cl)CC(=O)CN Amb33473605 [0,0,0,0,1,0|2,0,1]=4 1597 B7R0.2 CC(O)CC(=O)NN Amb6548973 [0,0,0,0,1,0|2,0,1]=4 1598 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,0,0,0,1,0|1,0,0]=2 1599 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,0,0,0,1,0|2,0,0]=3 1600 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,0,0,0,1,0|2,0,0]=3 1601 B7R0.2 CCC(=O)CC(O)O Amb28316114 [0,0,0,0,1,0|1,0,2]=4 1602 B7R0.2 CCC(=O)CS(C)=O Amb27464042 [0,0,0,0,1,0|3,0,0]=4 1603 B7R0.2 CCC(=O)C[C@@H](C)O Amb28316195 [0,0,0,0,1,0|2,0,1]=4 1604 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [0,0,0,0,1,0|3,0,0]=4 1605 B7R0.2 CCC(=O)NC(N)=O Amb27643460 [0,0,0,0,1,0|3,0,0]=4 1606 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [0,0,0,0,1,0|3,0,0]=4 1607 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,0,0,0,1,0|2,0,1]=4 1608 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,0,0,0,1,0|2,0,1]=4 1609 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,0,0,0,1,0|2,0,1]=4 1610 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,0,0,0,1,0|1,0,2]=4 1611 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,0,0,0,1,0|3,0,0]=4 1612 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,0,0,0,1,0|3,0,0]=4 1613 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,0,0,0,1,0|2,0,1]=4 1614 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,1,0|2,0,0]=3 1615 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [0,0,0,0,1,0|3,0,0]=4 1616 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [0,0,0,0,1,0|3,0,0]=4 1617 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,0,0,0,1,0|2,0,1]=4 1618 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,0,0,0,1,0|2,0,1]=4 1619 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,0,0,0,1,0|2,0,1]=4 1620 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,0,0,0,1,0|1,0,2]=4 1621 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,0,0,0,1,0|2,0,1]=4 1622 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,0,0,0,1,0|2,0,1]=4 1623 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,0,0,0,1,0|2,0,1]=4 1624 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,0,0,0,1,0|1,0,2]=4 1625 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,0,0,0,1,0|2,0,1]=4 1626 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,0,0,0,1,0|2,0,1]=4 1627 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,0,0,0,1,0|2,0,1]=4 1628 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,0,0,0,1,0|2,0,1]=4 1629 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,0,0,0,1,0|2,0,1]=4 1630 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,0,0,0,1,0|1,0,2]=4 1631 B7R0.2 CN(CO)CC(=O)O Amb27663224 [0,0,0,0,1,0|3,0,0]=4 1632 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [0,0,0,0,1,0|2,0,0]=3 1633 B7R0.2 CNC(=O)CC(=O)[O-] Amb35747299 [0,0,0,0,1,0|2,0,1]=4 1634 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [0,0,0,0,1,0|3,0,0]=4 1635 B7R0.2 COC(=O)CC(=O)Cl Amb3939073 [0,0,0,0,1,0|3,0,0]=4 1636 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,0,0,0,1,0|2,0,0]=3 1637 B7R0.2 COC(=O)CC(=O)[O-] Amb2780363 [0,0,0,0,1,0|2,0,1]=4 1638 B7R0.2 COC(=O)CC(=O)[O-] Amb34915950 [0,0,0,0,1,0|2,0,1]=4 1639 B7R0.2 COC(=O)CC(C)=O Amb6608655 [0,0,0,0,1,0|3,0,0]=4 1640 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,0,0,0,1,0|3,0,0]=4 1641 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,0,0,0,1,0|1,0,1]=3 1642 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,0,0,0,1,0|1,0,1]=3 1643 B7R0.2 C[C@@H](O)CC(=O)NN Amb27452910 [0,0,0,0,1,0|2,0,1]=4 1644 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,0,0,0,1,0|1,0,1]=3 1645 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,0,0,0,1,0|1,0,1]=3 1646 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,0,0,0,1,0|2,0,1]=4 1647 B7R0.2 C[C@H](O)CC(=O)NN Amb27409334 [0,0,0,0,1,0|2,0,1]=4 1648 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [0,0,0,0,1,0|2,0,1]=4 1649 B7R0.2 C\C(=C/C(N)=O)CN Amb28288035 [0,0,0,0,1,0|2,0,1]=4 1650 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [0,0,0,0,1,0|3,0,0]=4 1651 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [0,0,0,0,1,0|2,0,1]=4 1652 B7R0.2 NC(=O)CC(=O)CCl Amb27797889 [0,0,0,0,1,0|2,0,0]=3 1653 B7R0.2 NC(=O)CC(=O)NO Amb28348925 [0,0,0,0,1,0|3,0,0]=4 1654 B7R0.2 NC(=O)NC(=O)CBr Amb24104085 [0,0,0,0,1,0|3,0,0]=4 1655 B7R0.2 NC(=O)NC(=O)CCl Amb362395 [0,0,0,0,1,0|3,0,0]=4 1656 B7R0.2 NC(=O)NC(=O)CF Amb27838299 [0,0,0,0,1,0|3,0,0]=4 1657 B7R0.2 NC(=O)NC(=O)CS Amb27390052 [0,0,0,0,1,0|3,0,0]=4 1658 B7R0.2 NC(CF)CC(=O)O Amb24428065 [0,0,0,0,1,0|2,0,1]=4 1659 B7R0.2 NC(CS)CC(=O)O Amb25090412 [0,0,0,0,1,0|2,0,1]=4 1660 B7R0.2 NCC(=O)C[PH](=O)O Amb27257536 [0,0,0,0,1,0|1,0,0]=2 1661 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [0,0,0,0,1,0|2,0,1]=4 1662 B7R0.2 NCC(N)CC(=O)O Amb19515145 [0,0,0,0,1,0|1,0,1]=3 1663 B7R0.2 NCC(N)CC(=O)O Amb21858324 [0,0,0,0,1,0|1,0,1]=3 1664 B7R0.2 NCC(N)CC(N)=O Amb27603845 [0,0,0,0,1,0|2,0,1]=4 1665 B7R0.2 NCC(O)CC(=O)O Amb32663899 [0,0,0,0,1,0|0,0,2]=3 1666 B7R0.2 NCC(O)CC(=O)O Amb33544754 [0,0,0,0,1,0|0,0,2]=3 1667 B7R0.2 NCC(O)CS(=O)O Amb27831981 [0,0,0,0,1,0|1,0,2]=4 1668 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [0,0,0,0,1,0|1,0,1]=3 1669 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [0,0,0,0,1,0|2,0,1]=4 1670 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [0,0,0,0,1,0|2,0,1]=4 1671 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [0,0,0,0,1,0|1,0,1]=3 1672 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [0,0,0,0,1,0|0,0,2]=3 1673 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [0,0,0,0,1,0|0,0,2]=3 1674 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [0,0,0,0,1,0|1,0,2]=4 1675 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [0,0,0,0,1,0|1,0,2]=4 1676 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [0,0,0,0,1,0|2,0,1]=4 1677 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [0,0,0,0,1,0|0,0,2]=3 1678 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [0,0,0,0,1,0|1,0,1]=3 1679 B7R0.2 NNC(=O)CC(=O)O Amb25073925 [0,0,0,0,1,0|1,0,0]=2 1680 B7R0.2 NNC(=O)CC(N)=O Amb1980864 [0,0,0,0,1,0|2,0,0]=3 1681 B7R0.2 NNC(=O)CC(N)=O Amb27660515 [0,0,0,0,1,0|2,0,0]=3 1682 B7R0.2 NNC(=O)C[N+](=O)[O-] Amb1102120 [0,0,0,0,1,0|2,0,1]=4 1683 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [0,0,0,0,1,0|2,0,1]=4 1684 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [0,0,0,0,1,0|2,0,1]=4 1685 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [0,0,0,0,1,0|2,0,1]=4 1686 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [0,0,0,0,1,0|2,0,1]=4 1687 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [0,0,0,0,1,0|3,0,0]=4 1688 B7R0.2 O=C(Cl)CC(=O)CCl Amb17593874 [0,0,0,0,1,0|2,0,0]=3 1689 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [0,0,0,0,1,0|1,0,0]=2 1690 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [0,0,0,0,1,0|1,0,2]=4 1691 B7R0.2 O=C(O)CC(O)CF Amb26557587 [0,0,0,0,1,0|1,0,2]=4 1692 B7R0.2 O=C(O)CC(O)CO Amb28120003 [0,0,0,0,1,0|1,0,2]=4 1693 B7R0.2 O=C(O)CC(O)CS Amb27244674 [0,0,0,0,1,0|1,0,2]=4 1694 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [0,0,0,0,1,0|1,0,2]=4 1695 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [0,0,0,0,1,0|1,0,2]=4 1696 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [0,0,0,0,1,0|1,0,2]=4 1697 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [0,0,0,0,1,0|1,0,2]=4 1698 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [0,0,0,0,1,0|1,0,2]=4 1699 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [0,0,0,0,1,0|2,0,1]=4 1700 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [0,0,0,0,1,0|2,0,1]=4 1701 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [0,0,0,0,1,0|1,0,2]=4 1702 B9R0.1 C#CC(=O)NOCC(=O)O Amb27399796 [0,0,0,0,0,1|2,0,1]=4 1703 B9R0.1 C#C\C(C)=C\CCC(=O)O Amb27461397 [0,0,0,0,0,1|2,0,1]=4 1704 B9R0.1 C=C(C)CCNC(=O)CCl Amb27974797 [0,0,0,0,0,1|3,0,0]=4 1705 B9R0.1 C=C(C)CCNC(=O)CS Amb28144813 [0,0,0,0,0,1|3,0,0]=4 1706 B9R0.1 C=C(C)CCOC(=O)CC Amb27770403 [0,0,0,0,0,1|3,0,0]=4 1707 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,0,0,0,0,1|3,0,0]=4 1708 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,0,0,0,0,1|2,0,0]=3 1709 B9R0.1 C=C(CCl)CSCC(N)=O Amb28126890 [0,0,0,0,0,1|3,0,0]=4 1710 B9R0.1 C=C(CN)CSCC(N)=O Amb27599887 [0,0,0,0,0,1|2,0,0]=3 1711 B9R0.1 C=C(CO)CCOC(C)=O Amb28322751 [0,0,0,0,0,1|3,0,0]=4 1712 B9R0.1 C=C(CS)CSCC(N)=O Amb27494256 [0,0,0,0,0,1|3,0,0]=4 1713 B9R0.1 C=CC(=O)CCCC(=O)O Amb27770363 [0,0,0,0,0,1|1,0,1]=3 1714 B9R0.1 C=CC(=O)CCCC(C)=O Amb27409542 [0,0,0,0,0,1|2,0,1]=4 1715 B9R0.1 C=CC(=O)NCCC(=O)O Amb6257105 [0,0,0,0,0,1|1,0,1]=3 1716 B9R0.1 C=CC(=O)NCCC(=O)[O-] Amb20668483 [0,0,0,0,0,1|1,0,2]=4 1717 B9R0.1 C=CC(=O)NCCC(N)=O Amb9481014 [0,0,0,0,0,1|2,0,1]=4 1718 B9R0.1 C=CC(=O)OCCC(=O)O Amb18644058 [0,0,0,0,0,1|1,0,1]=3 1719 B9R0.1 CC(=O)CCCC(=N)NN Amb25146305 [0,0,0,0,0,1|3,0,0]=4 1720 B9R0.1 CC(=O)CCCC(=O)NO Amb27980256 [0,0,0,0,0,1|3,0,0]=4 1721 B9R0.1 CC(=O)NCCC(N)CN Amb27838083 [0,0,0,0,0,1|2,0,1]=4 1722 B9R0.1 CC(=O)NCC[C@@H](N)CN Amb28073891 [0,0,0,0,0,1|2,0,1]=4 1723 B9R0.1 CC(=O)NCNC(=O)CO Amb27243935 [0,0,0,0,0,1|3,0,0]=4 1724 B9R0.1 CC(=O)SCCC(=O)CCl Amb24436675 [0,0,0,0,0,1|2,0,0]=3 1725 B9R0.1 CC(C)=CCCC(=O)CCl Amb27173844 [0,0,0,0,0,1|3,0,0]=4 1726 B9R0.1 CC(C)=CCCC(=O)CF Amb28249661 [0,0,0,0,0,1|3,0,0]=4 1727 B9R0.1 CC(C)CCCC(=O)CN Amb28197069 [0,0,0,0,0,1|2,0,1]=4 1728 B9R0.1 CC(C)CCNC(=O)CN Amb5783141 [0,0,0,0,0,1|2,0,1]=4 1729 B9R0.1 CC(C)CCOC(=O)CN Amb17569860 [0,0,0,0,0,1|2,0,1]=4 1730 B9R0.1 CC(C)CNCC(=O)CN Amb27781669 [0,0,0,0,0,1|2,0,1]=4 1731 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,0,0,0,0,1|1,0,1]=3 1732 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,0,0,0,0,1|1,0,1]=3 1733 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,0,0,0,0,1|1,0,1]=3 1734 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,0,0,0,0,1|1,0,1]=3 1735 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,0,0,0,0,1|2,0,1]=4 1736 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,0,0,0,0,1|2,0,1]=4 1737 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,0,0,0,0,1|2,0,1]=4 1738 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,0,0,0,0,1|2,0,1]=4 1739 B9R0.1 CC(O)CCNC(=O)CS Amb28120401 [0,0,0,0,0,1|2,0,1]=4 1740 B9R0.1 CCC(=N)NCCC(N)=O Amb27181001 [0,0,0,0,0,1|3,0,0]=4 1741 B9R0.1 CCC(=O)CCC[N+](=O)[O-] Amb27636062 [0,0,0,0,0,1|2,0,1]=4 1742 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,0,0,0,0,1|1,0,0]=2 1743 B9R0.1 CCC(=O)NCCC(C)=O Amb17102869 [0,0,0,0,0,1|2,0,0]=3 1744 B9R0.1 CCC(=O)NCCC(N)=O Amb17231982 [0,0,0,0,0,1|2,0,0]=3 1745 B9R0.1 CCC(=O)NCCC(N)=S Amb17232333 [0,0,0,0,0,1|2,1,0]=4 1746 B9R0.1 CCC(=O)NOCC(N)=O Amb27390237 [0,0,0,0,0,1|3,0,0]=4 1747 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,0,0,0,0,1|1,0,0]=2 1748 B9R0.1 CCC(=O)OCOC(=O)Cl Amb25212596 [0,0,0,0,0,1|3,0,0]=4 1749 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,0,0,0,0,1|1,0,0]=2 1750 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,0,0,0,0,1|2,0,1]=4 1751 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,0,0,0,0,1|2,0,1]=4 1752 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,0,0,0,0,1|2,0,1]=4 1753 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,0,0,0,0,1|1,0,2]=4 1754 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,0,0,0,0,1|1,0,2]=4 1755 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [0,0,0,0,0,1|2,0,1]=4 1756 B9R0.1 CCS(=O)CCNC(C)=O Amb27616407 [0,0,0,0,0,1|3,0,0]=4 1757 B9R0.1 CCS(=O)CCNC(N)=O Amb27806812 [0,0,0,0,0,1|3,0,0]=4 1758 B9R0.1 CCS(=O)NOCC(=O)O Amb27249429 [0,0,0,0,0,1|3,0,0]=4 1759 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,0,0,0,0,1|2,0,1]=4 1760 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,0,0,0,0,1|2,0,0]=3 1761 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,0,0,0,0,1|3,0,0]=4 1762 B9R0.1 CN(C)CCNC(=O)CN Amb5783037 [0,0,0,0,0,1|3,0,0]=4 1763 B9R0.1 CNC(=N)NCCC(=O)O Amb26014274 [0,0,0,0,0,1|3,0,0]=4 1764 B9R0.1 CNC(=O)CCCC(=O)[O-] Amb24271120 [0,0,0,0,0,1|2,0,1]=4 1765 B9R0.1 CNC(=O)CNCC(=O)O Amb8943036 [0,0,0,0,0,1|2,0,0]=3 1766 B9R0.1 CNC(=O)CNCC(C)=O Amb27789643 [0,0,0,0,0,1|3,0,0]=4 1767 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,0,0,0,0,1|2,0,0]=3 1768 B9R0.1 CNC(=O)CSCC(=O)O Amb6251930 [0,0,0,0,0,1|2,0,0]=3 1769 B9R0.1 CNC(=O)CSCC(N)=O Amb27170981 [0,0,0,0,0,1|3,0,0]=4 1770 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,0,0,0,0,1|2,0,0]=3 1771 B9R0.1 CNC(=O)NOCC(=O)O Amb27970392 [0,0,0,0,0,1|3,0,0]=4 1772 B9R0.1 COC(=O)CCCC(=O)Cl Amb3939328 [0,0,0,0,0,1|3,0,0]=4 1773 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,0,0,0,0,1|2,0,0]=3 1774 B9R0.1 COC(=O)CCCC(=O)[O-] Amb33948529 [0,0,0,0,0,1|2,0,1]=4 1775 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,0,0,0,0,1|3,0,0]=4 1776 B9R0.1 COC(=O)CCCC(N)=O Amb27882411 [0,0,0,0,0,1|3,0,0]=4 1777 B9R0.1 COC(=O)CCNC(C)=O Amb15691935 [0,0,0,0,0,1|3,0,0]=4 1778 B9R0.1 COC(=O)CCNC(N)=O Amb22740124 [0,0,0,0,0,1|3,0,0]=4 1779 B9R0.1 COC(=O)CCOC(C)=O Amb27972208 [0,0,0,0,0,1|3,0,0]=4 1780 B9R0.1 COC(=O)CCSC(=O)Cl Amb26446360 [0,0,0,0,0,1|3,0,0]=4 1781 B9R0.1 COC(=O)CCSC(N)=O Amb28254662 [0,0,0,0,0,1|3,0,0]=4 1782 B9R0.1 COC(=O)CNCC(=O)O Amb7766422 [0,0,0,0,0,1|2,0,0]=3 1783 B9R0.1 COC(=O)COCC(=O)O Amb25305044 [0,0,0,0,0,1|2,0,0]=3 1784 B9R0.1 COC(=O)COCC(C)=O Amb8392403 [0,0,0,0,0,1|3,0,0]=4 1785 B9R0.1 COC(=O)CSCC(=O)O Amb33532171 [0,0,0,0,0,1|2,0,0]=3 1786 B9R0.1 COC(=O)CSCC(C)=O Amb2444691 [0,0,0,0,0,1|3,0,0]=4 1787 B9R0.1 COC(=O)NCCC(=O)O Amb6468177 [0,0,0,0,0,1|2,0,0]=3 1788 B9R0.1 COC(=O)OCCC(C)=O Amb28049880 [0,0,0,0,0,1|3,0,0]=4 1789 B9R0.1 COC(=S)SCCC(=O)O Amb27983821 [0,0,0,0,0,1|2,1,0]=4 1790 B9R0.1 CS(=O)CCNC(=O)CCl Amb27852973 [0,0,0,0,0,1|3,0,0]=4 1791 B9R0.1 CS(=O)CCNC(=O)CN Amb27451738 [0,0,0,0,0,1|2,0,0]=3 1792 B9R0.1 CSC(=N)NCCC(=O)O Amb28193743 [0,0,0,0,0,1|3,0,0]=4 1793 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,0,0,0,0,1|3,0,0]=4 1794 B9R0.1 C\C(CCl)=N/OCC(=O)O Amb27831952 [0,0,0,0,0,1|3,0,0]=4 1795 B9R0.1 C\C(CF)=N/OCC(=O)O Amb27174879 [0,0,0,0,0,1|3,0,0]=4 1796 B9R0.1 N=C(CN)NCCC(=O)O Amb28346899 [0,0,0,0,0,1|1,0,0]=2 1797 B9R0.1 NC(=O)CCNC(=O)CBr Amb27786158 [0,0,0,0,0,1|2,0,0]=3 1798 B9R0.1 NC(=O)CCNC(=O)CCl Amb9415901 [0,0,0,0,0,1|2,0,0]=3 1799 B9R0.1 NC(=O)CCNC(=O)CS Amb27981235 [0,0,0,0,0,1|2,0,0]=3 1800 B9R0.1 NC(=O)CCOC(=O)CO Amb28136694 [0,0,0,0,0,1|2,0,0]=3 1801 B9R0.1 NC(=O)CONC(=O)CCl Amb27945304 [0,0,0,0,0,1|3,0,0]=4 1802 B9R0.1 NC(=O)CSCC(=O)NO Amb27764593 [0,0,0,0,0,1|3,0,0]=4 1803 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [0,0,0,0,0,1|2,0,1]=4 1804 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,0,0,0,0,1|0,0,0]=1 1805 B9R0.1 NCC(=O)CNCB(O)O Amb24591556 [0,0,0,0,0,1|1,0,1]=3 1806 B9R0.1 NCC(=O)CNCC(=O)O Amb27979091 [0,0,0,0,0,1|0,0,0]=1 1807 B9R0.1 NCC(=O)NCC=C(Cl)Cl Amb29857483 [0,0,0,0,0,1|2,0,1]=4 1808 B9R0.1 NCC(=O)NCCC(=O)O Amb4018061 [0,0,0,0,0,1|0,0,0]=1 1809 B9R0.1 NCC(=O)NCCC(F)F Amb27760867 [0,0,0,0,0,1|2,0,1]=4 1810 B9R0.1 NCC(=O)NNCC(N)=O Amb28313796 [0,0,0,0,0,1|2,0,0]=3 1811 B9R0.1 NCC(=O)ONCC(=O)O Amb27625948 [0,0,0,0,0,1|1,0,0]=2 1812 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [0,0,0,0,0,1|1,0,1]=3 1813 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [0,0,0,0,0,1|2,0,1]=4 1814 B9R0.1 N\C(CNCC(=O)O)=N/O Amb27881601 [0,0,0,0,0,1|3,0,0]=4 1815 B9R0.1 N\N=C(/N)NCCC(=O)O Amb24682101 [0,0,0,0,0,1|2,0,0]=3 1816 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,0,0,0,0,1|1,0,0]=2 1817 B9R0.1 O=C(O)CCCC(=O)NO Amb27494720 [0,0,0,0,0,1|2,0,0]=3 1818 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [0,0,0,0,0,1|2,0,1]=4 1819 B9R0.1 O=C(O)CCNC(=O)CBr Amb17609911 [0,0,0,0,0,1|1,0,0]=2 1820 B9R0.1 O=C(O)CCNC(=O)CCl Amb2781692 [0,0,0,0,0,1|1,0,0]=2 1821 B9R0.1 O=C(O)CCNC(=O)CO Amb24478846 [0,0,0,0,0,1|1,0,0]=2 1822 B9R0.1 O=C(O)CCS\C(Cl)=C\Cl Amb27797305 [0,0,0,0,0,1|2,0,1]=4 1823 B9R0.1 O=C(O)CSCC(O)CCl Amb27858669 [0,0,0,0,0,1|1,0,2]=4 1824 B9R0.1 O=C(O)\C=C\NC(=O)CCl Amb27494076 [0,0,0,0,0,1|1,0,2]=4 1825 B6R0.1 C#CCC(=O)CN Amb27970357 [2,0,0,0,0,0|0,0,2]=4 1826 B6R0.1 C=C(CC)CCO Amb25261191 [2,0,0,0,0,0|2,0,0]=4 1827 B6R0.1 C=C(CN)CCC Amb33204217 [2,0,0,0,0,0|1,0,1]=4 1828 B6R0.1 C=C(CN)CCF Amb33480629 [2,0,0,0,0,0|2,0,0]=4 1829 B6R0.1 C=C(CO)CCO Amb25825219 [2,0,0,0,0,0|2,0,0]=4 1830 B6R0.1 C=CCC(=O)CC Amb27173052 [2,0,0,0,0,0|1,0,1]=4 1831 B6R0.1 C=CCC(=O)CN Amb32410102 [2,0,0,0,0,0|0,0,1]=3 1832 B6R0.1 CC(CN)CCO Amb17506271 [2,0,0,0,0,0|1,0,1]=4 1833 B6R0.1 CCC(=O)CCBr Amb27401869 [2,0,0,0,0,0|2,0,0]=4 1834 B6R0.1 CCC(=O)CCI Amb27232362 [2,0,0,0,0,0|2,0,0]=4 1835 B6R0.1 CCC(=O)CCN Amb18202790 [2,0,0,0,0,0|2,0,0]=4 1836 B6R0.1 CCC(=O)CCO Amb26872941 [2,0,0,0,0,0|1,0,0]=3 1837 B6R0.1 CCC(=O)CCS Amb24733984 [2,0,0,0,0,0|1,1,0]=4 1838 B6R0.1 CCC(=O)CNO Amb27434221 [2,0,0,0,0,0|2,0,0]=4 1839 B6R0.1 CCC(=O)NCO Amb27235623 [2,0,0,0,0,0|2,0,0]=4 1840 B6R0.1 CCCC(=O)CBr Amb24433274 [2,0,0,0,0,0|1,0,1]=4 1841 B6R0.1 CCCC(=O)CC Amb8513390 [2,0,0,0,0,0|1,0,1]=4 1842 B6R0.1 CCCC(=O)CCl Amb19372924 [2,0,0,0,0,0|1,0,1]=4 1843 B6R0.1 CCCC(=O)CI Amb27876205 [2,0,0,0,0,0|1,0,1]=4 1844 B6R0.1 CCCC(=O)CN Amb17593086 [2,0,0,0,0,0|0,0,1]=3 1845 B6R0.1 CCCC(=O)CN Amb28827644 [2,0,0,0,0,0|0,0,1]=3 1846 B6R0.1 CCCC(=O)CO Amb25125092 [2,0,0,0,0,0|1,0,1]=4 1847 B6R0.1 CCCC(=O)NN Amb6366352 [2,0,0,0,0,0|1,0,1]=4 1848 B6R0.1 CCNC(=O)CN Amb21956656 [2,0,0,0,0,0|1,0,1]=4 1849 B6R0.1 CCNC(=O)CN Amb426696 [2,0,0,0,0,0|1,0,1]=4 1850 B6R0.1 CCOC(=O)CN Amb2697340 [2,0,0,0,0,0|1,0,1]=4 1851 B6R0.1 CCOC(=O)CN Amb8513174 [2,0,0,0,0,0|1,0,1]=4 1852 B6R0.1 CCS(=O)CCO Amb10669566 [2,0,0,0,0,0|2,0,0]=4 1853 B6R0.1 CNC(=O)CCO Amb10608414 [2,0,0,0,0,0|2,0,0]=4 1854 B6R0.1 COC(=O)CC=O Amb18199826 [2,0,0,0,0,0|2,0,0]=4 1855 B6R0.1 COC(=O)CCO Amb8855137 [2,0,0,0,0,0|2,0,0]=4 1856 B6R0.1 COCC(=O)CN Amb18833134 [2,0,0,0,0,0|1,0,1]=4 1857 B6R0.1 CSC(=O)CCO Amb27662309 [2,0,0,0,0,0|2,0,0]=4 1858 B6R0.1 CSCC(=O)CN Amb33225415 [2,0,0,0,0,0|1,0,1]=4 1859 B6R0.1 C\C(=C/CO)CN Amb27252403 [2,0,0,0,0,0|1,0,1]=4 1860 B6R0.1 C\C(CCO)=N/N Amb28453929 [2,0,0,0,0,0|2,0,0]=4 1861 B6R0.1 NCC(=O)CCF Amb26604148 [2,0,0,0,0,0|1,0,0]=3 1862 B6R0.1 NCC(=O)OCCl Amb27204265 [2,0,0,0,0,0|2,0,0]=4 1863 B6R0.1 NCC(N)CCO Amb19514523 [2,0,0,0,0,0|1,0,1]=4 1864 B6R0.1 NCC(N)CCO Amb32661503 [2,0,0,0,0,0|1,0,1]=4 1865 B6R0.1 NCC(O)CCO Amb22011571 [2,0,0,0,0,0|0,0,2]=4 1866 B6R0.1 NCCC(=O)CF Amb33377162 [2,0,0,0,0,0|2,0,0]=4 1867 B6R0.1 NCCC(=O)CN Amb18121893 [2,0,0,0,0,0|1,0,0]=3 1868 B6R0.1 NCCC(=O)NN Amb18559344 [2,0,0,0,0,0|2,0,0]=4 1869 B6R0.1 NC[C@@H](O)CCO Amb28191136 [2,0,0,0,0,0|0,0,2]=4 1870 B6R0.1 NC[C@H](N)CCO Amb32661173 [2,0,0,0,0,0|1,0,1]=4 1871 B6R0.1 NC\C(I)=C\CO Amb27783357 [2,0,0,0,0,0|1,0,1]=4 1872 B6R0.1 NNC(=O)CCO Amb20622339 [2,0,0,0,0,0|1,0,0]=3 1873 B6R0.1 NNC(=O)CCS Amb20622690 [2,0,0,0,0,0|1,1,0]=4 1874 B6R0.1 O=C(CBr)CCBr Amb26567374 [2,0,0,0,0,0|2,0,0]=4 1875 B6R0.1 O=C(CBr)CCCl Amb27984732 [2,0,0,0,0,0|2,0,0]=4 1876 B6R0.1 O=C(CBr)NCO Amb25286051 [2,0,0,0,0,0|2,0,0]=4 1877 B6R0.1 O=C(CCl)CCCl Amb22395038 [2,0,0,0,0,0|2,0,0]=4 1878 B6R0.1 O=C(CCl)CCF Amb33413998 [2,0,0,0,0,0|2,0,0]=4 1879 B6R0.1 O=C(CCl)NCO Amb1153096 [2,0,0,0,0,0|2,0,0]=4 1880 B6R0.1 O=C(CF)CCF Amb28424077 [2,0,0,0,0,0|2,0,0]=4 1881 B6R0.1 O=C(CF)NCO Amb27625787 [2,0,0,0,0,0|2,0,0]=4 1882 B6R0.1 O=C(CO)CCO Amb10603377 [2,0,0,0,0,0|1,0,0]=3 1883 B6R0.1 O=C(CO)NCO Amb27593459 [2,0,0,0,0,0|2,0,0]=4 1884 B6R0.1 O=CC(=O)CCO Amb28050238 [2,0,0,0,0,0|1,0,1]=4 1885 B6R0.1 O=COC(=O)CO Amb27457699 [2,0,0,0,0,0|2,0,0]=4 1886 B6R0.4 C#CCCC(=O)O Amb33532622 [2,0,0,0,0,0|0,0,2]=4 1887 B6R0.4 C#CCCC(C)=O Amb8869638 [2,0,0,0,0,0|1,0,1]=4 1888 B6R0.4 C=C(Br)CCCN Amb27219336 [2,0,0,0,0,0|2,0,0]=4 1889 B6R0.4 C=C(C)CCCN Amb24761452 [2,0,0,0,0,0|2,0,0]=4 1890 B6R0.4 C=C(C)CCCN Amb33534233 [2,0,0,0,0,0|2,0,0]=4 1891 B6R0.4 C=C(C)CCCO Amb22886814 [2,0,0,0,0,0|1,0,1]=4 1892 B6R0.4 C=C(Cl)CCCN Amb27413032 [2,0,0,0,0,0|2,0,0]=4 1893 B6R0.4 C=C=CCC(=O)O Amb26657414 [2,0,0,0,0,0|1,0,1]=4 1894 B6R0.4 C=CCCC(=C)C Amb22228883 [2,0,0,0,0,0|2,0,0]=4 1895 B6R0.4 C=CCCC(=N)N Amb25326954 [2,0,0,0,0,0|2,0,0]=4 1896 B6R0.4 C=CCCC(=O)Cl Amb3939003 [2,0,0,0,0,0|1,0,1]=4 1897 B6R0.4 C=CCCC(=O)O Amb3940112 [2,0,0,0,0,0|0,0,1]=3 1898 B6R0.4 C=CCCC(C)=O Amb2721704 [2,0,0,0,0,0|1,0,0]=3 1899 B6R0.4 C=CCCC(N)=O Amb28136349 [2,0,0,0,0,0|1,0,0]=3 1900 B6R0.4 C=CCNC(C)=O Amb5797445 [2,0,0,0,0,0|2,0,0]=4 1901 B6R0.4 C=CCNC(N)=O Amb6599864 [2,0,0,0,0,0|2,0,0]=4 1902 B6R0.4 C=CCOC(N)=O Amb4017585 [2,0,0,0,0,0|2,0,0]=4 1903 B6R0.4 C=CNCC(=O)O Amb28346027 [2,0,0,0,0,0|1,0,1]=4 1904 B6R0.4 C=COCC(=O)O Amb27247261 [2,0,0,0,0,0|1,0,1]=4 1905 B6R0.4 C=COCC(C)=O Amb27838258 [2,0,0,0,0,0|2,0,0]=4 1906 B6R0.4 CC#CCC(=O)O Amb17939740 [2,0,0,0,0,0|0,0,2]=4 1907 B6R0.4 CC(=O)CC#CO Amb27463647 [2,0,0,0,0,0|0,0,2]=4 1908 B6R0.4 CC(=O)CCC#N Amb17334046 [2,0,0,0,0,0|1,0,1]=4 1909 B6R0.4 CC(=O)CCC=O Amb18639597 [2,0,0,0,0,0|0,0,0]=2 1910 B6R0.4 CC(=O)CCCBr Amb8394105 [2,0,0,0,0,0|1,0,1]=4 1911 B6R0.4 CC(=O)CCCCl Amb3940272 [2,0,0,0,0,0|1,0,1]=4 1912 B6R0.4 CC(=O)CCCF Amb25068187 [2,0,0,0,0,0|1,0,1]=4 1913 B6R0.4 CC(=O)CCCN Amb18121547 [2,0,0,0,0,0|1,0,0]=3 1914 B6R0.4 CC(=O)CCCN Amb32661221 [2,0,0,0,0,0|1,0,0]=3 1915 B6R0.4 CC(=O)CCCN Amb32661286 [2,0,0,0,0,0|1,0,0]=3 1916 B6R0.4 CC(=O)CCCO Amb3940340 [2,0,0,0,0,0|0,0,1]=3 1917 B6R0.4 CC(=O)C\C=N\O Amb27750272 [2,0,0,0,0,0|1,0,1]=4 1918 B6R0.4 CC(=O)NCC=O Amb25757509 [2,0,0,0,0,0|1,0,0]=3 1919 B6R0.4 CC(=O)NCCN Amb1218225 [2,0,0,0,0,0|2,0,0]=4 1920 B6R0.4 CC(=O)NCCO Amb2720909 [2,0,0,0,0,0|1,0,1]=4 1921 B6R0.4 CC(=O)OCCN Amb18121947 [2,0,0,0,0,0|2,0,0]=4 1922 B6R0.4 CC(=O)OCCN Amb28827650 [2,0,0,0,0,0|2,0,0]=4 1923 B6R0.4 CC(=O)OCCO Amb3941004 [2,0,0,0,0,0|1,0,1]=4 1924 B6R0.4 CC(=O)SCC=O Amb27873378 [2,0,0,0,0,0|1,0,0]=3 1925 B6R0.4 CC(=O)SCCN Amb21953963 [2,0,0,0,0,0|2,0,0]=4 1926 B6R0.4 CC(=O)SCCN Amb22011516 [2,0,0,0,0,0|2,0,0]=4 1927 B6R0.4 CC(=O)SCCN Amb31291049 [2,0,0,0,0,0|2,0,0]=4 1928 B6R0.4 CC(=O)SCCO Amb27481182 [2,0,0,0,0,0|1,0,1]=4 1929 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [2,0,0,0,0,0|0,0,2]=4 1930 B6R0.4 CC(C)=CCC=O Amb18120881 [2,0,0,0,0,0|1,0,1]=4 1931 B6R0.4 CC(C)CCC=O Amb17673735 [2,0,0,0,0,0|1,0,1]=4 1932 B6R0.4 CC(Cl)CCC=O Amb18124284 [2,0,0,0,0,0|1,0,1]=4 1933 B6R0.4 CC(O)CCC=O Amb17593090 [2,0,0,0,0,0|0,0,2]=4 1934 B6R0.4 CC(O)CCCN Amb8630414 [2,0,0,0,0,0|1,0,1]=4 1935 B6R0.4 CC=C=CC(=O)O Amb17593065 [2,0,0,0,0,0|0,0,2]=4 1936 B6R0.4 CCCCC(=O)Cl Amb3939066 [2,0,0,0,0,0|1,0,1]=4 1937 B6R0.4 CCCCC(=O)O Amb3939877 [2,0,0,0,0,0|0,0,1]=3 1938 B6R0.4 CCCCC(=O)[O-] Amb22056343 [2,0,0,0,0,0|0,0,2]=4 1939 B6R0.4 CCCCC(C)=O Amb6608652 [2,0,0,0,0,0|1,0,1]=4 1940 B6R0.4 CCCCC(N)=O Amb6891958 [2,0,0,0,0,0|1,0,1]=4 1941 B6R0.4 CCCC[PH](=O)O Amb8391286 [2,0,0,0,0,0|1,0,1]=4 1942 B6R0.4 CCNCC(=O)O Amb10609667 [2,0,0,0,0,0|1,0,1]=4 1943 B6R0.4 CCNCC(=O)O Amb7764661 [2,0,0,0,0,0|1,0,1]=4 1944 B6R0.4 CCOCC(=O)O Amb3939880 [2,0,0,0,0,0|1,0,1]=4 1945 B6R0.4 CCPCC(=O)O Amb28321137 [2,0,0,0,0,0|1,0,1]=4 1946 B6R0.4 CCSCC(=O)O Amb1125185 [2,0,0,0,0,0|1,0,1]=4 1947 B6R0.4 CC\C=C/C(=O)O Amb28429841 [2,0,0,0,0,0|1,0,1]=4 1948 B6R0.4 CC\C=C\C(=O)O Amb6608967 [2,0,0,0,0,0|1,0,1]=4 1949 B6R0.4 CN(C)CCC=O Amb22001057 [2,0,0,0,0,0|2,0,0]=4 1950 B6R0.4 CNCCC(=O)Cl Amb27422890 [2,0,0,0,0,0|2,0,0]=4 1951 B6R0.4 CNCCC(=O)O Amb10609760 [2,0,0,0,0,0|1,0,0]=3 1952 B6R0.4 CNCCC(=O)O Amb7766400 [2,0,0,0,0,0|1,0,0]=3 1953 B6R0.4 CNCCC(C)=O Amb24560306 [2,0,0,0,0,0|2,0,0]=4 1954 B6R0.4 CNCCC(C)=O Amb28827637 [2,0,0,0,0,0|2,0,0]=4 1955 B6R0.4 CNCCC(N)=O Amb19959913 [2,0,0,0,0,0|2,0,0]=4 1956 B6R0.4 CNCCC(N)=O Amb33538309 [2,0,0,0,0,0|2,0,0]=4 1957 B6R0.4 COCCC(=O)Cl Amb2689274 [2,0,0,0,0,0|2,0,0]=4 1958 B6R0.4 COCCC(=O)O Amb3938990 [2,0,0,0,0,0|1,0,0]=3 1959 B6R0.4 COCCC(C)=O Amb7764907 [2,0,0,0,0,0|2,0,0]=4 1960 B6R0.4 COCCC(N)=O Amb33538943 [2,0,0,0,0,0|2,0,0]=4 1961 B6R0.4 CS(=O)CCCN Amb18974527 [2,0,0,0,0,0|2,0,0]=4 1962 B6R0.4 CS(=O)CCCN Amb32684177 [2,0,0,0,0,0|2,0,0]=4 1963 B6R0.4 CSCCC(=O)O Amb3939879 [2,0,0,0,0,0|1,0,0]=3 1964 B6R0.4 CSCCC(C)=O Amb8392858 [2,0,0,0,0,0|2,0,0]=4 1965 B6R0.4 CSSCC(=O)O Amb25378801 [2,0,0,0,0,0|2,0,0]=4 1966 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [2,0,0,0,0,0|1,0,1]=4 1967 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [2,0,0,0,0,0|1,0,1]=4 1968 B6R0.4 C[C@H](O)CCC=O Amb27188424 [2,0,0,0,0,0|0,0,2]=4 1969 B6R0.4 C\C=C\CC(=O)O Amb3941538 [2,0,0,0,0,0|0,0,1]=3 1970 B6R0.4 C\C=C\CC(N)=O Amb26589975 [2,0,0,0,0,0|1,0,1]=4 1971 B6R0.4 N#CCCC(=O)O Amb2694975 [2,0,0,0,0,0|0,0,2]=4 1972 B6R0.4 N#CCCC(N)=O Amb8841150 [2,0,0,0,0,0|1,0,1]=4 1973 B6R0.4 N=C(N)CCCN Amb25888970 [2,0,0,0,0,0|2,0,0]=4 1974 B6R0.4 N=C(N)CCCN Amb33299271 [2,0,0,0,0,0|2,0,0]=4 1975 B6R0.4 N=C(N)CCCO Amb33038287 [2,0,0,0,0,0|1,0,1]=4 1976 B6R0.4 N=CNCC(=O)O Amb24670244 [2,0,0,0,0,0|1,0,1]=4 1977 B6R0.4 NC(=O)CCCCl Amb1138237 [2,0,0,0,0,0|1,0,1]=4 1978 B6R0.4 NC(=O)CCCF Amb28073400 [2,0,0,0,0,0|1,0,1]=4 1979 B6R0.4 NC(=O)CCCO Amb20623438 [2,0,0,0,0,0|0,0,1]=3 1980 B6R0.4 NC(=O)CCCS Amb27174778 [2,0,0,0,0,0|0,1,1]=4 1981 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [2,0,0,0,0,0|1,0,1]=4 1982 B6R0.4 NC(=O)NCCO Amb1146041 [2,0,0,0,0,0|1,0,1]=4 1983 B6R0.4 NC(=O)NNC=O Amb27874930 [2,0,0,0,0,0|2,0,0]=4 1984 B6R0.4 NC(=O)OCCO Amb20623788 [2,0,0,0,0,0|1,0,1]=4 1985 B6R0.4 NC(=S)CCCO Amb9215001 [2,0,0,0,0,0|0,1,1]=4 1986 B6R0.4 NC(=S)CNC=O Amb24479904 [2,0,0,0,0,0|1,1,0]=4 1987 B6R0.4 NCC#CC(=O)O Amb25703096 [2,0,0,0,0,0|0,0,2]=4 1988 B6R0.4 NCC#CC(=O)O Amb32666878 [2,0,0,0,0,0|0,0,2]=4 1989 B6R0.4 NCCCB(O)O Amb25878196 [2,0,0,0,0,0|1,0,1]=4 1990 B6R0.4 NCCCB(O)O Amb33339111 [2,0,0,0,0,0|1,0,1]=4 1991 B6R0.4 NCCCC(=O)Cl Amb1935063 [2,0,0,0,0,0|1,0,0]=3 1992 B6R0.4 NCCCC(=O)O Amb1935210 [2,0,0,0,0,0|0,0,0]=2 1993 B6R0.4 NCCCC(N)=O Amb2099583 [2,0,0,0,0,0|1,0,0]=3 1994 B6R0.4 NCCCC(N)=O Amb6543438 [2,0,0,0,0,0|1,0,0]=3 1995 B6R0.4 NCCCS(=O)O Amb25185942 [2,0,0,0,0,0|1,0,0]=3 1996 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [2,0,0,0,0,0|1,0,1]=4 1997 B6R0.4 NCCC[PH](=O)O Amb22370049 [2,0,0,0,0,0|1,0,0]=3 1998 B6R0.4 NCCNC(N)=O Amb19374121 [2,0,0,0,0,0|2,0,0]=4 1999 B6R0.4 NCCNC(N)=O Amb32665340 [2,0,0,0,0,0|2,0,0]=4 2000 B6R0.4 NCCNC(N)=O Amb6254968 [2,0,0,0,0,0|2,0,0]=4 2001 B6R0.4 NCCOC(N)=O Amb22059480 [2,0,0,0,0,0|2,0,0]=4 2002 B6R0.4 NCCOC(N)=O Amb24271076 [2,0,0,0,0,0|2,0,0]=4 2003 B6R0.4 NCCOS(=O)O Amb25843211 [2,0,0,0,0,0|2,0,0]=4 2004 B6R0.4 NCCO[PH](=O)O Amb28046334 [2,0,0,0,0,0|2,0,0]=4 2005 B6R0.4 NC\C=C/C(=O)O Amb24117018 [2,0,0,0,0,0|0,0,1]=3 2006 B6R0.4 NC\C=C\C(=O)O Amb33422010 [2,0,0,0,0,0|0,0,1]=3 2007 B6R0.4 NC\C=C\C(=O)O Amb33422035 [2,0,0,0,0,0|0,0,1]=3 2008 B6R0.4 NNCCC(=O)O Amb33756816 [2,0,0,0,0,0|1,0,0]=3 2009 B6R0.4 NOCCC(=O)O Amb17569891 [2,0,0,0,0,0|1,0,0]=3 2010 B6R0.4 NOCCC(=O)O Amb32693437 [2,0,0,0,0,0|1,0,0]=3 2011 B6R0.4 NOCCC(N)=O Amb27838275 [2,0,0,0,0,0|2,0,0]=4 2012 B6R0.4 O=C(Br)CCCBr Amb25724818 [2,0,0,0,0,0|2,0,0]=4 2013 B6R0.4 O=C(Cl)CCCBr Amb3940241 [2,0,0,0,0,0|2,0,0]=4 2014 B6R0.4 O=C(Cl)CCCCl Amb6608638 [2,0,0,0,0,0|2,0,0]=4 2015 B6R0.4 O=C(O)CCCBr Amb8393276 [2,0,0,0,0,0|1,0,0]=3 2016 B6R0.4 O=C(O)CCCCl Amb3940333 [2,0,0,0,0,0|1,0,0]=3 2017 B6R0.4 O=C(O)CCCF Amb17593104 [2,0,0,0,0,0|1,0,0]=3 2018 B6R0.4 O=C(O)CCCI Amb22295911 [2,0,0,0,0,0|1,0,0]=3 2019 B6R0.4 O=C(O)CCCO Amb18640332 [2,0,0,0,0,0|1,0,0]=3 2020 B6R0.4 O=C(O)CCCS Amb16185429 [2,0,0,0,0,0|1,0,0]=3 2021 B6R0.4 O=C(O)CCNO Amb28067767 [2,0,0,0,0,0|1,0,1]=4 2022 B6R0.4 O=C(O)CCSCl Amb28387511 [2,0,0,0,0,0|2,0,0]=4 2023 B6R0.4 O=C(O)COCF Amb33378705 [2,0,0,0,0,0|2,0,0]=4 2024 B6R0.4 O=C(O)CPCO Amb28340565 [2,0,0,0,0,0|2,0,0]=4 2025 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [2,0,0,0,0,0|1,0,1]=4 2026 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [2,0,0,0,0,0|1,0,1]=4 2027 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [2,0,0,0,0,0|1,0,1]=4 2028 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [2,0,0,0,0,0|1,0,1]=4 2029 B6R0.4 O=C(O)\C=C\CF Amb33470171 [2,0,0,0,0,0|1,0,1]=4 2030 B6R0.4 O=C(O)\C=C\CO Amb32662006 [2,0,0,0,0,0|1,0,1]=4 2031 B6R0.4 O=C([O-])CCCO Amb3429667 [2,0,0,0,0,0|1,0,1]=4 2032 B6R0.4 O=CCCC(=O)O Amb17673897 [2,0,0,0,0,0|0,0,0]=2 2033 B6R0.4 O=CCCC(O)O Amb27838257 [2,0,0,0,0,0|0,0,2]=4 2034 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [2,0,0,0,0,0|1,0,1]=4 2035 B6R0.4 O=CNCC(=O)O Amb1911508 [2,0,0,0,0,0|1,0,0]=3 2036 B6R0.4 O=COCC(=O)O Amb26624011 [2,0,0,0,0,0|1,0,0]=3 2037 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [2,0,0,0,0,0|0,0,2]=4 2038 B6R0.4 O=[PH](O)CCCO Amb28345330 [2,0,0,0,0,0|2,0,0]=4 2039 B6R0.6 C=C=CCCC=O Amb28208489 [2,0,0,0,0,0|1,0,1]=4 2040 B6R0.6 C=CCCCCN Amb18639514 [2,0,0,0,0,0|1,0,1]=4 2041 B6R0.6 CCCCCC=O Amb3939522 [2,0,0,0,0,0|1,0,1]=4 2042 B6R0.6 CCOCCC=O Amb25688261 [2,0,0,0,0,0|2,0,0]=4 2043 B6R0.6 CCSCCC=O Amb27254551 [2,0,0,0,0,0|2,0,0]=4 2044 B6R0.6 CC\C=C/CC=O Amb18639157 [2,0,0,0,0,0|1,0,1]=4 2045 B6R0.6 C\C=C/CCC=O Amb28202620 [2,0,0,0,0,0|1,0,1]=4 2046 B6R0.6 C\C=C\CCC=O Amb17593074 [2,0,0,0,0,0|1,0,1]=4 2047 B6R0.6 NCCCCC=O Amb26627836 [2,0,0,0,0,0|0,0,1]=3 2048 B6R0.6 NCCCCCO Amb3939337 [2,0,0,0,0,0|0,0,2]=4 2049 B6R0.6 NCCCCNO Amb24117989 [2,0,0,0,0,0|1,0,1]=4 2050 B6R0.6 NCCCCNO Amb27668394 [2,0,0,0,0,0|1,0,1]=4 2051 B6R0.6 NCCCNC=O Amb5723517 [2,0,0,0,0,0|1,0,1]=4 2052 B6R0.6 NC\C=C\CCO Amb27969293 [2,0,0,0,0,0|0,0,2]=4 2053 B6R0.6 O=CCCCCBr Amb18126353 [2,0,0,0,0,0|1,0,1]=4 2054 B6R0.6 O=CCCCCCl Amb18123550 [2,0,0,0,0,0|1,0,1]=4 2055 B6R0.6 O=CCCCCO Amb10603837 [2,0,0,0,0,0|1,0,1]=4 2056 B6R0.6 O=CCC\C=C/Br Amb27838206 [2,0,0,0,0,0|1,0,1]=4 2057 B6R0.6 O=CCC\C=C\Cl Amb27955198 [2,0,0,0,0,0|1,0,1]=4 2058 B8R0.1 C#CCCC(=O)CCN Amb27173378 [1,1,0,0,0,0|1,0,1]=4 2059 B8R0.1 C#CCCC(=O)CNC Amb27236588 [1,1,0,0,0,0|1,0,1]=4 2060 B8R0.1 C=C(CCO)CCC=O Amb28367058 [1,1,0,0,0,0|2,0,0]=4 2061 B8R0.1 C=CCCC(=O)CCC Amb9031599 [1,1,0,0,0,0|2,0,0]=4 2062 B8R0.1 C=CCCC(=O)OCC Amb10601809 [1,1,0,0,0,0|2,0,0]=4 2063 B8R0.1 C=CCNC(=O)CCN Amb5784976 [1,1,0,0,0,0|2,0,0]=4 2064 B8R0.1 C=CCNC(=O)CON Amb27465678 [1,1,0,0,0,0|2,0,0]=4 2065 B8R0.1 CCCC(=O)CCC=O Amb18642627 [1,1,0,0,0,0|1,0,0]=3 2066 B8R0.1 CCCC(=O)NCC=O Amb17102055 [1,1,0,0,0,0|2,0,0]=4 2067 B8R0.1 CCCCC(=O)CCN Amb28186730 [1,1,0,0,0,0|1,0,1]=4 2068 B8R0.1 CCCCC(=O)CNC Amb25824276 [1,1,0,0,0,0|1,0,1]=4 2069 B8R0.1 CCNC(=O)CCC=O Amb27665109 [1,1,0,0,0,0|1,0,0]=3 2070 B8R0.1 CCNC(=O)CCCO Amb17231872 [1,1,0,0,0,0|1,0,1]=4 2071 B8R0.1 CCOC(=O)CCC=O Amb17593369 [1,1,0,0,0,0|1,0,0]=3 2072 B8R0.1 CCOC(=O)CCCO Amb22733346 [1,1,0,0,0,0|1,0,1]=4 2073 B8R0.1 CCOC(=O)CCNO Amb27406192 [1,1,0,0,0,0|2,0,0]=4 2074 B8R0.1 CCOC(=O)CNC=O Amb16232466 [1,1,0,0,0,0|2,0,0]=4 2075 B8R0.1 CCSC(=O)CNC=O Amb27873219 [1,1,0,0,0,0|2,0,0]=4 2076 B8R0.1 CNCC(=O)CCOC Amb33377830 [1,1,0,0,0,0|2,0,0]=4 2077 B8R0.1 CNCC(=O)CCSC Amb33198762 [1,1,0,0,0,0|2,0,0]=4 2078 B8R0.1 CNCC(=O)NCCO Amb8866820 [1,1,0,0,0,0|1,0,1]=4 2079 B8R0.1 COCC(=O)CCC=O Amb28343164 [1,1,0,0,0,0|1,0,0]=3 2080 B8R0.1 COCC(=O)CCCO Amb27869244 [1,1,0,0,0,0|1,0,1]=4 2081 B8R0.1 COCCC(=O)CCN Amb33377832 [1,1,0,0,0,0|2,0,0]=4 2082 B8R0.1 CONC(=O)CCC=O Amb27837664 [1,1,0,0,0,0|2,0,0]=4 2083 B8R0.1 CSCCC(=O)CCN Amb33198765 [1,1,0,0,0,0|2,0,0]=4 2084 B8R0.1 C\C(=C/CCl)CCC=O Amb27622941 [1,1,0,0,0,0|2,0,0]=4 2085 B8R0.1 C\C(=C/CO)CCC=O Amb27827380 [1,1,0,0,0,0|2,0,0]=4 2086 B8R0.1 C\C(=C\CCl)CCC=O Amb27865820 [1,1,0,0,0,0|2,0,0]=4 2087 B8R0.1 C\C=C\C(=O)CCC=O Amb24610089 [1,1,0,0,0,0|1,0,1]=4 2088 B8R0.1 NOCC(=O)NCCO Amb27494090 [1,1,0,0,0,0|1,0,1]=4 2089 B8R0.3 C=CCC(O)C(=O)CC Amb27199094 [1,1,0,0,0,0|2,0,0]=4 2090 B8R0.3 C=CCN(C)C(=O)CN Amb17231854 [1,1,0,0,0,0|2,0,0]=4 2091 B8R0.3 CCC(=O)C(C)OC=O Amb27227136 [1,1,0,0,0,0|2,0,0]=4 2092 B8R0.3 CCC(=O)C(Cl)CCO Amb26477870 [1,1,0,0,0,0|1,0,1]=4 2093 B8R0.3 CCC(=O)N(C)CC=O Amb17080669 [1,1,0,0,0,0|2,0,0]=4 2094 B8R0.3 CCCC(C)C(=O)CN Amb25686985 [1,1,0,0,0,0|1,0,1]=4 2095 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [1,1,0,0,0,0|2,0,0]=4 2096 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [1,1,0,0,0,0|2,0,0]=4 2097 B8R0.6 C#CCCCC(=O)CN Amb27788268 [1,1,0,0,0,0|1,0,1]=4 2098 B8R0.6 C=CCCCC(=O)CBr Amb27966828 [1,1,0,0,0,0|2,0,0]=4 2099 B8R0.6 C=CCCCC(=O)CC Amb27249620 [1,1,0,0,0,0|2,0,0]=4 2100 B8R0.6 C=CCCOC(=O)CO Amb27487083 [1,1,0,0,0,0|2,0,0]=4 2101 B8R0.6 C=CCOCC(=O)CC Amb27181141 [1,1,0,0,0,0|2,0,0]=4 2102 B8R0.6 C=CCOCC(=O)CN Amb26046396 [1,1,0,0,0,0|1,0,0]=3 2103 B8R0.6 C=CCOCC(=O)CO Amb27256454 [1,1,0,0,0,0|2,0,0]=4 2104 B8R0.6 C=CCSCC(=C)CN Amb27222109 [1,1,0,0,0,0|2,0,0]=4 2105 B8R0.6 C=CCSCC(=O)CC Amb27856651 [1,1,0,0,0,0|2,0,0]=4 2106 B8R0.6 C=CCSCC(=O)NN Amb28121530 [1,1,0,0,0,0|2,0,0]=4 2107 B8R0.6 CCC(=O)CCCCO Amb27867195 [1,1,0,0,0,0|1,0,1]=4 2108 B8R0.6 CCC(=O)CSCCO Amb4165967 [1,1,0,0,0,0|1,0,1]=4 2109 B8R0.6 CCC(=O)NCCC=O Amb17102166 [1,1,0,0,0,0|1,0,0]=3 2110 B8R0.6 CCC(=O)NCCCO Amb5797471 [1,1,0,0,0,0|1,0,1]=4 2111 B8R0.6 CCC(=O)OCCCO Amb28138647 [1,1,0,0,0,0|1,0,1]=4 2112 B8R0.6 CCCCNC(=O)CN Amb21958688 [1,1,0,0,0,0|1,0,1]=4 2113 B8R0.6 CCCCNC(=O)CN Amb5783028 [1,1,0,0,0,0|1,0,1]=4 2114 B8R0.6 CCCCOC(=O)CN Amb19373374 [1,1,0,0,0,0|1,0,1]=4 2115 B8R0.6 CCCCOC(=O)CN Amb3939626 [1,1,0,0,0,0|1,0,1]=4 2116 B8R0.6 CCOCCC(=O)CN Amb27253736 [1,1,0,0,0,0|1,0,1]=4 2117 B8R0.6 CC\C(C)=C\CCC=O Amb28131737 [1,1,0,0,0,0|2,0,0]=4 2118 B8R0.6 COCCCC(=O)CCl Amb28255500 [1,1,0,0,0,0|1,0,1]=4 2119 B8R0.6 COCCCC(=O)CN Amb27632511 [1,1,0,0,0,0|0,0,1]=3 2120 B8R0.6 COCCCC(=O)NN Amb8455564 [1,1,0,0,0,0|1,0,1]=4 2121 B8R0.6 COCCNC(=O)CN Amb1155607 [1,1,0,0,0,0|1,0,1]=4 2122 B8R0.6 COCCNC(=O)CN Amb19515050 [1,1,0,0,0,0|1,0,1]=4 2123 B8R0.6 COCCOC(=O)CN Amb28252338 [1,1,0,0,0,0|1,0,1]=4 2124 B8R0.6 C\C(=C/CCC=O)CO Amb28248122 [1,1,0,0,0,0|2,0,0]=4 2125 B8R0.6 C\C(=C\CCC=O)CO Amb18642621 [1,1,0,0,0,0|2,0,0]=4 2126 B8R0.6 NCC(=O)NCCCCl Amb33483904 [1,1,0,0,0,0|1,0,1]=4 2127 B8R0.6 NCC(=O)NCCCCl Amb33483921 [1,1,0,0,0,0|1,0,1]=4 2128 B8R0.6 NCC(=O)OCCCO Amb27430485 [1,1,0,0,0,0|0,0,1]=3 2129 B8R0.6 NCCCNC(=O)CN Amb19011430 [1,1,0,0,0,0|1,0,1]=4 2130 B8R0.6 NNC(=O)CSCCO Amb27432331 [1,1,0,0,0,0|1,0,1]=4 2131 B8R0.6 O=C(CBr)NCCCO Amb17329705 [1,1,0,0,0,0|1,0,1]=4 2132 B8R0.6 O=C(CCl)NCCCO Amb4477240 [1,1,0,0,0,0|1,0,1]=4 2133 B8R0.6 O=C(CCl)OCCCO Amb27198162 [1,1,0,0,0,0|1,0,1]=4 2134 B8R0.6 O=C(CO)NCCCO Amb5798092 [1,1,0,0,0,0|1,0,1]=4 2135 B8R0.8 C#CCCC(=O)C(C)N Amb27881475 [1,1,0,0,0,0|1,0,1]=4 2136 B8R0.8 C#CCCC(=O)[C@@H](C)N Amb30024518 [1,1,0,0,0,0|1,0,1]=4 2137 B8R0.8 C#CCCC(=O)[C@H](C)N Amb35624362 [1,1,0,0,0,0|1,0,1]=4 2138 B8R0.8 C=CCCC(=O)C(C)Cl Amb28193735 [1,1,0,0,0,0|2,0,0]=4 2139 B8R0.8 C=CCCC(=O)C(C)F Amb27838690 [1,1,0,0,0,0|2,0,0]=4 2140 B8R0.8 C=CCCC(=O)C(F)F Amb27762686 [1,1,0,0,0,0|2,0,0]=4 2141 B8R0.8 C=CCNC(=O)[C@@H](C)N Amb17987741 [1,1,0,0,0,0|2,0,0]=4 2142 B8R0.8 C=CCNC(=O)[C@H](C)N Amb5783187 [1,1,0,0,0,0|2,0,0]=4 2143 B8R0.8 C=CCOC(=O)C(C)N Amb18642699 [1,1,0,0,0,0|2,0,0]=4 2144 B8R0.8 C=CCOC(=O)[C@H](C)N Amb28313858 [1,1,0,0,0,0|2,0,0]=4 2145 B8R0.8 C=CCOC(=O)[C@H](C)N Amb30867945 [1,1,0,0,0,0|2,0,0]=4 2146 B8R0.8 CC(C)C(=O)NCC=O Amb17102056 [1,1,0,0,0,0|2,0,0]=4 2147 B8R0.8 CC(N)C(=O)NCCO Amb21958724 [1,1,0,0,0,0|1,0,1]=4 2148 B8R0.8 CC(N)C(=O)NCCO Amb9023081 [1,1,0,0,0,0|1,0,1]=4 2149 B8R0.8 CC(O)C(=O)CCC=O Amb28430094 [1,1,0,0,0,0|1,0,0]=3 2150 B8R0.8 CCCCC(=O)C(C)N Amb26583107 [1,1,0,0,0,0|1,0,1]=4 2151 B8R0.8 CN(C)C(=O)CCC=O Amb26512871 [1,1,0,0,0,0|2,0,0]=4 2152 B8R0.8 COCCC(=O)C(C)N Amb33377835 [1,1,0,0,0,0|2,0,0]=4 2153 B8R0.8 CSCCC(=O)C(C)N Amb33199124 [1,1,0,0,0,0|2,0,0]=4 2154 B8R0.8 C[C@@H](N)C(=O)NCCO Amb30526700 [1,1,0,0,0,0|1,0,1]=4 2155 B8R0.8 C[C@H](N)C(=O)NCCO Amb25344161 [1,1,0,0,0,0|1,0,1]=4 2156 B8R0.8 C[C@H](N)C(=O)NCCO Amb28934945 [1,1,0,0,0,0|1,0,1]=4 2157 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [1,1,0,0,0,0|1,0,1]=4 2158 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [1,1,0,0,0,0|1,0,1]=4 2159 B8R0.11 C\C=C(\CC)CCC=O Amb27818045 [1,1,0,0,0,0|2,0,0]=4 2160 B8R0.11 N\C=C(/C=O)CCCO Amb25307863 [1,1,0,0,0,0|0,0,2]=4 2161 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [1,1,0,0,0,0|2,0,0]=4 2162 B8R0.19 COC(=O)CC(F)C=O Amb27173133 [1,1,0,0,0,0|2,0,0]=4 2163 B8R0.19 COC(=O)C[C@@H](C)C=O Amb27863686 [1,1,0,0,0,0|2,0,0]=4 2164 B8R0.19 COC(=O)C[C@H](C)C=O Amb28366984 [1,1,0,0,0,0|2,0,0]=4 2165 B8R0.19 C[C@H](CO)NC(=O)CN Amb28369296 [1,1,0,0,0,0|1,0,1]=4 2166 B8R0.19 O=C(CO)CC(O)CO Amb26067178 [1,1,0,0,0,0|1,0,1]=4 2167 B8R0.19 O=CC(O)CC(=O)CO Amb28144194 [1,1,0,0,0,0|1,0,0]=3 2168 B8R0.19 O=C[C@H](O)CC(=O)CO Amb28121885 [1,1,0,0,0,0|1,0,0]=3 2169 B8R0.5 C=C=CC(C)CC(=O)O Amb27631675 [1,1,0,0,0,0|1,0,1]=4 2170 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [1,1,0,0,0,0|1,0,1]=4 2171 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [1,1,0,0,0,0|0,0,1]=3 2172 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [1,1,0,0,0,0|0,0,1]=3 2173 B8R0.5 CC(CCN)C[PH](=O)O Amb28250150 [1,1,0,0,0,0|1,0,1]=4 2174 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [1,1,0,0,0,0|1,0,1]=4 2175 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [1,1,0,0,0,0|1,0,1]=4 2176 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [1,1,0,0,0,0|1,0,1]=4 2177 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [1,1,0,0,0,0|1,0,1]=4 2178 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [1,1,0,0,0,0|1,0,1]=4 2179 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [1,1,0,0,0,0|1,0,1]=4 2180 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [1,1,0,0,0,0|1,0,1]=4 2181 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [1,1,0,0,0,0|1,0,1]=4 2182 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [1,1,0,0,0,0|1,0,1]=4 2183 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [1,1,0,0,0,0|1,0,1]=4 2184 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [1,1,0,0,0,0|1,0,1]=4 2185 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [1,1,0,0,0,0|2,0,0]=4 2186 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [1,1,0,0,0,0|2,0,0]=4 2187 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [1,1,0,0,0,0|2,0,0]=4 2188 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [1,1,0,0,0,0|2,0,0]=4 2189 B8R0.5 CC\C=C(/Br)CC(=O)O Amb28208655 [1,1,0,0,0,0|1,0,1]=4 2190 B8R0.5 CN(CCN)CC(=O)O Amb18313585 [1,1,0,0,0,0|1,0,1]=4 2191 B8R0.5 CN(CCN)CC(=O)O Amb32701580 [1,1,0,0,0,0|1,0,1]=4 2192 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [1,1,0,0,0,0|1,0,1]=4 2193 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [1,1,0,0,0,0|1,0,1]=4 2194 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [1,1,0,0,0,0|1,0,1]=4 2195 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [1,1,0,0,0,0|1,0,1]=4 2196 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [1,1,0,0,0,0|1,0,1]=4 2197 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [1,1,0,0,0,0|0,0,1]=3 2198 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [1,1,0,0,0,0|0,0,1]=3 2199 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [1,1,0,0,0,0|0,0,1]=3 2200 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [1,1,0,0,0,0|0,0,1]=3 2201 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [1,1,0,0,0,0|0,0,1]=3 2202 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [1,1,0,0,0,0|1,0,1]=4 2203 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [1,1,0,0,0,0|1,0,1]=4 2204 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [1,1,0,0,0,0|1,0,1]=4 2205 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [1,1,0,0,0,0|1,0,1]=4 2206 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [1,1,0,0,0,0|1,0,1]=4 2207 B8R0.7 C#CCCCCC(=O)O Amb2721485 [1,1,0,0,0,0|1,0,1]=4 2208 B8R0.7 C#CCOCCC(=O)O Amb9208654 [1,1,0,0,0,0|2,0,0]=4 2209 B8R0.7 C#C\C=C\CCC(=O)O Amb10605297 [1,1,0,0,0,0|1,0,1]=4 2210 B8R0.7 C=CCCCCC(=O)O Amb6299578 [1,1,0,0,0,0|1,0,1]=4 2211 B8R0.7 C=CCNCCC(=O)O Amb33527032 [1,1,0,0,0,0|2,0,0]=4 2212 B8R0.7 C=CCNCCC(=O)O Amb7755724 [1,1,0,0,0,0|2,0,0]=4 2213 B8R0.7 C=CC\C=C\CC(=O)O Amb18642408 [1,1,0,0,0,0|1,0,1]=4 2214 B8R0.7 C=C\C=C\CCC(=O)O Amb10605294 [1,1,0,0,0,0|1,0,1]=4 2215 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,1,0,0,0,0|1,0,1]=4 2216 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,1,0,0,0,0|1,0,1]=4 2217 B8R0.7 CC(=O)CCOCCN Amb18628609 [1,1,0,0,0,0|1,0,1]=4 2218 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [1,1,0,0,0,0|2,0,0]=4 2219 B8R0.7 CC(=O)COCCCN Amb18630475 [1,1,0,0,0,0|1,0,1]=4 2220 B8R0.7 CC(=O)NCCCCN Amb17053700 [1,1,0,0,0,0|1,0,1]=4 2221 B8R0.7 CC(=O)OCCCCN Amb24657282 [1,1,0,0,0,0|1,0,1]=4 2222 B8R0.7 CC(=O)SCCCCN Amb24117263 [1,1,0,0,0,0|1,0,1]=4 2223 B8R0.7 CC(=O)SCCCCN Amb27429858 [1,1,0,0,0,0|1,0,1]=4 2224 B8R0.7 CCC#CCCC(=O)O Amb28046178 [1,1,0,0,0,0|1,0,1]=4 2225 B8R0.7 CCCCCCC(=O)O Amb34915914 [1,1,0,0,0,0|1,0,1]=4 2226 B8R0.7 CCCCCCC(=O)O Amb3499439 [1,1,0,0,0,0|1,0,1]=4 2227 B8R0.7 CCCCNCC(=O)O Amb7766471 [1,1,0,0,0,0|1,0,1]=4 2228 B8R0.7 CCCCOCC(=O)O Amb8514871 [1,1,0,0,0,0|1,0,1]=4 2229 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,1,0,0,0,0|1,0,1]=4 2230 B8R0.7 CCCNCCC(=O)O Amb18633174 [1,1,0,0,0,0|1,0,1]=4 2231 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,1,0,0,0,0|1,0,1]=4 2232 B8R0.7 CCCOCCC(=O)O Amb8874502 [1,1,0,0,0,0|1,0,1]=4 2233 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [1,1,0,0,0,0|1,0,1]=4 2234 B8R0.7 CCNCCCC(=O)O Amb30585148 [1,1,0,0,0,0|1,0,1]=4 2235 B8R0.7 CCNCCCC(=O)O Amb6253896 [1,1,0,0,0,0|1,0,1]=4 2236 B8R0.7 CCOCCCC(=O)O Amb6257602 [1,1,0,0,0,0|1,0,1]=4 2237 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [1,1,0,0,0,0|2,0,0]=4 2238 B8R0.7 CCSCCCC(=O)O Amb6680204 [1,1,0,0,0,0|1,0,1]=4 2239 B8R0.7 CCSSCCC(=O)O Amb27837279 [1,1,0,0,0,0|2,0,0]=4 2240 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [1,1,0,0,0,0|1,0,0]=3 2241 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [1,1,0,0,0,0|1,0,0]=3 2242 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [1,1,0,0,0,0|2,0,0]=4 2243 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [1,1,0,0,0,0|2,0,0]=4 2244 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,1,0,0,0,0|0,0,1]=3 2245 B8R0.7 CNCCCCC(=O)O Amb24340485 [1,1,0,0,0,0|0,0,1]=3 2246 B8R0.7 CNCCCCC(N)=O Amb27780478 [1,1,0,0,0,0|1,0,1]=4 2247 B8R0.7 CNCCOCC(=O)O Amb18630741 [1,1,0,0,0,0|1,0,1]=4 2248 B8R0.7 COCCCCC(=O)O Amb9207785 [1,1,0,0,0,0|1,0,1]=4 2249 B8R0.7 COCOCCC(=O)O Amb27784860 [1,1,0,0,0,0|2,0,0]=4 2250 B8R0.7 COCSCCC(=O)O Amb27263382 [1,1,0,0,0,0|2,0,0]=4 2251 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,1,0,0,0,0|1,0,1]=4 2252 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [1,1,0,0,0,0|1,0,1]=4 2253 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [1,1,0,0,0,0|1,0,1]=4 2254 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [1,1,0,0,0,0|1,0,1]=4 2255 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,1,0,0,0,0|0,0,2]=4 2256 B8R0.7 N#CCSCCC(=O)O Amb6277440 [1,1,0,0,0,0|1,0,1]=4 2257 B8R0.7 N#CC\C=C\CC(=O)O Amb27762977 [1,1,0,0,0,0|0,0,2]=4 2258 B8R0.7 N#C\C=C\CCC(=O)O Amb27785050 [1,1,0,0,0,0|0,0,2]=4 2259 B8R0.7 NCCCC#CC(=O)O Amb33168806 [1,1,0,0,0,0|0,0,2]=4 2260 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,1,0,0,0,0|1,0,1]=4 2261 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,1,0,0,0,0|0,0,1]=3 2262 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,1,0,0,0,0|0,0,1]=3 2263 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [1,1,0,0,0,0|0,0,2]=4 2264 B8R0.7 NCCCCNC(N)=O Amb19026975 [1,1,0,0,0,0|1,0,1]=4 2265 B8R0.7 NCCCCNC(N)=O Amb19374296 [1,1,0,0,0,0|1,0,1]=4 2266 B8R0.7 NCCCOCC(=O)O Amb18111435 [1,1,0,0,0,0|0,0,1]=3 2267 B8R0.7 NCCCOCC(=O)O Amb31217489 [1,1,0,0,0,0|0,0,1]=3 2268 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,1,0,0,0,0|0,0,1]=3 2269 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [1,1,0,0,0,0|0,0,2]=4 2270 B8R0.7 NCCNCCC(=O)O Amb20668304 [1,1,0,0,0,0|0,0,1]=3 2271 B8R0.7 NCCNCCC(=O)O Amb22058790 [1,1,0,0,0,0|0,0,1]=3 2272 B8R0.7 NCCNCCC(N)=O Amb27436823 [1,1,0,0,0,0|1,0,1]=4 2273 B8R0.7 NCCOCCC(=O)O Amb18630461 [1,1,0,0,0,0|0,0,1]=3 2274 B8R0.7 NCCOCCC(=O)O Amb33330744 [1,1,0,0,0,0|0,0,1]=3 2275 B8R0.7 NCCOCCC(N)=O Amb27751130 [1,1,0,0,0,0|1,0,1]=4 2276 B8R0.7 NCCSCCC(=O)O Amb21988844 [1,1,0,0,0,0|0,0,1]=3 2277 B8R0.7 NCCSSCC(=O)O Amb27658690 [1,1,0,0,0,0|1,0,1]=4 2278 B8R0.7 NC\C=C\C=C\C(=O)O Amb25146005 [1,1,0,0,0,0|0,0,2]=4 2279 B8R0.7 NOCCCCC(=O)O Amb27596055 [1,1,0,0,0,0|0,0,1]=3 2280 B8R0.7 O=C(O)CCC#CCO Amb27949900 [1,1,0,0,0,0|1,0,1]=4 2281 B8R0.7 O=C(O)CCCCCBr Amb2081955 [1,1,0,0,0,0|1,0,1]=4 2282 B8R0.7 O=C(O)CCCCCCl Amb18796646 [1,1,0,0,0,0|1,0,1]=4 2283 B8R0.7 O=C(O)CCCCCF Amb26063796 [1,1,0,0,0,0|1,0,1]=4 2284 B8R0.7 O=C(O)CCCCCI Amb22736492 [1,1,0,0,0,0|1,0,1]=4 2285 B8R0.7 O=C(O)CCCCCO Amb8515991 [1,1,0,0,0,0|1,0,1]=4 2286 B8R0.7 O=C(O)CCCCNO Amb28410171 [1,1,0,0,0,0|0,0,1]=3 2287 B8R0.7 O=C(O)CCNCCF Amb27954272 [1,1,0,0,0,0|1,0,1]=4 2288 B8R0.7 O=C(O)CCNCCO Amb1110010 [1,1,0,0,0,0|1,0,1]=4 2289 B8R0.7 O=C(O)CCNCCS Amb28285239 [1,1,0,0,0,0|1,0,1]=4 2290 B8R0.7 O=C(O)CCOCCBr Amb24057757 [1,1,0,0,0,0|1,0,1]=4 2291 B8R0.7 O=C(O)CCOCCF Amb27807548 [1,1,0,0,0,0|1,0,1]=4 2292 B8R0.7 O=C(O)CCOCCO Amb6680916 [1,1,0,0,0,0|1,0,1]=4 2293 B8R0.7 O=C(O)CCOCCS Amb27226892 [1,1,0,0,0,0|1,0,1]=4 2294 B8R0.7 O=C(O)CCSCCBr Amb27468126 [1,1,0,0,0,0|1,0,1]=4 2295 B8R0.7 O=C(O)CCSCCF Amb27172860 [1,1,0,0,0,0|1,0,1]=4 2296 B8R0.7 O=C(O)CCSCCS Amb18126456 [1,1,0,0,0,0|1,0,1]=4 2297 B8R0.7 O=C(O)CNCCCCl Amb28055692 [1,1,0,0,0,0|1,0,1]=4 2298 B8R0.7 O=C(O)CNCCCF Amb27649256 [1,1,0,0,0,0|1,0,1]=4 2299 B8R0.7 O=C(O)CNCCCO Amb9325805 [1,1,0,0,0,0|1,0,1]=4 2300 B8R0.7 O=C(O)COCCCO Amb28288633 [1,1,0,0,0,0|1,0,1]=4 2301 B8R0.7 O=C(O)COC\C=C\Cl Amb27450817 [1,1,0,0,0,0|1,0,1]=4 2302 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [1,1,0,0,0,0|1,0,1]=4 2303 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [1,1,0,0,0,0|1,0,1]=4 2304 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [1,1,0,0,0,0|1,0,1]=4 2305 B8R0.7 O=CCCCCC(=O)O Amb18642763 [1,1,0,0,0,0|1,0,1]=4 2306 B8R0.7 O=CC\C=C\CC(=O)O Amb25911988 [1,1,0,0,0,0|1,0,1]=4 2307 B8R0.7 O=C\C=C\CCC(=O)O Amb26920160 [1,1,0,0,0,0|1,0,1]=4 2308 B8R0.21 NCCCCP(=O)(O)O Amb4036798 [1,1,0,0,0,0|1,0,1]=4 2309 B8R0.21 NCCCCS(=O)(=O)O Amb28285138 [1,1,0,0,0,0|1,0,1]=4 2310 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [1,1,0,0,0,0|1,0,1]=4 2311 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [1,1,0,0,0,0|1,0,1]=4 2312 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [1,1,0,0,0,0|1,0,1]=4 2313 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [1,1,0,0,0,0|2,0,0]=4 2314 B8R0.28 CC(C)NCCC(=O)O Amb528114 [1,1,0,0,0,0|2,0,0]=4 2315 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [1,1,0,0,0,0|2,0,0]=4 2316 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [1,1,0,0,0,0|2,0,0]=4 2317 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [1,1,0,0,0,0|1,0,1]=4 2318 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [1,1,0,0,0,0|1,0,1]=4 2319 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [1,1,0,0,0,0|0,0,1]=3 2320 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [1,1,0,0,0,0|0,0,1]=3 2321 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [1,1,0,0,0,0|1,0,1]=4 2322 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [1,1,0,0,0,0|1,0,1]=4 2323 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [1,1,0,0,0,0|0,0,1]=3 2324 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [1,1,0,0,0,0|1,0,1]=4 2325 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [1,1,0,0,0,0|1,0,1]=4 2326 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [1,1,0,0,0,0|0,0,2]=4 2327 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [1,1,0,0,0,0|1,0,1]=4 2328 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [1,1,0,0,0,0|1,0,1]=4 2329 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [1,1,0,0,0,0|0,0,2]=4 2330 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [1,1,0,0,0,0|1,0,1]=4 2331 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [1,1,0,0,0,0|1,0,1]=4 2332 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [1,1,0,0,0,0|1,0,1]=4 2333 B8R0.28 O=C(O)CCSC(F)F Amb8840854 [1,1,0,0,0,0|2,0,0]=4 2334 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [1,1,0,0,0,0|1,0,0]=3 2335 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [1,1,0,0,0,0|1,0,1]=4 2336 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [1,1,0,0,0,0|1,0,1]=4 2337 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [1,1,0,0,0,0|1,0,1]=4 2338 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [1,1,0,0,0,0|1,0,1]=4 2339 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [1,1,0,0,0,0|1,0,0]=3 2340 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [1,1,0,0,0,0|2,0,0]=4 2341 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [1,1,0,0,0,0|1,0,0]=3 2342 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [1,1,0,0,0,0|2,0,0]=4 2343 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [1,1,0,0,0,0|1,0,0]=3 2344 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [1,1,0,0,0,0|2,0,0]=4 2345 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [1,1,0,0,0,0|1,0,1]=4 2346 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [1,1,0,0,0,0|1,0,0]=3 2347 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [1,1,0,0,0,0|2,0,0]=4 2348 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [1,1,0,0,0,0|2,0,0]=4 2349 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [1,1,0,0,0,0|1,0,0]=3 2350 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [1,1,0,0,0,0|2,0,0]=4 2351 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [1,1,0,0,0,0|1,0,0]=3 2352 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [1,1,0,0,0,0|1,0,0]=3 2353 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [1,1,0,0,0,0|1,0,0]=3 2354 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [1,1,0,0,0,0|1,0,0]=3 2355 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [1,1,0,0,0,0|1,0,0]=3 2356 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [1,1,0,0,0,0|1,0,0]=3 2357 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [1,1,0,0,0,0|2,0,0]=4 2358 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [1,1,0,0,0,0|1,0,0]=3 2359 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [1,1,0,0,0,0|1,0,0]=3 2360 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [1,1,0,0,0,0|2,0,0]=4 2361 B8R0.23 C=C(CC(=O)O)C(=O)O Amb6608656 [1,1,0,0,0,0|1,0,1]=4 2362 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [1,1,0,0,0,0|0,0,1]=3 2363 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [1,1,0,0,0,0|0,0,1]=3 2364 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [1,1,0,0,0,0|1,0,1]=4 2365 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [1,1,0,0,0,0|1,0,1]=4 2366 B8R0.23 C=C(Cl)CC(N)C(N)=O Amb33308519 [1,1,0,0,0,0|2,0,0]=4 2367 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [1,1,0,0,0,0|1,0,1]=4 2368 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [1,1,0,0,0,0|1,0,1]=4 2369 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [1,1,0,0,0,0|1,0,1]=4 2370 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [1,1,0,0,0,0|1,0,1]=4 2371 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [1,1,0,0,0,0|1,0,1]=4 2372 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [1,1,0,0,0,0|1,0,1]=4 2373 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [1,1,0,0,0,0|1,0,1]=4 2374 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [1,1,0,0,0,0|1,0,1]=4 2375 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [1,1,0,0,0,0|0,0,1]=3 2376 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [1,1,0,0,0,0|0,0,0]=2 2377 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [1,1,0,0,0,0|0,0,0]=2 2378 B8R0.23 CC(=O)C(C)NC(N)=O Amb27778024 [1,1,0,0,0,0|2,0,0]=4 2379 B8R0.23 CC(=O)C(C)SC(=O)Cl Amb32679654 [1,1,0,0,0,0|2,0,0]=4 2380 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [1,1,0,0,0,0|1,0,1]=4 2381 B8R0.23 CC(=O)C(Cl)C[N+](=O)[O-] Amb27954705 [1,1,0,0,0,0|1,0,1]=4 2382 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [1,1,0,0,0,0|0,0,0]=2 2383 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [1,1,0,0,0,0|1,0,0]=3 2384 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [1,1,0,0,0,0|0,0,0]=2 2385 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [1,1,0,0,0,0|0,0,1]=3 2386 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [1,1,0,0,0,0|1,0,1]=4 2387 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [1,1,0,0,0,0|0,0,0]=2 2388 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [1,1,0,0,0,0|1,0,0]=3 2389 B8R0.23 CC(=O)CC(C)[N+](=O)[O-] Amb27210764 [1,1,0,0,0,0|1,0,1]=4 2390 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [1,1,0,0,0,0|0,0,0]=2 2391 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [1,1,0,0,0,0|0,0,0]=2 2392 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [1,1,0,0,0,0|1,0,0]=3 2393 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [1,1,0,0,0,0|0,0,0]=2 2394 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [1,1,0,0,0,0|2,0,0]=4 2395 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [1,1,0,0,0,0|0,0,0]=2 2396 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [1,1,0,0,0,0|0,0,0]=2 2397 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [1,1,0,0,0,0|0,0,0]=2 2398 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [1,1,0,0,0,0|1,0,0]=3 2399 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [1,1,0,0,0,0|0,0,0]=2 2400 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [1,1,0,0,0,0|0,0,0]=2 2401 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [1,1,0,0,0,0|1,0,0]=3 2402 B8R0.23 CC(=O)N(C)CC(N)=O Amb8999134 [1,1,0,0,0,0|2,0,0]=4 2403 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [1,1,0,0,0,0|1,0,0]=3 2404 B8R0.23 CC(=O)NC(Br)C(C)=O Amb28285135 [1,1,0,0,0,0|2,0,0]=4 2405 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [1,1,0,0,0,0|1,0,0]=3 2406 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [1,1,0,0,0,0|2,0,0]=4 2407 B8R0.23 CC(=O)NC(C)C(N)=O Amb4018750 [1,1,0,0,0,0|2,0,0]=4 2408 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [1,1,0,0,0,0|1,0,0]=3 2409 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [1,1,0,0,0,0|2,0,0]=4 2410 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [1,1,0,0,0,0|1,0,0]=3 2411 B8R0.23 CC(=O)OC(C)C(=O)Cl Amb25920188 [1,1,0,0,0,0|2,0,0]=4 2412 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [1,1,0,0,0,0|1,0,0]=3 2413 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [1,1,0,0,0,0|2,0,0]=4 2414 B8R0.23 CC(=O)OC(C)C(N)=O Amb27179906 [1,1,0,0,0,0|2,0,0]=4 2415 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl Amb3939242 [1,1,0,0,0,0|2,0,0]=4 2416 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [1,1,0,0,0,0|1,0,0]=3 2417 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [1,1,0,0,0,0|2,0,0]=4 2418 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl Amb27411067 [1,1,0,0,0,0|2,0,0]=4 2419 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [1,1,0,0,0,0|1,0,0]=3 2420 B8R0.23 CC(=O)O[C@H](C)C(N)=O Amb27227531 [1,1,0,0,0,0|2,0,0]=4 2421 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [1,1,0,0,0,0|1,0,0]=3 2422 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [1,1,0,0,0,0|1,0,0]=3 2423 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [1,1,0,0,0,0|1,0,0]=3 2424 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [1,1,0,0,0,0|0,0,0]=2 2425 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [1,1,0,0,0,0|0,0,0]=2 2426 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [1,1,0,0,0,0|0,0,2]=4 2427 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [1,1,0,0,0,0|0,0,2]=4 2428 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [1,1,0,0,0,0|0,0,2]=4 2429 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [1,1,0,0,0,0|0,0,2]=4 2430 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [1,1,0,0,0,0|0,0,2]=4 2431 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [1,1,0,0,0,0|0,0,2]=4 2432 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [1,1,0,0,0,0|0,0,2]=4 2433 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [1,1,0,0,0,0|1,1,0]=4 2434 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [1,1,0,0,0,0|1,0,1]=4 2435 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [1,1,0,0,0,0|1,0,1]=4 2436 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [1,1,0,0,0,0|1,0,1]=4 2437 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [1,1,0,0,0,0|1,0,1]=4 2438 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [1,1,0,0,0,0|1,0,1]=4 2439 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [1,1,0,0,0,0|1,0,1]=4 2440 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [1,1,0,0,0,0|1,0,1]=4 2441 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [1,1,0,0,0,0|1,0,1]=4 2442 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [1,1,0,0,0,0|1,0,1]=4 2443 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [1,1,0,0,0,0|1,0,1]=4 2444 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [1,1,0,0,0,0|1,0,1]=4 2445 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [1,1,0,0,0,0|1,0,1]=4 2446 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [1,1,0,0,0,0|1,0,1]=4 2447 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [1,1,0,0,0,0|1,0,1]=4 2448 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [1,1,0,0,0,0|1,0,1]=4 2449 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [1,1,0,0,0,0|1,0,1]=4 2450 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [1,1,0,0,0,0|1,0,1]=4 2451 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [1,1,0,0,0,0|1,0,1]=4 2452 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [1,1,0,0,0,0|1,0,1]=4 2453 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [1,1,0,0,0,0|1,0,1]=4 2454 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [1,1,0,0,0,0|1,0,1]=4 2455 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [1,1,0,0,0,0|1,0,1]=4 2456 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [1,1,0,0,0,0|1,0,1]=4 2457 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [1,1,0,0,0,0|1,0,1]=4 2458 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [1,1,0,0,0,0|1,0,1]=4 2459 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [1,1,0,0,0,0|1,0,1]=4 2460 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [1,1,0,0,0,0|1,0,1]=4 2461 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [1,1,0,0,0,0|1,0,1]=4 2462 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [1,1,0,0,0,0|1,0,1]=4 2463 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [1,1,0,0,0,0|1,0,1]=4 2464 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [1,1,0,0,0,0|1,0,1]=4 2465 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [1,1,0,0,0,0|1,0,1]=4 2466 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [1,1,0,0,0,0|1,0,1]=4 2467 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [1,1,0,0,0,0|1,0,1]=4 2468 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [1,1,0,0,0,0|1,0,1]=4 2469 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [1,1,0,0,0,0|1,0,1]=4 2470 B8R0.23 CC(CC(=N)N)C(N)=O Amb27209796 [1,1,0,0,0,0|2,0,0]=4 2471 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [1,1,0,0,0,0|2,0,0]=4 2472 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [1,1,0,0,0,0|1,0,0]=3 2473 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [1,1,0,0,0,0|0,0,0]=2 2474 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [1,1,0,0,0,0|1,0,1]=4 2475 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [1,1,0,0,0,0|2,0,0]=4 2476 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [1,1,0,0,0,0|2,0,0]=4 2477 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [1,1,0,0,0,0|1,0,1]=4 2478 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [1,1,0,0,0,0|0,0,0]=2 2479 B8R0.23 CC(CC(N)=O)C(N)=O Amb2720769 [1,1,0,0,0,0|1,0,0]=3 2480 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [1,1,0,0,0,0|2,0,0]=4 2481 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [1,1,0,0,0,0|2,0,0]=4 2482 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [1,1,0,0,0,0|2,0,0]=4 2483 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [1,1,0,0,0,0|2,0,0]=4 2484 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [1,1,0,0,0,0|1,0,0]=3 2485 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [1,1,0,0,0,0|2,0,0]=4 2486 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [1,1,0,0,0,0|2,0,0]=4 2487 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [1,1,0,0,0,0|1,0,1]=4 2488 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [1,1,0,0,0,0|1,0,1]=4 2489 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [1,1,0,0,0,0|1,0,1]=4 2490 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [1,1,0,0,0,0|1,0,1]=4 2491 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [1,1,0,0,0,0|2,0,0]=4 2492 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [1,1,0,0,0,0|1,0,0]=3 2493 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [1,1,0,0,0,0|0,0,2]=4 2494 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [1,1,0,0,0,0|1,0,1]=4 2495 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [1,1,0,0,0,0|0,0,2]=4 2496 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [1,1,0,0,0,0|1,0,1]=4 2497 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [1,1,0,0,0,0|0,0,2]=4 2498 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [1,1,0,0,0,0|0,0,2]=4 2499 B8R0.23 CC(OC(=O)Cl)C(=O)O Amb27241520 [1,1,0,0,0,0|2,0,0]=4 2500 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [1,1,0,0,0,0|1,1,0]=4 2501 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [1,1,0,0,0,0|2,0,0]=4 2502 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [1,1,0,0,0,0|2,0,0]=4 2503 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [1,1,0,0,0,0|2,0,0]=4 2504 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [1,1,0,0,0,0|2,0,0]=4 2505 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [1,1,0,0,0,0|2,0,0]=4 2506 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [1,1,0,0,0,0|2,0,0]=4 2507 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [1,1,0,0,0,0|2,0,0]=4 2508 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [1,1,0,0,0,0|2,0,0]=4 2509 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [1,1,0,0,0,0|2,0,0]=4 2510 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [1,1,0,0,0,0|2,0,0]=4 2511 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [1,1,0,0,0,0|2,0,0]=4 2512 B8R0.23 CN(CC(=O)O)C(=O)Cl Amb27484119 [1,1,0,0,0,0|2,0,0]=4 2513 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [1,1,0,0,0,0|1,0,0]=3 2514 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [1,1,0,0,0,0|2,0,0]=4 2515 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [1,1,0,0,0,0|2,0,0]=4 2516 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [1,1,0,0,0,0|1,0,0]=3 2517 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [1,1,0,0,0,0|2,0,0]=4 2518 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [1,1,0,0,0,0|1,0,0]=3 2519 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [1,1,0,0,0,0|1,0,0]=3 2520 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [1,1,0,0,0,0|1,0,0]=3 2521 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [1,1,0,0,0,0|1,0,1]=4 2522 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [1,1,0,0,0,0|1,0,0]=3 2523 B8R0.23 C[C@@H](NC(N)=O)C(N)=O Amb27394390 [1,1,0,0,0,0|2,0,0]=4 2524 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [1,1,0,0,0,0|0,0,2]=4 2525 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [1,1,0,0,0,0|0,0,2]=4 2526 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [1,1,0,0,0,0|1,0,0]=3 2527 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [1,1,0,0,0,0|1,0,0]=3 2528 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [1,1,0,0,0,0|0,0,0]=2 2529 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [1,1,0,0,0,0|1,0,0]=3 2530 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [1,1,0,0,0,0|1,0,1]=4 2531 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [1,1,0,0,0,0|1,0,1]=4 2532 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [1,1,0,0,0,0|1,0,1]=4 2533 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [1,1,0,0,0,0|1,0,1]=4 2534 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [1,1,0,0,0,0|1,0,1]=4 2535 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [1,1,0,0,0,0|2,0,0]=4 2536 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [1,1,0,0,0,0|1,0,0]=3 2537 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [1,1,0,0,0,0|2,0,0]=4 2538 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [1,1,0,0,0,0|0,0,2]=4 2539 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [1,1,0,0,0,0|1,0,0]=3 2540 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [1,1,0,0,0,0|1,0,0]=3 2541 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [1,1,0,0,0,0|1,0,0]=3 2542 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [1,1,0,0,0,0|0,0,2]=4 2543 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [1,1,0,0,0,0|0,0,2]=4 2544 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [1,1,0,0,0,0|1,0,1]=4 2545 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [1,1,0,0,0,0|1,0,1]=4 2546 B8R0.23 NC(=O)C(=S)CC(O)=S Amb28323012 [1,1,0,0,0,0|0,1,1]=4 2547 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [1,1,0,0,0,0|0,0,0]=2 2548 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [1,1,0,0,0,0|0,0,0]=2 2549 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [1,1,0,0,0,0|0,0,0]=2 2550 B8R0.23 NC(=O)C(O)CC(=O)[O-] Amb33068981 [1,1,0,0,0,0|0,0,1]=3 2551 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [1,1,0,0,0,0|0,0,0]=2 2552 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [1,1,0,0,0,0|0,0,0]=2 2553 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [1,1,0,0,0,0|0,0,0]=2 2554 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [1,1,0,0,0,0|0,0,0]=2 2555 B8R0.23 NC(=O)CC(N)C(N)=O Amb18289248 [1,1,0,0,0,0|1,0,0]=3 2556 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [1,1,0,0,0,0|0,0,0]=2 2557 B8R0.23 NC(=O)CC(O)C(N)=O Amb27961515 [1,1,0,0,0,0|1,0,0]=3 2558 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [1,1,0,0,0,0|0,0,0]=2 2559 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [1,1,0,0,0,0|0,0,0]=2 2560 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [1,1,0,0,0,0|0,0,0]=2 2561 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [1,1,0,0,0,0|0,0,0]=2 2562 B8R0.23 NC(=O)C[C@@H](N)C(N)=O Amb28423711 [1,1,0,0,0,0|1,0,0]=3 2563 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [1,1,0,0,0,0|0,0,0]=2 2564 B8R0.23 NC(=O)C[C@@H](O)C(N)=O Amb27258074 [1,1,0,0,0,0|1,0,0]=3 2565 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [1,1,0,0,0,0|0,0,0]=2 2566 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [1,1,0,0,0,0|0,0,0]=2 2567 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [1,1,0,0,0,0|0,0,0]=2 2568 B8R0.23 NC(=O)C[C@H](N)C(N)=O Amb16183882 [1,1,0,0,0,0|1,0,0]=3 2569 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [1,1,0,0,0,0|0,0,0]=2 2570 B8R0.23 NC(=O)N(N)CC(=O)O Amb6296397 [1,1,0,0,0,0|1,0,0]=3 2571 B8R0.23 NC(=O)NC(=O)C(=O)O Amb18124345 [1,1,0,0,0,0|1,0,1]=4 2572 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [1,1,0,0,0,0|1,0,0]=3 2573 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [1,1,0,0,0,0|1,0,0]=3 2574 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [1,1,0,0,0,0|0,0,0]=2 2575 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [1,1,0,0,0,0|0,0,0]=2 2576 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [1,1,0,0,0,0|0,0,0]=2 2577 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [1,1,0,0,0,0|0,0,0]=2 2578 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [1,1,0,0,0,0|0,0,2]=4 2579 B8R0.23 NC(=O)\C=C(/Cl)C(=O)O Amb27815058 [1,1,0,0,0,0|0,0,2]=4 2580 B8R0.23 NC(=O)\C=C(\F)C(=O)O Amb27447226 [1,1,0,0,0,0|0,0,2]=4 2581 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [1,1,0,0,0,0|0,1,0]=3 2582 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [1,1,0,0,0,0|1,0,0]=3 2583 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [1,1,0,0,0,0|1,0,0]=3 2584 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [1,1,0,0,0,0|1,0,0]=3 2585 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [1,1,0,0,0,0|2,0,0]=4 2586 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [1,1,0,0,0,0|1,0,0]=3 2587 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [1,1,0,0,0,0|1,0,0]=3 2588 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [1,1,0,0,0,0|1,0,0]=3 2589 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [1,1,0,0,0,0|1,0,0]=3 2590 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [1,1,0,0,0,0|1,0,0]=3 2591 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] Amb22757383 [1,1,0,0,0,0|1,0,1]=4 2592 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [1,1,0,0,0,0|2,0,0]=4 2593 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [1,1,0,0,0,0|2,0,0]=4 2594 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [1,1,0,0,0,0|2,0,0]=4 2595 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [1,1,0,0,0,0|1,0,0]=3 2596 B8R0.23 O=C(Cl)CC(Cl)C(=O)Cl Amb28122555 [1,1,0,0,0,0|2,0,0]=4 2597 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [1,1,0,0,0,0|2,0,0]=4 2598 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [1,1,0,0,0,0|1,0,1]=4 2599 B8R0.23 O=C(O)CC(=S)C(=O)O Amb25304511 [1,1,0,0,0,0|1,0,1]=4 2600 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [1,1,0,0,0,0|1,0,0]=3 2601 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [1,1,0,0,0,0|1,0,0]=3 2602 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [1,1,0,0,0,0|1,0,0]=3 2603 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [1,1,0,0,0,0|1,0,0]=3 2604 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [1,1,0,0,0,0|1,0,0]=3 2605 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [1,1,0,0,0,0|1,0,0]=3 2606 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [1,1,0,0,0,0|1,0,0]=3 2607 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [1,1,0,0,0,0|1,0,0]=3 2608 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [1,1,0,0,0,0|1,0,0]=3 2609 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [1,1,0,0,0,0|1,0,0]=3 2610 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [1,1,0,0,0,0|1,0,0]=3 2611 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [1,1,0,0,0,0|1,0,0]=3 2612 B8R0.23 O=C([O-])CC(O)C(=O)[O-] Amb30876864 [1,1,0,0,0,0|1,0,1]=4 2613 B8R0.23 O=C([O-])C[C@H](O)C(=O)[O-] Amb22351833 [1,1,0,0,0,0|1,0,1]=4 2614 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [1,1,0,0,0,0|2,0,0]=4 2615 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [1,1,0,0,0,0|1,0,1]=4 2616 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [1,1,0,0,0,0|1,0,1]=4 2617 B8R0.29 CC(=O)CSS(=O)(=O)O Amb27256676 [1,1,0,0,0,0|2,0,0]=4 2618 B8R0.29 CC(=O)NCP(=O)(O)O Amb26515978 [1,1,0,0,0,0|2,0,0]=4 2619 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [1,1,0,0,0,0|1,0,1]=4 2620 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [1,1,0,0,0,0|1,0,1]=4 2621 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [1,1,0,0,0,0|1,0,1]=4 2622 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [1,1,0,0,0,0|1,0,1]=4 2623 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [1,1,0,0,0,0|1,0,1]=4 2624 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [1,1,0,0,0,0|1,0,1]=4 2625 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [1,1,0,0,0,0|1,0,1]=4 2626 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [1,1,0,0,0,0|0,1,1]=4 2627 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [1,1,0,0,0,0|1,0,1]=4 2628 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [1,1,0,0,0,0|1,0,0]=3 2629 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [1,1,0,0,0,0|2,0,0]=4 2630 B8R0.29 CS(=N)(=O)NCC(=O)O Amb35687837 [1,1,0,0,0,0|2,0,0]=4 2631 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [1,1,0,0,0,0|1,0,0]=3 2632 B8R0.29 CS(=O)(=O)NCC(=O)O Amb1120433 [1,1,0,0,0,0|2,0,0]=4 2633 B8R0.29 CS(=O)(=O)OCC(=O)O Amb25783884 [1,1,0,0,0,0|2,0,0]=4 2634 B8R0.29 CS(=O)(=O)SCC(=O)O Amb17610576 [1,1,0,0,0,0|2,0,0]=4 2635 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [1,1,0,0,0,0|2,0,0]=4 2636 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [1,1,0,0,0,0|2,0,0]=4 2637 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [1,1,0,0,0,0|2,0,0]=4 2638 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [1,1,0,0,0,0|2,0,0]=4 2639 B8R0.29 NC(=O)CCS(=O)(=O)Cl Amb27427539 [1,1,0,0,0,0|1,0,1]=4 2640 B8R0.29 NC(=O)COP(=O)(O)O Amb27760380 [1,1,0,0,0,0|2,0,0]=4 2641 B8R0.29 NC(=O)COP(=O)([O-])O Amb33483331 [1,1,0,0,0,0|2,0,0]=4 2642 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [1,1,0,0,0,0|1,0,0]=3 2643 B8R0.29 NS(=O)(=O)NCC(=O)O Amb6277125 [1,1,0,0,0,0|2,0,0]=4 2644 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [1,1,0,0,0,0|2,0,0]=4 2645 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [1,1,0,0,0,0|2,0,0]=4 2646 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [1,1,0,0,0,0|2,0,0]=4 2647 B8R0.2 C=C(O)C(O)C(=O)CC Amb28051028 [0,1,0,0,1,0|2,0,0]=4 2648 B8R0.2 CC(=O)C(F)C(=O)CF Amb27834300 [0,1,0,0,1,0|2,0,0]=4 2649 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,1,0,0,1,0|2,0,0]=4 2650 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,1,0,0,1,0|1,0,1]=4 2651 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,1,0,0,1,0|1,0,1]=4 2652 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,1,0,0,1,0|1,0,1]=4 2653 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,1,0,0,1,0|1,0,1]=4 2654 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,1,0,0,1,0|1,0,1]=4 2655 B8R0.2 CCC(=O)C(=O)C(=O)O Amb31097725 [0,1,0,0,1,0|1,0,1]=4 2656 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,1,0,0,1,0|2,0,0]=4 2657 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [0,1,0,0,1,0|1,1,0]=4 2658 B8R0.2 CNC(=O)C(C)C(=O)O Amb26367215 [0,1,0,0,1,0|2,0,0]=4 2659 B8R0.2 COC(=O)C(C)C(=O)O Amb33545071 [0,1,0,0,1,0|2,0,0]=4 2660 B8R0.2 COC(=O)C(N)C(=O)O Amb27487566 [0,1,0,0,1,0|2,0,0]=4 2661 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,1,0,0,1,0|0,0,2]=4 2662 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,1,0,0,1,0|1,0,1]=4 2663 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,1,0,0,1,0|0,0,2]=4 2664 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,1,0,0,1,0|0,0,2]=4 2665 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,1,0,0,1,0|0,0,2]=4 2666 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,1,0,0,1,0|0,0,2]=4 2667 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,1,0,0,1,0|0,0,2]=4 2668 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,1,0,0,1,0|1,0,1]=4 2669 B8R0.2 O=C(Cl)C(Cl)C(=O)CCl Amb24433455 [0,1,0,0,1,0|2,0,0]=4 2670 B8R0.16 CCC(CN)CC(=O)O Amb20669457 [0,1,0,0,1,0|1,0,1]=4 2671 B8R0.16 CCC(CN)CC(=O)O Amb22059482 [0,1,0,0,1,0|1,0,1]=4 2672 B8R0.16 CCN(C=O)CC(=O)O Amb18972736 [0,1,0,0,1,0|2,0,0]=4 2673 B8R0.16 COC(CN)CC(=O)O Amb27806172 [0,1,0,0,1,0|0,0,2]=4 2674 B8R0.16 COC(CN)CC(=O)O Amb28555397 [0,1,0,0,1,0|0,0,2]=4 2675 B8R0.16 C\C=C(/CC)CC(=O)O Amb27473412 [0,1,0,0,1,0|2,0,0]=4 2676 B8R0.16 NCC(CF)CC(=O)O Amb27244579 [0,1,0,0,1,0|1,0,1]=4 2677 B8R0.16 NCC(CO)CC(=O)O Amb22546422 [0,1,0,0,1,0|0,0,2]=4 2678 B8R0.16 NC\C(=C/F)CC(=O)O Amb27960296 [0,1,0,0,1,0|1,0,0]=3 2679 B8R0.16 O=C\C(=C/C(=O)O)CCl Amb24656100 [0,1,0,0,1,0|1,0,1]=4 2680 B8R0.24 CCC(=O)CS(=O)(=O)O Amb27762508 [0,1,0,0,1,0|2,0,0]=4 2681 B8R0.24 CS(=O)(=O)CC(=O)CN Amb26597041 [0,1,0,0,1,0|1,0,1]=4 2682 B8R0.24 NCC(=O)CP(=O)(O)O Amb28141900 [0,1,0,0,1,0|1,0,0]=3 2683 B8R0.24 NCC(=O)NP(=O)(O)O Amb27876829 [0,1,0,0,1,0|2,0,0]=4 2684 B8R0.24 NCC(=O)OP(=O)(O)O Amb27781513 [0,1,0,0,1,0|2,0,0]=4 2685 B8R0.24 NNC(=O)CP(=O)(O)O Amb27630071 [0,1,0,0,1,0|2,0,0]=4 2686 B8R0.34 CC(C)(CN)CC(=O)O Amb4245619 [0,1,0,0,1,0|1,0,1]=4 2687 B8R0.34 CC(C)(CN)CC(=O)O Amb578353 [0,1,0,0,1,0|1,0,1]=4 2688 B8R0.34 CC(N)(CN)CC(=O)O Amb32787831 [0,1,0,0,1,0|1,0,1]=4 2689 B8R0.34 CC(O)(CN)CC(=O)O Amb25188898 [0,1,0,0,1,0|0,0,2]=4 2690 B8R0.34 CC(O)(CN)CC(=O)O Amb28935004 [0,1,0,0,1,0|0,0,2]=4 2691 B8R0.34 CCS(=O)(=O)CC(=O)O Amb6277554 [0,1,0,0,1,0|2,0,0]=4 2692 B8R0.34 NCC(F)(F)CC(=O)O Amb19148532 [0,1,0,0,1,0|1,0,1]=4 2693 B8R0.34 NCC(F)(F)CC(=O)O Amb32693401 [0,1,0,0,1,0|1,0,1]=4 2694 B10R0.3 CCCC(=O)CCCC(=O)O Amb6305240 [0,1,0,0,0,1|1,0,0]=3 2695 B10R0.3 CCCC(=O)NCCC(=O)O Amb5741938 [0,1,0,0,0,1|1,0,0]=3 2696 B10R0.3 CCNC(=O)CCCC(=O)O Amb3365014 [0,1,0,0,0,1|1,0,0]=3 2697 B10R0.3 CCNC(=O)NCCC(=O)O Amb1136873 [0,1,0,0,0,1|1,0,0]=3 2698 B10R0.3 CCOC(=O)CCCC(=O)Cl Amb6608947 [0,1,0,0,0,1|2,0,0]=4 2699 B10R0.3 CCOC(=O)CCCC(=O)O Amb3939878 [0,1,0,0,0,1|1,0,0]=3 2700 B10R0.3 CCOC(=O)CCCC(C)=O Amb4605993 [0,1,0,0,0,1|2,0,0]=4 2701 B10R0.3 CCOC(=O)CCNC(N)=O Amb4035329 [0,1,0,0,0,1|2,0,0]=4 2702 B10R0.3 CCOC(=O)CNCC(N)=O Amb6714658 [0,1,0,0,0,1|2,0,0]=4 2703 B10R0.3 CCOC(=O)NCCC(=O)O Amb6247333 [0,1,0,0,0,1|1,0,0]=3 2704 B10R0.3 CN(CCN)CCCC(=O)O Amb32684701 [0,1,0,0,0,1|2,0,0]=4 2705 B10R0.3 CN(CCN)CCCC(=O)O Amb32684702 [0,1,0,0,0,1|2,0,0]=4 2706 B10R0.3 COCC(=O)NCCC(=O)O Amb1121155 [0,1,0,0,0,1|1,0,0]=3 2707 B10R0.3 C\C=C\C(=O)NCCC(=O)O Amb9722353 [0,1,0,0,0,1|1,0,1]=4 2708 B10R0.3 N#CCC(=O)NCCC(N)=O Amb9416051 [0,1,0,0,0,1|1,0,1]=4 2709 B10R0.3 NCCC(=O)NCCC(=O)O Amb533809 [0,1,0,0,0,1|0,0,0]=2 2710 B10R0.3 O=C(O)CCNC(=O)\C=C\Cl Amb7969475 [0,1,0,0,0,1|1,0,1]=4 2711 B10R0.44 CC(CC(N)=O)NC(=O)NN Amb27241135 [0,1,0,0,0,1|2,0,0]=4 2712 B10R0.44 CC(O)CC(C)NC(=O)CN Amb27818479 [0,1,0,0,0,1|1,0,1]=4 2713 B10R0.44 CCC(=O)NC(C)CC(C)=O Amb28326445 [0,1,0,0,0,1|2,0,0]=4 2714 B10R0.44 CNC(=O)CS(=O)CC(=O)O Amb18796112 [0,1,0,0,0,1|2,0,0]=4 2715 B10R0.44 CNC(=O)NC(C)CC(=O)O Amb18290552 [0,1,0,0,0,1|2,0,0]=4 2716 B10R0.44 COC(=O)CC(C)CC(=O)O Amb2689808 [0,1,0,0,0,1|2,0,0]=4 2717 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33621255 [0,1,0,0,0,1|2,0,0]=4 2718 B10R0.44 COC(=O)C[C@@H](N)CC(=O)O Amb33747103 [0,1,0,0,0,1|2,0,0]=4 2719 B10R0.57 C#CC(=O)N(C)CCC(=O)O Amb18984978 [0,1,0,0,0,1|1,0,1]=4 2720 B10R0.57 CCC(=O)N(C)CCC(=O)O Amb17400039 [0,1,0,0,0,1|1,0,0]=3 2721 B10R0.57 CNC(=O)C(C)NCC(=O)O Amb9325887 [0,1,0,0,0,1|2,0,0]=4 2722 B10R0.57 CNC(=O)C(C)SCC(=O)O Amb9203226 [0,1,0,0,0,1|2,0,0]=4 2723 B10R0.57 CNC(=O)C(N)CCC(=O)O Amb27987066 [0,1,0,0,0,1|2,0,0]=4 2724 B10R0.57 CNC(=O)N(C)CCC(=O)O Amb18977475 [0,1,0,0,0,1|2,0,0]=4 2725 B10R0.57 CNC(=O)[C@@H](N)CCC(=O)O Amb27671844 [0,1,0,0,0,1|2,0,0]=4 2726 B10R0.57 COC(=O)[C@@H](N)CCC(=O)O Amb8390399 [0,1,0,0,0,1|2,0,0]=4 2727 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33801734 [0,1,0,0,0,1|2,0,0]=4 2728 B10R0.57 COC(=O)[C@H](N)CCC(=O)O Amb33866552 [0,1,0,0,0,1|2,0,0]=4 2729 B10R0.57 NC(CCC(=O)O)C(=O)NO Amb27987067 [0,1,0,0,0,1|2,0,0]=4 2730 B10R0.57 NNC(=O)C(=O)NCC(=O)O Amb25337580 [0,1,0,0,0,1|1,0,1]=4 2731 B10R0.57 NNC(=O)C(N)CCC(=O)O Amb27987068 [0,1,0,0,0,1|1,0,0]=3 2732 B10R0.57 NNC(=O)C(N)CCC(N)=O Amb27988668 [0,1,0,0,0,1|2,0,0]=4 2733 B10R0.57 O=C(O)CNC(=O)C(=O)CO Amb27988470 [0,1,0,0,0,1|1,0,1]=4 2734 B10R0.59 C=CC(=O)NCCC(=O)OC Amb9531118 [0,1,0,0,0,1|1,0,1]=4 2735 B10R0.59 CCC(=O)CCCC(=O)OC Amb17593954 [0,1,0,0,0,1|1,0,0]=3 2736 B10R0.59 CNC(=O)CCNC(=O)CS Amb28387087 [0,1,0,0,0,1|2,0,0]=4 2737 B10R0.59 CNC(=O)CCNC(=O)NN Amb18800330 [0,1,0,0,0,1|2,0,0]=4 2738 B10R0.59 CNC(=O)NCCC(=O)OC Amb27266771 [0,1,0,0,0,1|2,0,0]=4 2739 B10R0.59 COC(=O)CCCC(=O)OC Amb8513144 [0,1,0,0,0,1|2,0,0]=4 2740 B10R0.59 COC(=O)CCNC(=O)CCl Amb5722346 [0,1,0,0,0,1|1,0,0]=3 2741 B10R0.59 COC(=O)CCN\C(N)=N\N Amb28386852 [0,1,0,0,0,1|2,0,0]=4 2742 B10R0.59 COC(=O)CNCC(=O)OC Amb2759492 [0,1,0,0,0,1|2,0,0]=4 2743 B10R0.59 COC(=O)CNCC(=O)OC Amb6707561 [0,1,0,0,0,1|2,0,0]=4 2744 B10R0.59 COC(=O)COCC(=O)OC Amb9787367 [0,1,0,0,0,1|2,0,0]=4 2745 B10R0.59 COC(=O)CSCC(=O)OC Amb839594 [0,1,0,0,0,1|2,0,0]=4 2746 B10R0.59 COC(=O)NCCC(=O)NN Amb27988674 [0,1,0,0,0,1|1,0,0]=3 2747 B10R0.59 COC(=O)NCCC(=O)NO Amb27988901 [0,1,0,0,0,1|2,0,0]=4 2748 B10R0.59 COC(=O)NCNC(=O)CCl Amb27990040 [0,1,0,0,0,1|2,0,0]=4 2749 B10R0.59 NNC(=O)CCCC(=O)NN Amb841513 [0,1,0,0,0,1|2,0,0]=4 2750 B10R0.59 NNC(=O)CSCC(=O)NN Amb26070160 [0,1,0,0,0,1|2,0,0]=4 2751 B10R0.59 O=C(CCCC(=O)NO)NO Amb25383708 [0,1,0,0,0,1|2,0,0]=4 2752 B10R0.59 O=C(COCC(=O)NO)NO Amb27988714 [0,1,0,0,0,1|2,0,0]=4 2753 B10R0.59 O=C(CSCC(=O)NO)NO Amb27271906 [0,1,0,0,0,1|2,0,0]=4 2754 B10R0.60 NCC(=O)NCCS(N)(=O)=O Amb9414593 [0,1,0,0,0,1|1,0,1]=4 2755 B10R0.60 O=C(CCl)NCCS(=O)(=O)O Amb17326730 [0,1,0,0,0,1|2,0,0]=4 2756 B10R0.65 CCS(=O)(=O)CCCC(=O)O Amb9303285 [0,1,0,0,0,1|2,0,0]=4 2757 B10R0.65 CCS(=O)(=O)NCCC(=O)O Amb1119258 [0,1,0,0,0,1|2,0,0]=4 2758 B10R0.82 C#CC(=O)NCC(N)C(=O)O Amb27792858 [0,1,0,0,0,1|1,0,1]=4 2759 B10R0.82 C#CC(=O)NC[C@H](N)C(=O)O Amb25210877 [0,1,0,0,0,1|1,0,1]=4 2760 B10R0.82 C#CC(=O)NC[C@H](O)C(=O)O Amb27751159 [0,1,0,0,0,1|1,0,1]=4 2761 B10R0.82 C=C(CCC(=O)OC)C(=O)O Amb30584741 [0,1,0,0,0,1|2,0,0]=4 2762 B10R0.82 C=CC(=O)NC[C@H](N)C(=O)O Amb27674138 [0,1,0,0,0,1|1,0,1]=4 2763 B10R0.82 CCC(=O)NC[C@H](O)C(=O)O Amb27670709 [0,1,0,0,0,1|1,0,0]=3 2764 B10R0.82 CNC(=O)CCC(N)C(=O)O Amb18645293 [0,1,0,0,0,1|2,0,0]=4 2765 B10R0.82 CNC(=O)CO[C@@H](C)C(=O)O Amb27986317 [0,1,0,0,0,1|2,0,0]=4 2766 B10R0.82 CNC(=O)CSC(C)C(=O)O Amb6257259 [0,1,0,0,0,1|2,0,0]=4 2767 B10R0.82 CNC(=O)NCC(C)C(=O)O Amb18300018 [0,1,0,0,0,1|2,0,0]=4 2768 B10R0.82 CNC(=O)SC[C@H](N)C(=O)O Amb17617278 [0,1,0,0,0,1|2,0,0]=4 2769 B10R0.82 COC(=O)CCC(Br)C(=O)O Amb18134592 [0,1,0,0,0,1|2,0,0]=4 2770 B10R0.82 COC(=O)CCC(Cl)C(=O)O Amb32941125 [0,1,0,0,0,1|2,0,0]=4 2771 B10R0.82 COC(=O)CCC(N)C(=O)O Amb9825413 [0,1,0,0,0,1|2,0,0]=4 2772 B10R0.82 COC(=O)CCC(O)C(=O)O Amb32941120 [0,1,0,0,0,1|2,0,0]=4 2773 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb16183875 [0,1,0,0,0,1|2,0,0]=4 2774 B10R0.82 COC(=O)CC[C@@H](N)C(=O)O Amb22746068 [0,1,0,0,0,1|2,0,0]=4 2775 B10R0.82 COC(=O)CC[C@H](N)C(=O)O Amb2720571 [0,1,0,0,0,1|2,0,0]=4 2776 B10R0.82 COC(=O)NC[C@H](O)C(=O)O Amb27670721 [0,1,0,0,0,1|2,0,0]=4 2777 B10R0.82 NC(CCC(=O)NO)C(=O)O Amb22350145 [0,1,0,0,0,1|2,0,0]=4 2778 B10R0.82 NC(CNC(=O)C=O)C(=O)O Amb26082139 [0,1,0,0,0,1|1,0,1]=4 2779 B10R0.82 NC(CNC(=O)CCl)C(=O)O Amb27990068 [0,1,0,0,0,1|1,0,0]=3 2780 B10R0.82 NCC(F)CCC(N)C(=O)O Amb10839781 [0,1,0,0,0,1|1,0,1]=4 2781 B10R0.82 NCC(O)CCC(N)C(=O)O Amb2720125 [0,1,0,0,0,1|0,0,2]=4 2782 B10R0.82 NCC(O)CCC(N)C(=O)O Amb9809250 [0,1,0,0,0,1|0,0,2]=4 2783 B10R0.82 NCC(O)CC[C@H](N)C(=O)O Amb34175411 [0,1,0,0,0,1|0,0,2]=4 2784 B10R0.82 NC[C@@H](O)CC[C@H](N)C(=O)O Amb24117040 [0,1,0,0,0,1|0,0,2]=4 2785 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33802991 [0,1,0,0,0,1|0,0,2]=4 2786 B10R0.82 NC[C@H](O)CC[C@@H](N)C(=O)O Amb33804786 [0,1,0,0,0,1|0,0,2]=4 2787 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb22747912 [0,1,0,0,0,1|0,0,2]=4 2788 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb24121192 [0,1,0,0,0,1|0,0,2]=4 2789 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O Amb35788437 [0,1,0,0,0,1|0,0,2]=4 2790 B10R0.82 NNC(=O)CCC(N)C(=O)O Amb6366546 [0,1,0,0,0,1|1,0,0]=3 2791 B10R0.82 NNC(=O)CC[C@H](N)C(=O)O Amb25379957 [0,1,0,0,0,1|1,0,0]=3 2792 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O Amb27269199 [0,1,0,0,0,1|2,0,0]=4 2793 B10R0.82 N[C@@H](C\C=C(/Cl)CO)C(=O)O Amb27988484 [0,1,0,0,0,1|2,0,0]=4 2794 B10R0.82 O=C(CCl)NCC(O)C(=O)O Amb27990120 [0,1,0,0,0,1|1,0,0]=3 2795 B10R0.98 C=C(Cl)C(=O)NCCC(=O)O Amb27671986 [0,1,0,0,0,1|1,0,1]=4 2796 B10R0.98 CC(=O)CCNC(=O)C(C)C Amb17102871 [0,1,0,0,0,1|2,0,0]=4 2797 B10R0.98 CC(Br)C(=O)NCCC(=O)O Amb27266434 [0,1,0,0,0,1|1,0,0]=3 2798 B10R0.98 CC(Br)C(=O)NCCC(N)=O Amb27987838 [0,1,0,0,0,1|2,0,0]=4 2799 B10R0.98 CC(C)C(=O)CCCC(=O)O Amb6305282 [0,1,0,0,0,1|1,0,0]=3 2800 B10R0.98 CC(C)C(=O)NCCC(=O)O Amb1114300 [0,1,0,0,0,1|1,0,0]=3 2801 B10R0.98 CC(C)C(=O)NCCC(N)=O Amb17232246 [0,1,0,0,0,1|2,0,0]=4 2802 B10R0.98 CC(C)C(=O)NOCC(=O)O Amb27269922 [0,1,0,0,0,1|2,0,0]=4 2803 B10R0.98 CC(Cl)C(=O)NCCC(N)=O Amb9415900 [0,1,0,0,0,1|2,0,0]=4 2804 B10R0.98 CC(N)C(=O)NCCC(=O)O Amb4018751 [0,1,0,0,0,1|0,0,0]=2 2805 B10R0.98 CC(O)CCNC(=O)C(C)N Amb27670792 [0,1,0,0,0,1|1,0,1]=4 2806 B10R0.98 CC(O)CCNC(=O)[C@@H](C)N Amb27670791 [0,1,0,0,0,1|1,0,1]=4 2807 B10R0.98 CC(O)CCNC(=O)[C@H](C)N Amb27670790 [0,1,0,0,0,1|1,0,1]=4 2808 B10R0.98 CN(C)C(=O)CCCC(=O)O Amb7770454 [0,1,0,0,0,1|2,0,0]=4 2809 B10R0.98 CN(C)C(=O)COCC(=O)O Amb6408507 [0,1,0,0,0,1|2,0,0]=4 2810 B10R0.98 CN(C)C(=O)CSCC(=O)O Amb426301 [0,1,0,0,0,1|2,0,0]=4 2811 B10R0.98 CN(C)C(=O)NCCC(=O)O Amb18973180 [0,1,0,0,0,1|2,0,0]=4 2812 B10R0.98 C[C@@H](O)C(=O)NCCC(N)=O Amb27988997 [0,1,0,0,0,1|2,0,0]=4 2813 B10R0.98 C[C@@H](O)CCNC(=O)[C@@H](C)N Amb27987331 [0,1,0,0,0,1|1,0,1]=4 2814 B10R0.98 C[C@H](O)C(=O)NCCC(N)=O Amb28387010 [0,1,0,0,0,1|2,0,0]=4 2815 B10R0.98 NC(=O)CCNC(=O)C(F)F Amb27269795 [0,1,0,0,0,1|2,0,0]=4 2816 B10R0.98 O=C(O)CSCC(=O)C(=O)O Amb33069681 [0,1,0,0,0,1|1,0,1]=4 2817 B10R0.12 C=C(C)CCC(=O)C(C)(C)N Amb27986852 [0,2,0,0,0,0|2,0,0]=4 2818 B10R0.12 CC(=O)CCC(=O)C(C)(C)O Amb27672531 [0,2,0,0,0,0|2,0,0]=4 2819 B10R0.12 CC(=O)CNC(=O)C(C)(C)N Amb25316002 [0,2,0,0,0,0|2,0,0]=4 2820 B10R0.12 CC(C)(C)C(=O)CCC(=O)O Amb6305221 [0,2,0,0,0,0|1,0,0]=3 2821 B10R0.12 CC(C)(C)C(=O)NCC(=O)O Amb436475 [0,2,0,0,0,0|2,0,0]=4 2822 B10R0.12 CC(C)(C)S(=O)CCC(=O)O Amb1085940 [0,2,0,0,0,0|2,0,0]=4 2823 B10R0.12 CC(C)(F)C(=O)NCC(=O)O Amb27600205 [0,2,0,0,0,0|2,0,0]=4 2824 B10R0.12 CC(C)(N)C(=O)NCC(=O)O Amb18290823 [0,2,0,0,0,0|1,0,0]=3 2825 B10R0.12 CC(C)(N)C(=O)NCC(N)=O Amb18974135 [0,2,0,0,0,0|2,0,0]=4 2826 B10R0.12 O=C(O)CCC(=O)C(F)(F)F Amb8396726 [0,2,0,0,0,0|1,0,0]=3 2827 B10R0.12 O=C(O)CCS(=O)C(F)(F)F Amb18307084 [0,2,0,0,0,0|2,0,0]=4 2828 B10R0.12 O=C(O)CNC(=O)C(F)(F)F Amb4013342 [0,2,0,0,0,0|2,0,0]=4 2829 B10R0.12 O=C(O)COC(=O)C(F)(F)F Amb27988477 [0,2,0,0,0,0|2,0,0]=4 2830 B10R0.13 CC(C)C(=O)N(C)CC(=O)O Amb1115376 [0,2,0,0,0,0|2,0,0]=4 2831 B10R0.13 CC(C)S(=O)C(C)CC(=O)O Amb18305769 [0,2,0,0,0,0|2,0,0]=4 2832 B10R0.13 CC(CC(=O)O)S(=O)C(F)F Amb27271638 [0,2,0,0,0,0|2,0,0]=4 2833 B10R0.13 CC(S)C(=O)N(C)CC(=O)O Amb27990230 [0,2,0,0,0,0|2,0,0]=4 2834 B10R0.13 CN(C)C(=O)C(N)CC(=O)O Amb18224399 [0,2,0,0,0,0|2,0,0]=4 2835 B10R0.13 CN(O)C(=O)C(N)CC(=O)O Amb28079798 [0,2,0,0,0,0|2,0,0]=4 2836 B10R0.13 O=C(O)CC(Br)C(=O)C(=O)O Amb33756838 [0,2,0,0,0,0|1,0,1]=4 2837 B10R0.43 CC(C)S(=O)(=O)CCC(=O)O Amb6261108 [0,2,0,0,0,0|2,0,0]=4 2838 B10R0.84 CC(C)\C(CCC(=O)O)=N/O Amb27986433 [0,2,0,0,0,0|1,0,1]=4 2839 B10R0.92 CC(N)C(=O)CCS(C)(=O)=O Amb26651255 [0,2,0,0,0,0|1,0,1]=4 2840 B10R0.92 CC(N)C(=O)NCP(C)(=O)O Amb27793436 [0,2,0,0,0,0|2,0,0]=4 2841 B10R0.92 C[C@H](N)C(=O)NCP(=O)(O)O Amb27401933 [0,2,0,0,0,0|2,0,0]=4 2842 B10R0.93 C=C(NC(=O)C(C)N)C(=O)O Amb27392392 [0,2,0,0,0,0|1,0,1]=4 2843 B10R0.93 CC(=O)C(O)CC(=O)C(C)C Amb27672332 [0,2,0,0,0,0|2,0,0]=4 2844 B10R0.93 CC(Br)C(=O)N[C@@H](C)C(=O)O Amb28436668 [0,2,0,0,0,0|2,0,0]=4 2845 B10R0.93 CC(C)C(=O)CC(C)C(=O)O Amb18182335 [0,2,0,0,0,0|1,0,0]=3 2846 B10R0.93 CC(C)C(=O)CC(N)C(=O)O Amb25385142 [0,2,0,0,0,0|1,0,0]=3 2847 B10R0.93 CC(C)C(=O)CC(N)C(N)=O Amb27269560 [0,2,0,0,0,0|2,0,0]=4 2848 B10R0.93 CC(C)C(=O)C[C@@H](N)C(=O)O Amb28386948 [0,2,0,0,0,0|1,0,0]=3 2849 B10R0.93 CC(C)C(=O)C[C@H](N)C(=O)O Amb25385141 [0,2,0,0,0,0|1,0,0]=3 2850 B10R0.93 CC(C)C(=O)NC(C)C(=O)O Amb1116052 [0,2,0,0,0,0|2,0,0]=4 2851 B10R0.93 CC(C)C(=O)N[C@@H](C)C(=O)O Amb18792069 [0,2,0,0,0,0|2,0,0]=4 2852 B10R0.93 CC(C)C(=O)N[C@H](C)C(=O)O Amb27157731 [0,2,0,0,0,0|2,0,0]=4 2853 B10R0.93 CC(C)S(=O)CC(O)C(=O)O Amb27270945 [0,2,0,0,0,0|2,0,0]=4 2854 B10R0.93 CC(CC(=O)C(=O)O)C(=O)O Amb26660388 [0,2,0,0,0,0|1,0,1]=4 2855 B10R0.93 CC(CS(=O)C(C)C)C(=O)O Amb18305878 [0,2,0,0,0,0|2,0,0]=4 2856 B10R0.93 CC(CS(=O)C(F)F)C(=O)O Amb28386861 [0,2,0,0,0,0|2,0,0]=4 2857 B10R0.93 CC(Cl)C(=O)N[C@H](C)C(=O)O Amb27400292 [0,2,0,0,0,0|2,0,0]=4 2858 B10R0.93 CC(Cl)C(=O)OC(C)C(=O)O Amb27990118 [0,2,0,0,0,0|2,0,0]=4 2859 B10R0.93 CC(N)C(=N)NC(C)C(=O)O Amb28436883 [0,2,0,0,0,0|2,0,0]=4 2860 B10R0.93 CC(N)C(=O)NC(C)C(=O)O Amb4025816 [0,2,0,0,0,0|1,0,0]=3 2861 B10R0.93 CC(N)C(=O)NC(C)C(N)=O Amb9407675 [0,2,0,0,0,0|2,0,0]=4 2862 B10R0.93 CC(N)C(=O)NC(C)[PH](=O)O Amb28118389 [0,2,0,0,0,0|2,0,0]=4 2863 B10R0.93 CC(N)C(=O)N[C@H](C)C(=O)O Amb18179953 [0,2,0,0,0,0|1,0,0]=3 2864 B10R0.93 CC(N)C(=O)N[C@H](C)C(N)=O Amb28141112 [0,2,0,0,0,0|2,0,0]=4 2865 B10R0.93 CC(NC(=O)C(F)F)C(=O)O Amb27272800 [0,2,0,0,0,0|2,0,0]=4 2866 B10R0.93 CC(NC(=O)[C@H](C)N)[PH](=O)O Amb27392973 [0,2,0,0,0,0|2,0,0]=4 2867 B10R0.93 CC(S)C(=O)N[C@H](C)C(=O)O Amb19132999 [0,2,0,0,0,0|2,0,0]=4 2868 B10R0.93 C[C@@H](N)C(=O)N[C@H](C)C(=O)O Amb18179957 [0,2,0,0,0,0|1,0,0]=3 2869 B10R0.93 C[C@@H](N)C(=O)O[C@@H](O)C(=O)O Amb26083732 [0,2,0,0,0,0|1,0,0]=3 2870 B10R0.93 C[C@@H](N)C(=O)O[C@H](C)C(=O)O Amb26084124 [0,2,0,0,0,0|1,0,0]=3 2871 B10R0.93 C[C@H](N)C(=O)N[C@@H](C)C(=O)O Amb33842491 [0,2,0,0,0,0|1,0,0]=3 2872 B10R0.93 C[C@H](N)C(=O)N[C@@H](C)C(=O)O Amb8514727 [0,2,0,0,0,0|1,0,0]=3 2873 B10R0.93 C[C@H](N)C(=O)N[C@@H](C)[PH](=O)O Amb27408467 [0,2,0,0,0,0|2,0,0]=4 2874 B10R0.93 C[C@H](N)C(=O)N[C@H](C)C(=O)O Amb18179958 [0,2,0,0,0,0|1,0,0]=3 2875 B10R0.93 C[C@H](NC(=O)C(Cl)Cl)C(=O)O Amb27870849 [0,2,0,0,0,0|2,0,0]=4 2876 B10R0.93 C[C@H](NC(=O)[C@@H](C)N)C(=O)O Amb27247210 [0,2,0,0,0,0|1,0,0]=3 2877 B10R0.93 C[C@H](OC(=O)C(Cl)Cl)C(=O)O Amb27818531 [0,2,0,0,0,0|2,0,0]=4 2878 B10R0.93 NC(CC(=O)C(=O)O)C(=O)O Amb27671651 [0,2,0,0,0,0|1,0,1]=4 2879 B10R0.93 O=C(O)C(=O)CC(O)C(=O)O Amb17615458 [0,2,0,0,0,0|1,0,1]=4 2880 B10R0.93 O=C(OC(O)C(=O)O)C(O)O Amb27988478 [0,2,0,0,0,0|2,0,0]=4 2881 B10R0.52 C[C@H](NC(=O)CN)P(=O)(O)O Amb28384466 [0,2,0,0,0,0|2,0,0]=4 2882 B10R0.32 C=C(CC(=O)O)C(=O)OCC Amb24086592 [0,2,0,0,0,0|1,0,1]=4 2883 B10R0.32 CC(CC(=O)O)S(=O)CC#N Amb27271654 [0,2,0,0,0,0|1,0,1]=4 2884 B10R0.32 CCCC(=O)N(C)CC(=O)O Amb6249124 [0,2,0,0,0,0|2,0,0]=4 2885 B10R0.32 CCNC(=O)C(C)CC(N)=O Amb17334427 [0,2,0,0,0,0|2,0,0]=4 2886 B10R0.32 CCNC(=O)C(N)CC(=O)O Amb18224398 [0,2,0,0,0,0|1,0,0]=3 2887 B10R0.32 CCNC(=O)[C@H](N)CC(N)=O Amb28080086 [0,2,0,0,0,0|2,0,0]=4 2888 B10R0.32 CCOC(=O)C(N)CC(C)=O Amb32653477 [0,2,0,0,0,0|2,0,0]=4 2889 B10R0.32 CCOC(=O)C(N)CC(C)=O Amb32653478 [0,2,0,0,0,0|2,0,0]=4 2890 B10R0.32 CCOC(=O)N(C)CC(=O)O Amb6251129 [0,2,0,0,0,0|2,0,0]=4 2891 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O Amb22745898 [0,2,0,0,0,0|1,0,0]=3 2892 B10R0.32 COCC(=O)N(C)CC(=O)O Amb1120074 [0,2,0,0,0,0|2,0,0]=4 2893 B10R0.32 CONC(=O)C(N)CC(=O)O Amb27670779 [0,2,0,0,0,0|2,0,0]=4 2894 B10R0.32 N#CNC(=O)C(N)CC(=O)O Amb27209412 [0,2,0,0,0,0|0,0,2]=4 2895 B10R0.46 C=C(CC)CC(N)C(=O)OC Amb33037025 [0,2,0,0,0,0|2,0,0]=4 2896 B10R0.46 CC(CC(=O)NN)C(=O)NN Amb26869176 [0,2,0,0,0,0|2,0,0]=4 2897 B10R0.46 CCC(=O)C(C)NC(=O)OC Amb27818513 [0,2,0,0,0,0|2,0,0]=4 2898 B10R0.46 CCC(=O)CC(=O)C(=O)OC Amb24066601 [0,2,0,0,0,0|1,0,1]=4 2899 B10R0.46 CCC(=O)CC(N)C(=O)OC Amb32789392 [0,2,0,0,0,0|1,0,0]=3 2900 B10R0.46 CCC(=O)NC(C)C(=O)NO Amb27649007 [0,2,0,0,0,0|2,0,0]=4 2901 B10R0.46 CCC(=O)N[C@H](C)C(=O)OC Amb27266625 [0,2,0,0,0,0|2,0,0]=4 2902 B10R0.46 CNC(=O)C(N)CC(=O)OC Amb27671619 [0,2,0,0,0,0|2,0,0]=4 2903 B10R0.46 CNC(=O)CC(N)C(=O)OC Amb27671628 [0,2,0,0,0,0|2,0,0]=4 2904 B10R0.46 CNC(=O)[C@@H](C)NC(=O)CN Amb29890804 [0,2,0,0,0,0|2,0,0]=4 2905 B10R0.46 CNC(=O)[C@H](C)NC(=O)CN Amb27231834 [0,2,0,0,0,0|2,0,0]=4 2906 B10R0.46 COC(=O)C(C)CC(=O)NO Amb27987382 [0,2,0,0,0,0|2,0,0]=4 2907 B10R0.46 COC(=O)C(C)NC(=O)CBr Amb17332522 [0,2,0,0,0,0|2,0,0]=4 2908 B10R0.46 COC(=O)C(C)NC(=O)CCl Amb17332132 [0,2,0,0,0,0|2,0,0]=4 2909 B10R0.46 COC(=O)CC(C)C(=O)OC Amb21964553 [0,2,0,0,0,0|2,0,0]=4 2910 B10R0.46 COC(=O)CC(N)C(=O)OC Amb18126274 [0,2,0,0,0,0|2,0,0]=4 2911 B10R0.46 COC(=O)CC(N)C(=O)OC Amb6366547 [0,2,0,0,0,0|2,0,0]=4 2912 B10R0.46 COC(=O)CC(O)C(=O)OC Amb3939692 [0,2,0,0,0,0|2,0,0]=4 2913 B10R0.46 COC(=O)C[C@@H](Br)C(=O)OC Amb22747395 [0,2,0,0,0,0|2,0,0]=4 2914 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC Amb15692786 [0,2,0,0,0,0|2,0,0]=4 2915 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb16183880 [0,2,0,0,0,0|2,0,0]=4 2916 B10R0.46 COC(=O)C[C@@H](N)C(=O)OC Amb19372612 [0,2,0,0,0,0|2,0,0]=4 2917 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC Amb3939675 [0,2,0,0,0,0|2,0,0]=4 2918 B10R0.46 COC(=O)C[C@H](C)C(=O)OC Amb22226743 [0,2,0,0,0,0|2,0,0]=4 2919 B10R0.46 COC(=O)C[C@H](N)C(=O)OC Amb6211510 [0,2,0,0,0,0|2,0,0]=4 2920 B10R0.46 COC(=O)C[C@H](O)C(=O)OC Amb3939687 [0,2,0,0,0,0|2,0,0]=4 2921 B10R0.46 COC(=O)N(C)CC(=O)NN Amb27272207 [0,2,0,0,0,0|2,0,0]=4 2922 B10R0.46 COC(=O)N(C)CC(=O)NN Amb27988672 [0,2,0,0,0,0|2,0,0]=4 2923 B10R0.46 COC(=O)[C@@H](C)NC(=O)CBr Amb27266494 [0,2,0,0,0,0|2,0,0]=4 2924 B10R0.46 COC(=O)[C@@H](C)NC(=O)CCl Amb18796198 [0,2,0,0,0,0|2,0,0]=4 2925 B10R0.46 NNC(=O)CC(O)C(=O)NN Amb26482844 [0,2,0,0,0,0|2,0,0]=4 2926 B10R0.46 NNC(=O)CC(S)C(=O)NN Amb27758208 [0,2,0,0,0,0|2,0,0]=4 2927 B10R0.54 CCC(=O)N(CC)CC(=O)O Amb17400037 [0,2,0,0,0,0|2,0,0]=4 2928 B10R0.54 CNC(=O)C(CC(=O)O)OC Amb23536084 [0,2,0,0,0,0|2,0,0]=4 2929 B10R0.56 CC(=O)[C@@H](O)[C@@H](O)C(=O)CO Amb27672418 [0,2,0,0,0,0|2,0,0]=4 2930 B10R0.56 CC(C(=O)O)N(C)C(=O)CCl Amb27990117 [0,2,0,0,0,0|2,0,0]=4 2931 B10R0.56 CC(C(=O)O)N(C)C(=O)CN Amb18299750 [0,2,0,0,0,0|1,0,0]=3 2932 B10R0.56 CC(C(=O)O)N(O)C(=O)CN Amb27990216 [0,2,0,0,0,0|1,0,0]=3 2933 B10R0.56 CCC(=O)C(C)C(C)C(C)=O Amb27672664 [0,2,0,0,0,0|2,0,0]=4 2934 B10R0.56 CCC(=O)N(C)C(C)C(=O)O Amb18994668 [0,2,0,0,0,0|2,0,0]=4 2935 B10R0.56 CCC(=O)[C@@H](C)[C@H](N)C(=O)O Amb27990250 [0,2,0,0,0,0|1,0,0]=3 2936 B10R0.56 CCC(=O)[C@H](C)[C@H](N)C(=O)O Amb27990251 [0,2,0,0,0,0|1,0,0]=3 2937 B10R0.56 CNC(=O)C(O)C(O)C(=O)O Amb27176596 [0,2,0,0,0,0|2,0,0]=4 2938 B10R0.56 CNC(=O)[C@H](O)[C@@H](O)C(=O)O Amb27617308 [0,2,0,0,0,0|2,0,0]=4 2939 B10R0.56 COC(=O)C(F)C(N)C(=O)O Amb27671674 [0,2,0,0,0,0|2,0,0]=4 2940 B10R0.56 COC(=O)C(F)[C@H](N)C(=O)O Amb26083722 [0,2,0,0,0,0|2,0,0]=4 2941 B10R0.56 COC(=O)C(N)C(C)C(=O)O Amb27673475 [0,2,0,0,0,0|2,0,0]=4 2942 B10R0.56 COC(=O)C(O)C(N)C(=O)O Amb18645752 [0,2,0,0,0,0|2,0,0]=4 2943 B10R0.56 COC(=O)C(O)C(O)C(=O)O Amb25384902 [0,2,0,0,0,0|2,0,0]=4 2944 B10R0.56 COC(=O)[C@@H](C)[C@H](C)C(=O)O Amb27990012 [0,2,0,0,0,0|2,0,0]=4 2945 B10R0.56 COC(=O)[C@@H](O)[C@H](N)C(=O)O Amb27271132 [0,2,0,0,0,0|2,0,0]=4 2946 B10R0.56 COC(=O)[C@@H](O)[C@H](O)C(=O)O Amb24764738 [0,2,0,0,0,0|2,0,0]=4 2947 B10R0.56 COC(=O)[C@H](O)[C@@H](O)C(=O)O Amb24763072 [0,2,0,0,0,0|2,0,0]=4 2948 B10R0.56 C[C@@H](C(=O)O)N(C)C(=O)CCl Amb27990093 [0,2,0,0,0,0|2,0,0]=4 2949 B10R0.56 C[C@@H](C(=O)O)N(C)C(=O)CN Amb27990269 [0,2,0,0,0,0|1,0,0]=3 2950 B10R0.56 NNC(=O)C(O)C(O)C(N)=O Amb28208291 [0,2,0,0,0,0|2,0,0]=4 2951 B10R0.56 N[C@@H](C(=O)O)[C@H](O)C(=O)NO Amb27823329 [0,2,0,0,0,0|2,0,0]=4 2952 B10R0.56 O=C(O)[C@@H](O)[C@H](O)C(=O)CO Amb27988486 [0,2,0,0,0,0|1,0,0]=3 2953 B10R0.141 CCC(=O)C(C)(C)CC(C)=O Amb27672641 [0,2,0,0,0,0|2,0,0]=4 2954 B10R0.141 CCC(=O)[C@@](C)(O)CC(C)=O Amb27672471 [0,2,0,0,0,0|2,0,0]=4 2955 B10R0.141 CNC(=O)C(C)(C)CC(=O)O Amb25032544 [0,2,0,0,0,0|2,0,0]=4 2956 B10R0.141 COC(=O)C(C)(C)CC(=O)O Amb16232092 [0,2,0,0,0,0|2,0,0]=4 2957 B10R0.141 COC(=O)C(F)(F)CC(=O)O Amb25385023 [0,2,0,0,0,0|2,0,0]=4 2958 B10R0.108 CC#CC(=O)CCC(=O)OC Amb27673589 [0,2,0,0,0,0|1,0,1]=4 2959 B10R0.108 CCNC(=O)CC\C(C)=N\O Amb26998104 [0,2,0,0,0,0|2,0,0]=4 2960 B10R0.108 CCNC(=O)CNC(=O)OC Amb28387489 [0,2,0,0,0,0|2,0,0]=4 2961 B10R0.108 CCOC(=O)CCC(=O)CBr Amb17406254 [0,2,0,0,0,0|1,0,0]=3 2962 B10R0.108 CCOC(=O)CCC(=O)CC Amb6305806 [0,2,0,0,0,0|1,0,0]=3 2963 B10R0.108 CCOC(=O)CCC(=O)CCl Amb22395166 [0,2,0,0,0,0|1,0,0]=3 2964 B10R0.108 CCOC(=O)CNC(=O)CC Amb17775264 [0,2,0,0,0,0|2,0,0]=4 2965 B10R0.108 CCOC(=O)CNC(=O)CCl Amb2720185 [0,2,0,0,0,0|2,0,0]=4 2966 B10R0.108 CCOC(=O)CNC(=O)CN Amb3978910 [0,2,0,0,0,0|1,0,0]=3 2967 B10R0.108 CCOC(=O)CNC(=O)CN Amb4086318 [0,2,0,0,0,0|1,0,0]=3 2968 B10R0.108 CCOC(=O)CNC(=O)NO Amb25384490 [0,2,0,0,0,0|2,0,0]=4 2969 B10R0.108 CCOC(=O)CNC(=O)OC Amb13952620 [0,2,0,0,0,0|2,0,0]=4 2970 B10R0.108 COC(=O)CCC(C)CCN Amb19515451 [0,2,0,0,0,0|1,0,1]=4 2971 B10R0.108 COC(=O)CNC(=O)CCBr Amb17328425 [0,2,0,0,0,0|2,0,0]=4 2972 B10R0.108 COC(=O)CNC(=O)CCCl Amb1131800 [0,2,0,0,0,0|2,0,0]=4 2973 B10R0.108 COC(=O)CNC(=O)CCN Amb22551883 [0,2,0,0,0,0|1,0,0]=3 2974 B10R0.108 CONC(=O)CNC(=O)CN Amb27670776 [0,2,0,0,0,0|1,0,0]=3 2975 B10R0.108 [C-]#[N+]CC(=O)NCC(=O)OC Amb2688928 [0,2,0,0,0,0|1,0,1]=4 2976 B10R0.26 C#CCC(=O)NC(C)C(=O)O Amb28456822 [0,2,0,0,0,0|2,0,0]=4 2977 B10R0.26 C=CCS(=O)C[C@@H](N)C(=O)O Amb16193379 [0,2,0,0,0,0|2,0,0]=4 2978 B10R0.26 C=CCS(=O)C[C@H](N)C(=O)O Amb10843492 [0,2,0,0,0,0|2,0,0]=4 2979 B10R0.26 CC(CS(=O)CC#N)C(=O)O Amb28386863 [0,2,0,0,0,0|1,0,1]=4 2980 B10R0.26 CC(NC(=O)CCN)C(=O)O Amb18304954 [0,2,0,0,0,0|1,0,0]=3 2981 B10R0.26 CC(NC(=O)CCN)C(N)=O Amb9407640 [0,2,0,0,0,0|2,0,0]=4 2982 B10R0.26 CCCC(=O)CC(N)C(=O)O Amb33065496 [0,2,0,0,0,0|1,0,0]=3 2983 B10R0.26 CCCC(=O)CC(N)C(N)=O Amb33036932 [0,2,0,0,0,0|2,0,0]=4 2984 B10R0.26 CCCC(=O)C[C@@H](N)C(=O)O Amb33036798 [0,2,0,0,0,0|1,0,0]=3 2985 B10R0.26 CCCC(=O)C[C@H](N)C(=O)O Amb33065790 [0,2,0,0,0,0|1,0,0]=3 2986 B10R0.26 CCCC(=O)NC(C)C(=O)O Amb5741699 [0,2,0,0,0,0|2,0,0]=4 2987 B10R0.26 CCCC(=O)N[C@@H](C)C(=O)O Amb18179870 [0,2,0,0,0,0|2,0,0]=4 2988 B10R0.26 CCCS(=O)C[C@@H](N)C(=O)O Amb22904243 [0,2,0,0,0,0|2,0,0]=4 2989 B10R0.26 CCNC(=O)CC(C)C(N)=O Amb17334425 [0,2,0,0,0,0|2,0,0]=4 2990 B10R0.26 CCNC(=O)CC(N)C(=O)O Amb27990016 [0,2,0,0,0,0|1,0,0]=3 2991 B10R0.26 CCNC(=O)CC(O)C(N)=O Amb27272122 [0,2,0,0,0,0|2,0,0]=4 2992 B10R0.26 CCOC(=O)CC(Br)C(=O)O Amb18659113 [0,2,0,0,0,0|1,0,0]=3 2993 B10R0.26 CCOC(=O)CC(Br)C(C)=O Amb17406255 [0,2,0,0,0,0|2,0,0]=4 2994 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4017449 [0,2,0,0,0,0|1,0,0]=3 2995 B10R0.26 CCOC(=O)CC(N)C(=O)O Amb4019239 [0,2,0,0,0,0|1,0,0]=3 2996 B10R0.26 CCOC(=O)CC(O)C(=O)O Amb33362320 [0,2,0,0,0,0|1,0,0]=3 2997 B10R0.26 CCOC(=O)C[C@H](Br)C(=O)O Amb32653240 [0,2,0,0,0,0|1,0,0]=3 2998 B10R0.26 CCOC(=O)NC(C)C(=O)O Amb6248353 [0,2,0,0,0,0|2,0,0]=4 2999 B10R0.26 CCOC(=O)N[C@H](C)C(=O)O Amb24761982 [0,2,0,0,0,0|2,0,0]=4 3000 B10R0.26 CCSC(=O)N[C@@H](C)C(=O)O Amb27990273 [0,2,0,0,0,0|2,0,0]=4 3001 B10R0.26 CNCC(=O)NC(C)C(N)=O Amb9407674 [0,2,0,0,0,0|2,0,0]=4 3002 B10R0.26 CNCC(=O)N[C@@H](C)C(N)=O Amb27267009 [0,2,0,0,0,0|2,0,0]=4 3003 B10R0.26 COCC(=O)CC(N)C(=O)O Amb32789418 [0,2,0,0,0,0|1,0,0]=3 3004 B10R0.26 COCC(=O)CC(N)C(N)=O Amb33065478 [0,2,0,0,0,0|2,0,0]=4 3005 B10R0.26 COCC(=O)C[C@@H](N)C(=O)O Amb33308520 [0,2,0,0,0,0|1,0,0]=3 3006 B10R0.26 COCC(=O)C[C@H](N)C(=O)O Amb33036839 [0,2,0,0,0,0|1,0,0]=3 3007 B10R0.26 COCC(=O)NC(C)C(=O)O Amb9705107 [0,2,0,0,0,0|2,0,0]=4 3008 B10R0.26 COCC(=O)N[C@@H](C)C(=O)O Amb18179995 [0,2,0,0,0,0|2,0,0]=4 3009 B10R0.26 CSCC(=O)NC(C)C(=O)O Amb6743913 [0,2,0,0,0,0|2,0,0]=4 3010 B10R0.26 C[C@@H](NC(=O)CCN)C(=O)O Amb18179956 [0,2,0,0,0,0|1,0,0]=3 3011 B10R0.26 C[C@@H](NC(=O)CCS)C(=O)O Amb27271136 [0,2,0,0,0,0|2,0,0]=4 3012 B10R0.26 C[C@H](NC(=O)CC#N)C(=O)O Amb27401826 [0,2,0,0,0,0|1,0,1]=4 3013 B10R0.26 C[C@H](NC(=O)CCN)C(=O)O Amb26660401 [0,2,0,0,0,0|1,0,0]=3 3014 B10R0.26 C[C@H](NC(=O)CCN)C(N)=O Amb27267008 [0,2,0,0,0,0|2,0,0]=4 3015 B10R0.26 C\C(=C/CO)C[C@H](N)C(=O)O Amb27990183 [0,2,0,0,0,0|2,0,0]=4 3016 B10R0.26 N#CCS(=O)CC(N)C(=O)O Amb26081512 [0,2,0,0,0,0|1,0,1]=4 3017 B10R0.26 N#CCS(=O)C[C@H](N)C(=O)O Amb26998029 [0,2,0,0,0,0|1,0,1]=4 3018 B10R0.26 NCCC(Cl)CC(N)C(=O)O Amb29838276 [0,2,0,0,0,0|1,0,1]=4 3019 B10R0.26 NCCC(O)CC(N)C(=O)O Amb31031050 [0,2,0,0,0,0|0,0,2]=4 3020 B10R0.26 NCCS(=O)CC(=O)C(=O)O Amb33069856 [0,2,0,0,0,0|1,0,1]=4 3021 B10R0.47 C=C(CC)CC(C)(C)C(=O)O Amb27670923 [0,2,0,0,0,0|2,0,0]=4 3022 B10R0.47 CC(C)(CC(=O)CN)C(=O)O Amb27990161 [0,2,0,0,0,0|0,0,0]=2 3023 B10R0.47 CC(C)(NC(=O)CCl)C(=O)O Amb840464 [0,2,0,0,0,0|2,0,0]=4 3024 B10R0.47 CC(C)(NC(=O)CN)C(N)=O Amb18290644 [0,2,0,0,0,0|2,0,0]=4 3025 B10R0.47 CC(C)(OC(=O)CCl)C(=O)O Amb27990079 [0,2,0,0,0,0|2,0,0]=4 3026 B10R0.47 CCC(=O)NC(C)(C)C(=O)O Amb18290758 [0,2,0,0,0,0|2,0,0]=4 3027 B10R0.47 CCC(=O)OC(C)(C)C(=O)O Amb27990234 [0,2,0,0,0,0|2,0,0]=4 3028 B10R0.47 CCS(=O)CC(C)(C)C(=O)O Amb27269275 [0,2,0,0,0,0|2,0,0]=4 3029 B10R0.47 CCS(=O)CC(F)(F)C(=O)O Amb33169914 [0,2,0,0,0,0|2,0,0]=4 3030 B10R0.47 CNC(=O)CC(C)(C)C(=O)O Amb24707522 [0,2,0,0,0,0|2,0,0]=4 3031 B10R0.47 COC(=O)CC(C)(C)C(=O)O Amb16232093 [0,2,0,0,0,0|2,0,0]=4 3032 B10R0.53 CCC(=O)NC(CC)C(=O)O Amb5741741 [0,2,0,0,0,0|2,0,0]=4 3033 B10R0.53 CCC(=O)N[C@@H](CC)C(=O)O Amb27672238 [0,2,0,0,0,0|2,0,0]=4 3034 B10R0.53 CCC(=O)N[C@@H](CS)C(=O)O Amb17619566 [0,2,0,0,0,0|2,0,0]=4 3035 B10R0.53 CCC(=O)N[C@H](CS)C(=O)O Amb27989798 [0,2,0,0,0,0|2,0,0]=4 3036 B10R0.53 CCC(NC(=O)CCl)C(=O)O Amb22343239 [0,2,0,0,0,0|2,0,0]=4 3037 B10R0.53 CCC(NC(=O)CN)C(=O)O Amb19009859 [0,2,0,0,0,0|1,0,0]=3 3038 B10R0.53 CC[C@@H](NC(=O)CN)C(=O)O Amb24755319 [0,2,0,0,0,0|1,0,0]=3 3039 B10R0.53 CC[C@H](NC(=O)CCl)C(=O)O Amb27272568 [0,2,0,0,0,0|2,0,0]=4 3040 B10R0.53 CC[C@H](NC(=O)CN)C(=O)O Amb27272566 [0,2,0,0,0,0|1,0,0]=3 3041 B10R0.53 C\C=C(\NC(=O)CN)C(=O)O Amb28411010 [0,2,0,0,0,0|1,0,1]=4 3042 B10R0.53 NCC(=O)NC(CO)C(=O)O Amb557297 [0,2,0,0,0,0|1,0,0]=3 3043 B10R0.53 NCC(=O)N[C@@H](CO)C(=O)O Amb18180042 [0,2,0,0,0,0|1,0,0]=3 3044 B10R0.53 NCC(=O)N[C@@H](CS)C(=O)O Amb26660629 [0,2,0,0,0,0|1,0,0]=3 3045 B10R0.53 NCC(=O)N[C@H](CO)C(=O)O Amb22230741 [0,2,0,0,0,0|1,0,0]=3 3046 B10R0.53 O=C(CCl)NC(CO)C(=O)O Amb3940605 [0,2,0,0,0,0|2,0,0]=4 3047 B10R0.53 O=C(CCl)N[C@@H](CO)C(=O)O Amb27990067 [0,2,0,0,0,0|2,0,0]=4 3048 B10R0.53 O=C(CCl)N[C@@H](CS)C(=O)O Amb27990119 [0,2,0,0,0,0|2,0,0]=4 3049 B10R0.67 CCP(=O)(O)CC(C)C(=O)O Amb27990021 [0,2,0,0,0,0|2,0,0]=4 3050 B10R0.67 CCS(=O)(=O)CC(C)C(=O)O Amb9400267 [0,2,0,0,0,0|2,0,0]=4 3051 B10R0.67 CCS(=O)(=O)CC(O)C(=O)O Amb27270946 [0,2,0,0,0,0|2,0,0]=4 3052 B10R0.67 NCC(F)(F)C[C@@H](N)C(=O)O Amb25383715 [0,2,0,0,0,0|1,0,1]=4 3053 B10R0.27 CCC(CCC(=O)O)N=C=O Amb33471400 [0,2,0,0,0,0|1,0,1]=4 3054 B10R0.78 C#CCCC(=O)CCC(=O)O Amb32676703 [0,2,0,0,0,0|1,0,0]=3 3055 B10R0.78 C#CCNC(=O)CCC(=O)O Amb9390618 [0,2,0,0,0,0|1,0,0]=3 3056 B10R0.78 C#CCOC(=O)CCC(=O)O Amb6346606 [0,2,0,0,0,0|1,0,0]=3 3057 B10R0.78 C#CCOC(=O)NCC(=O)O Amb27266689 [0,2,0,0,0,0|2,0,0]=4 3058 B10R0.78 C=CCCC(=O)NCC(=O)O Amb18182182 [0,2,0,0,0,0|2,0,0]=4 3059 B10R0.78 C=CCNC(=O)CCC(=O)Cl Amb17142951 [0,2,0,0,0,0|2,0,0]=4 3060 B10R0.78 C=CCNC(=O)CCC(=O)O Amb1771046 [0,2,0,0,0,0|1,0,0]=3 3061 B10R0.78 C=CCNC(=O)CNC(=O)O Amb27988669 [0,2,0,0,0,0|2,0,0]=4 3062 B10R0.78 C=CCNC(=O)NCC(=O)O Amb1136414 [0,2,0,0,0,0|2,0,0]=4 3063 B10R0.78 C=CCOC(=O)CCC(=O)O Amb6542993 [0,2,0,0,0,0|1,0,0]=3 3064 B10R0.78 C=CCOC(=O)NCC(=O)O Amb18126174 [0,2,0,0,0,0|2,0,0]=4 3065 B10R0.78 CC(=O)CCC(=O)OCCBr Amb33276557 [0,2,0,0,0,0|2,0,0]=4 3066 B10R0.78 CCCCC(=O)CCC(=O)O Amb6305230 [0,2,0,0,0,0|1,0,0]=3 3067 B10R0.78 CCCCC(=O)NCC(=O)O Amb2794084 [0,2,0,0,0,0|2,0,0]=4 3068 B10R0.78 CCCNC(=O)CCC(=O)Cl Amb17142965 [0,2,0,0,0,0|2,0,0]=4 3069 B10R0.78 CCCNC(=O)CCC(=O)O Amb1783633 [0,2,0,0,0,0|1,0,0]=3 3070 B10R0.78 CCCNC(=O)CCC(N)=O Amb17142885 [0,2,0,0,0,0|2,0,0]=4 3071 B10R0.78 CCCNC(=O)CNC(=O)O Amb27988663 [0,2,0,0,0,0|2,0,0]=4 3072 B10R0.78 CCCNC(=O)NCC(=O)O Amb1137768 [0,2,0,0,0,0|2,0,0]=4 3073 B10R0.78 CCCOC(=O)CCC(C)=O Amb15692711 [0,2,0,0,0,0|2,0,0]=4 3074 B10R0.78 CC\C=C\C(=O)NCC(=O)O Amb27270420 [0,2,0,0,0,0|2,0,0]=4 3075 B10R0.78 C\C=C\CC(=O)NCC(=O)O Amb2761023 [0,2,0,0,0,0|2,0,0]=4 3076 B10R0.78 N#CCNC(=O)CCC(=O)O Amb18305340 [0,2,0,0,0,0|0,0,1]=3 3077 B10R0.78 O=C(O)CCC(=O)NCCO Amb17131338 [0,2,0,0,0,0|1,0,0]=3 3078 B10R0.78 O=C(O)CCC(=O)NCCS Amb32669007 [0,2,0,0,0,0|1,0,0]=3 3079 B10R0.78 [N-]=[N+]=NCC(=O)NCC(=O)O Amb26082990 [0,2,0,0,0,0|1,0,1]=4 3080 B10R0.96 CC(=O)CC(=O)NCC(=O)O Amb19011373 [0,2,0,0,0,0|2,0,0]=4 3081 B10R0.96 CC(=O)CCC(=O)NC(C)C Amb17334411 [0,2,0,0,0,0|2,0,0]=4 3082 B10R0.96 CC(C)CC(=O)NCC(=O)O Amb1113772 [0,2,0,0,0,0|2,0,0]=4 3083 B10R0.96 CC(C)NC(=O)CCC(N)=O Amb17142886 [0,2,0,0,0,0|2,0,0]=4 3084 B10R0.96 CC(C)NC(=O)NCC(=O)O Amb1129399 [0,2,0,0,0,0|2,0,0]=4 3085 B10R0.96 CC(Cl)CC(=O)NCC(=O)O Amb27990069 [0,2,0,0,0,0|2,0,0]=4 3086 B10R0.96 CN(C)NC(=O)CCC(=O)O Amb2774317 [0,2,0,0,0,0|1,0,0]=3 3087 B10R0.96 CN(C)NC(=O)NCC(=O)O Amb27758357 [0,2,0,0,0,0|2,0,0]=4 3088 B10R0.96 CN(CCC(=O)O)CC(N)=O Amb8957129 [0,2,0,0,0,0|2,0,0]=4 3089 B10R0.96 NC(=O)CC(=O)NCC(=O)O Amb27271867 [0,2,0,0,0,0|1,0,0]=3 3090 B10R0.96 NC(=O)CNC(=O)CC(N)=O Amb27272087 [0,2,0,0,0,0|2,0,0]=4 3091 B10R0.96 NC(=O)NC(=O)NCC(=O)O Amb27444706 [0,2,0,0,0,0|1,0,1]=4 3092 B10R0.96 O=C(O)CNC(=O)CC(=O)O Amb18800491 [0,2,0,0,0,0|2,0,0]=4 3093 B10R0.105 C#CCS(=O)(=O)CCC(=O)O Amb17501292 [0,2,0,0,0,0|2,0,0]=4 3094 B10R0.105 C=CCS(=O)(=O)CCC(=O)O Amb17501262 [0,2,0,0,0,0|2,0,0]=4 3095 B10R0.105 CC(C)(CCN)CCC(=O)O Amb18199857 [0,2,0,0,0,0|1,0,1]=4 3096 B10R0.105 CC(C)(CCN)CCC(=O)O Amb19148308 [0,2,0,0,0,0|1,0,1]=4 3097 B10R0.105 CCCS(=O)(=O)CCC(=O)O Amb6281323 [0,2,0,0,0,0|2,0,0]=4 3098 B10R0.105 N#CCS(=O)(=O)CCC(=O)O Amb6259095 [0,2,0,0,0,0|1,0,1]=4 3099 B10R0.105 O=C(O)CCS(=O)(=O)CCCl Amb22359198 [0,2,0,0,0,0|2,0,0]=4 3100 B8R1.1 C=C1CN[C@H](CO)C1 Amb27205082 [1,0,0,1,0,0|1,0,1]=4 3101 B8R1.1 C=CC1CCC(=O)C1 Amb26592031 [1,0,0,1,0,0|2,0,0]=4 3102 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [1,0,0,1,0,0|2,0,0]=4 3103 B8R1.1 NCC1=NC(=O)CS1 Amb35679385 [1,0,0,1,0,0|2,0,0]=4 3104 B8R1.1 NCC1CCC(=O)C1 Amb24644946 [1,0,0,1,0,0|1,0,1]=4 3105 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [1,0,0,1,0,0|1,0,1]=4 3106 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [1,0,0,1,0,0|1,0,1]=4 3107 B8R1.1 NCC1CCC(=O)N1 Amb2699145 [1,0,0,1,0,0|1,0,1]=4 3108 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [1,0,0,1,0,0|0,0,2]=4 3109 B8R1.1 NCC1CCC(=O)O1 Amb28934914 [1,0,0,1,0,0|0,0,2]=4 3110 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [1,0,0,1,0,0|1,0,1]=4 3111 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb2699146 [1,0,0,1,0,0|1,0,1]=4 3112 B8R1.1 NC[C@H]1CCC(=O)N1 Amb2699147 [1,0,0,1,0,0|1,0,1]=4 3113 B8R1.1 NC[C@H]1CCC(=O)N1 Amb32721612 [1,0,0,1,0,0|1,0,1]=4 3114 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [1,0,0,1,0,0|1,0,1]=4 3115 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [1,0,0,1,0,0|1,0,1]=4 3116 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [1,0,0,1,0,0|1,0,1]=4 3117 B8R1.1 O=C1COC(CO)C1 Amb24117838 [1,0,0,1,0,0|1,0,1]=4 3118 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [1,0,0,1,0,0|1,0,0]=3 3119 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [1,0,0,1,0,0|2,0,0]=4 3120 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [1,0,0,1,0,0|2,0,0]=4 3121 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [1,0,0,1,0,0|2,0,0]=4 3122 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [1,0,0,1,0,0|2,0,0]=4 3123 B8R1.1 O=C[C@H]1CCC(=O)O1 Amb27964499 [1,0,0,1,0,0|2,0,0]=4 3124 B8R1.1 O=C[C@H]1CCC(=O)S1 Amb27792268 [1,0,0,1,0,0|2,0,0]=4 3125 B8R1.2 NCC1=COCCC1 Amb27202637 [1,0,0,1,0,0|1,0,1]=4 3126 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [1,0,0,1,0,0|2,0,0]=4 3127 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [1,0,0,1,0,0|2,0,0]=4 3128 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [1,0,0,1,0,0|2,0,0]=4 3129 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [1,0,0,1,0,0|1,0,1]=4 3130 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [1,0,0,1,0,0|1,0,1]=4 3131 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [1,0,0,1,0,0|1,0,1]=4 3132 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [1,0,0,1,0,0|1,0,1]=4 3133 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [1,0,0,1,0,0|1,0,1]=4 3134 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [1,0,0,1,0,0|1,0,1]=4 3135 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [1,0,0,1,0,0|1,0,1]=4 3136 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [1,0,0,1,0,0|1,0,1]=4 3137 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [1,0,0,1,0,0|1,0,1]=4 3138 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [1,0,0,1,0,0|1,0,1]=4 3139 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [1,0,0,1,0,0|1,0,1]=4 3140 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [1,0,0,1,0,0|1,0,0]=3 3141 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [1,0,0,1,0,0|0,0,0]=2 3142 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [1,0,0,1,0,0|1,0,0]=3 3143 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [1,0,0,1,0,0|1,0,0]=3 3144 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [1,0,0,1,0,0|1,0,1]=4 3145 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [1,0,0,1,0,0|0,0,2]=4 3146 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [1,0,0,1,0,0|2,0,0]=4 3147 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [1,0,0,1,0,0|0,0,2]=4 3148 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [1,0,0,1,0,0|0,0,2]=4 3149 B8R1.3 O=C1CNC(=O)C=N1 Amb27838363 [1,0,0,1,0,0|1,0,1]=4 3150 B8R1.3 O=C1CNC(=O)CN1 Amb1011605 [1,0,0,1,0,0|1,0,0]=3 3151 B8R1.3 O=C1CNC(=O)NN1 Amb27655538 [1,0,0,1,0,0|2,0,0]=4 3152 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [1,0,0,1,0,0|1,0,0]=3 3153 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [1,0,0,1,0,0|2,0,0]=4 3154 B8R1.3 O=C1CSC(=O)SC1 Amb28074747 [1,0,0,1,0,0|2,0,0]=4 3155 B8R1.5 CC1OCCCC1=O Amb28048940 [1,0,0,1,0,0|1,0,1]=4 3156 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [1,0,0,1,0,0|1,0,1]=4 3157 B8R1.5 NC1CCCCC1=O Amb17939051 [1,0,0,1,0,0|1,0,1]=4 3158 B8R1.5 NC1CCCCC1=O Amb22001819 [1,0,0,1,0,0|1,0,1]=4 3159 B8R1.5 NC1CNCCC1=O Amb27635311 [1,0,0,1,0,0|2,0,0]=4 3160 B8R1.5 NC1COCCC1=O Amb18833021 [1,0,0,1,0,0|2,0,0]=4 3161 B8R1.5 NC1COCCC1=O Amb32670691 [1,0,0,1,0,0|2,0,0]=4 3162 B8R1.5 NC1CSCCC1=O Amb4296938 [1,0,0,1,0,0|2,0,0]=4 3163 B8R1.10 O=CCCC1=CCC1 Amb28130448 [1,0,0,1,0,0|2,0,0]=4 3164 B8R1.13 C=CCC1CCC1=O Amb17593141 [1,0,0,1,0,0|2,0,0]=4 3165 B8R1.22 O=C1CC=COCC1 Amb27835241 [1,0,0,1,0,0|1,0,1]=4 3166 B8R1.22 O=C1CCC=CCC1 Amb22230447 [1,0,0,1,0,0|2,0,0]=4 3167 B8R1.22 O=C1CCC=COC1 Amb27812549 [1,0,0,1,0,0|2,0,0]=4 3168 B8R1.22 O=C1CCCCNC1 Amb22000936 [1,0,0,1,0,0|1,0,1]=4 3169 B8R1.22 O=C1CCCCNC1 Amb25922210 [1,0,0,1,0,0|1,0,1]=4 3170 B8R1.22 O=C1CCCOCC1 Amb25873789 [1,0,0,1,0,0|1,0,1]=4 3171 B8R1.38 CCC(=O)C1CCO1 Amb28368772 [1,0,0,1,0,0|1,0,1]=4 3172 B8R1.38 NCC(=O)C1CCC1 Amb24524254 [1,0,0,1,0,0|1,0,1]=4 3173 B8R1.38 NCC(=O)C1CCC1 Amb29083365 [1,0,0,1,0,0|1,0,1]=4 3174 B8R1.40 CCC(=O)CC1CO1 Amb28316245 [1,0,0,1,0,0|1,0,1]=4 3175 B8R1.40 NCC(=O)CC1CC1 Amb18203369 [1,0,0,1,0,0|1,0,1]=4 3176 B8R1.40 NCC(=O)CC1CC1 Amb32410146 [1,0,0,1,0,0|1,0,1]=4 3177 B8R1.46 NC1C(=O)NC1CO Amb27985586 [1,0,0,1,0,0|1,0,1]=4 3178 B8R1.46 N[C@@H]1C(=O)N[C@@H]1CO Amb28058411 [1,0,0,1,0,0|1,0,1]=4 3179 B8R1.46 O=C1CC(CO)C1F Amb27973059 [1,0,0,1,0,0|1,0,1]=4 3180 B8R1.50 CC1C(=O)CCC1=O Amb974862 [1,0,0,1,0,0|1,0,0]=3 3181 B8R1.50 CC1C(=O)COC1=O Amb4035239 [1,0,0,1,0,0|2,0,0]=4 3182 B8R1.50 CC1CCC(=O)C1N Amb25675652 [1,0,0,1,0,0|1,0,1]=4 3183 B8R1.50 CN1C(=O)CCC1=O Amb6368854 [1,0,0,1,0,0|2,0,0]=4 3184 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [1,0,0,1,0,0|1,0,1]=4 3185 B8R1.50 N=C1COC(=O)C1N Amb27839054 [1,0,0,1,0,0|2,0,0]=4 3186 B8R1.50 NC1=C(O)CCC1=O Amb27203866 [1,0,0,1,0,0|0,0,1]=3 3187 B8R1.50 NC1=C(O)COC1=O Amb27830449 [1,0,0,1,0,0|1,0,1]=4 3188 B8R1.50 NC1C(=O)CCC1=O Amb27409660 [1,0,0,1,0,0|0,0,0]=2 3189 B8R1.50 NC1C(=O)NNC1=O Amb26392782 [1,0,0,1,0,0|2,0,0]=4 3190 B8R1.50 NN1C(=O)CCC1=O Amb24323275 [1,0,0,1,0,0|1,0,0]=3 3191 B8R1.50 NN1C(=O)CNC1=O Amb2795837 [1,0,0,1,0,0|2,0,0]=4 3192 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O Amb27420900 [1,0,0,1,0,0|1,0,1]=4 3193 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O Amb28289413 [1,0,0,1,0,0|1,0,1]=4 3194 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [1,0,0,1,0,0|1,0,1]=4 3195 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [1,0,0,1,0,0|1,0,1]=4 3196 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [1,0,0,1,0,0|1,0,1]=4 3197 B8R1.50 N[C@H]1C(=O)NC[C@H]1O Amb28346232 [1,0,0,1,0,0|1,0,1]=4 3198 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [1,0,0,1,0,0|1,0,1]=4 3199 B8R1.50 O=C1CCC(=O)C1Br Amb10975590 [1,0,0,1,0,0|1,0,0]=3 3200 B8R1.50 O=C1CCC(=O)C1Cl Amb27471835 [1,0,0,1,0,0|1,0,0]=3 3201 B8R1.50 O=C1CCC(=O)C1O Amb24443990 [1,0,0,1,0,0|1,0,0]=3 3202 B8R1.50 O=C1CCC(=O)N1Br Amb2685488 [1,0,0,1,0,0|2,0,0]=4 3203 B8R1.50 O=C1CCC(=O)N1Cl Amb6609006 [1,0,0,1,0,0|2,0,0]=4 3204 B8R1.50 O=C1CCC(=O)N1I Amb2688884 [1,0,0,1,0,0|2,0,0]=4 3205 B8R1.50 O=C1CCC(=O)N1O Amb1152089 [1,0,0,1,0,0|2,0,0]=4 3206 B8R1.50 O=C1CCC(O)=C1Br Amb25205766 [1,0,0,1,0,0|1,0,1]=4 3207 B8R1.50 O=C1CCC(O)=C1O Amb17593179 [1,0,0,1,0,0|1,0,1]=4 3208 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [1,0,0,1,0,0|1,0,1]=4 3209 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [1,0,0,1,0,0|2,0,0]=4 3210 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [1,0,0,1,0,0|2,0,0]=4 3211 B8R1.83 CC1CC1C(=O)CN Amb24524253 [1,0,0,1,0,0|1,0,1]=4 3212 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [1,0,0,1,0,0|1,0,1]=4 3213 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [1,0,0,1,0,0|1,0,1]=4 3214 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [1,0,0,1,0,0|1,0,1]=4 3215 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [1,0,0,1,0,0|1,0,1]=4 3216 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [1,0,0,1,0,0|1,0,1]=4 3217 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [1,0,0,1,0,0|1,0,1]=4 3218 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [1,0,0,1,0,0|1,0,1]=4 3219 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [1,0,0,1,0,0|1,0,1]=4 3220 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [1,0,0,1,0,0|1,0,1]=4 3221 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [1,0,0,1,0,0|1,0,1]=4 3222 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [1,0,0,1,0,0|1,0,1]=4 3223 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [1,0,0,1,0,0|1,0,1]=4 3224 B8R1.7 NC(=O)C1C=CCN1 Amb27246432 [1,0,0,1,0,0|1,0,1]=4 3225 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [1,0,0,1,0,0|1,0,1]=4 3226 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [1,0,0,1,0,0|1,0,1]=4 3227 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [1,0,0,1,0,0|2,0,0]=4 3228 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [1,0,0,1,0,0|1,0,1]=4 3229 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [1,0,0,1,0,0|1,0,1]=4 3230 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [1,0,0,1,0,0|2,0,0]=4 3231 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [1,0,0,1,0,0|1,0,1]=4 3232 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [1,0,0,1,0,0|1,0,1]=4 3233 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [1,0,0,1,0,0|1,0,1]=4 3234 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [1,0,0,1,0,0|2,0,0]=4 3235 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [1,0,0,1,0,0|1,0,1]=4 3236 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [1,0,0,1,0,0|1,0,1]=4 3237 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [1,0,0,1,0,0|0,0,1]=3 3238 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [1,0,0,1,0,0|0,0,1]=3 3239 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [1,0,0,1,0,0|1,0,1]=4 3240 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [1,0,0,1,0,0|1,0,1]=4 3241 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [1,0,0,1,0,0|1,0,0]=3 3242 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [1,0,0,1,0,0|2,0,0]=4 3243 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [1,0,0,1,0,0|2,0,0]=4 3244 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [1,0,0,1,0,0|1,0,1]=4 3245 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [1,0,0,1,0,0|0,0,1]=3 3246 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [1,0,0,1,0,0|0,0,1]=3 3247 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [1,0,0,1,0,0|1,0,1]=4 3248 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [1,0,0,1,0,0|1,0,1]=4 3249 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [1,0,0,1,0,0|2,0,0]=4 3250 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [1,0,0,1,0,0|2,0,0]=4 3251 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [1,0,0,1,0,0|2,0,0]=4 3252 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [1,0,0,1,0,0|2,0,0]=4 3253 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [1,0,0,1,0,0|2,0,0]=4 3254 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [1,0,0,1,0,0|1,0,0]=3 3255 B8R1.7 O=C(O)C1COCN1 Amb2694915 [1,0,0,1,0,0|1,0,0]=3 3256 B8R1.7 O=C(O)C1COCN1 Amb2696354 [1,0,0,1,0,0|1,0,0]=3 3257 B8R1.7 O=C(O)C1COCO1 Amb27810510 [1,0,0,1,0,0|2,0,0]=4 3258 B8R1.7 O=C(O)C1CSCN1 Amb532947 [1,0,0,1,0,0|1,0,0]=3 3259 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [1,0,0,1,0,0|1,0,1]=4 3260 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [1,0,0,1,0,0|0,0,1]=3 3261 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [1,0,0,1,0,0|0,0,1]=3 3262 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [1,0,0,1,0,0|0,0,1]=3 3263 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [1,0,0,1,0,0|0,0,1]=3 3264 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [1,0,0,1,0,0|1,0,1]=4 3265 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [1,0,0,1,0,0|2,0,0]=4 3266 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [1,0,0,1,0,0|2,0,0]=4 3267 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [1,0,0,1,0,0|2,0,0]=4 3268 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [1,0,0,1,0,0|1,0,1]=4 3269 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [1,0,0,1,0,0|1,0,0]=3 3270 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [1,0,0,1,0,0|1,0,0]=3 3271 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [1,0,0,1,0,0|1,0,1]=4 3272 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [1,0,0,1,0,0|0,0,1]=3 3273 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [1,0,0,1,0,0|2,0,0]=4 3274 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [1,0,0,1,0,0|0,0,1]=3 3275 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [1,0,0,1,0,0|1,0,1]=4 3276 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [1,0,0,1,0,0|2,0,0]=4 3277 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [1,0,0,1,0,0|2,0,0]=4 3278 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [1,0,0,1,0,0|2,0,0]=4 3279 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [1,0,0,1,0,0|2,0,0]=4 3280 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [1,0,0,1,0,0|2,0,0]=4 3281 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [1,0,0,1,0,0|1,0,0]=3 3282 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [1,0,0,1,0,0|1,0,1]=4 3283 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [1,0,0,1,0,0|0,1,1]=4 3284 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [1,0,0,1,0,0|0,0,2]=4 3285 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [1,0,0,1,0,0|1,0,1]=4 3286 B8R1.20 CC1CC1CC(=O)O Amb25316515 [1,0,0,1,0,0|1,0,1]=4 3287 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [1,0,0,1,0,0|1,0,1]=4 3288 B8R1.20 NC1CC1CC(=O)O Amb27201670 [1,0,0,1,0,0|0,0,1]=3 3289 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [1,0,0,1,0,0|0,0,1]=3 3290 B8R1.20 O=C(O)CC1CC1O Amb27981662 [1,0,0,1,0,0|1,0,1]=4 3291 B8R1.31 CC1CCC1C(=O)O Amb21857447 [1,0,0,1,0,0|1,0,1]=4 3292 B8R1.31 CC1NCC1C(=O)O Amb26984410 [1,0,0,1,0,0|2,0,0]=4 3293 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [1,0,0,1,0,0|1,0,1]=4 3294 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [1,0,0,1,0,0|2,0,0]=4 3295 B8R1.31 NC(=O)C1CCC1N Amb20248288 [1,0,0,1,0,0|1,0,1]=4 3296 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [1,0,0,1,0,0|1,0,1]=4 3297 B8R1.31 NC1CCC1C(=O)O Amb26979562 [1,0,0,1,0,0|0,0,1]=3 3298 B8R1.31 NC1COC1C(=O)O Amb28428430 [1,0,0,1,0,0|1,0,1]=4 3299 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [1,0,0,1,0,0|1,0,1]=4 3300 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [1,0,0,1,0,0|0,0,1]=3 3301 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [1,0,0,1,0,0|0,0,1]=3 3302 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [1,0,0,1,0,0|0,0,1]=3 3303 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [1,0,0,1,0,0|0,0,1]=3 3304 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [1,0,0,1,0,0|1,0,1]=4 3305 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [1,0,0,1,0,0|0,0,1]=3 3306 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [1,0,0,1,0,0|0,0,1]=3 3307 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [1,0,0,1,0,0|0,0,1]=3 3308 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [1,0,0,1,0,0|0,0,1]=3 3309 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [1,0,0,1,0,0|1,0,1]=4 3310 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [1,0,0,1,0,0|1,0,1]=4 3311 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [1,0,0,1,0,0|1,0,1]=4 3312 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [1,0,0,1,0,0|1,0,1]=4 3313 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [1,0,0,1,0,0|1,0,1]=4 3314 B8R1.31 O=C(O)C1CCC1F Amb27835547 [1,0,0,1,0,0|1,0,1]=4 3315 B8R1.31 O=C(O)C1CCC1O Amb24481384 [1,0,0,1,0,0|1,0,1]=4 3316 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [1,0,0,1,0,0|1,0,1]=4 3317 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [1,0,0,1,0,0|1,0,1]=4 3318 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [1,0,0,1,0,0|1,0,1]=4 3319 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [1,0,0,1,0,0|0,0,1]=3 3320 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [1,0,0,1,0,0|1,0,1]=4 3321 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [1,0,0,1,0,0|1,0,1]=4 3322 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [1,0,0,1,0,0|1,0,1]=4 3323 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [1,0,0,1,0,0|1,0,0]=3 3324 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [1,0,0,1,0,0|1,0,1]=4 3325 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [1,0,0,1,0,0|1,0,1]=4 3326 B8R1.43 CC(=O)C1CC1CN Amb33132446 [1,0,0,1,0,0|1,0,1]=4 3327 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CN Amb33132469 [1,0,0,1,0,0|1,0,1]=4 3328 B8R1.43 CCC1CC1C(=O)O Amb18961272 [1,0,0,1,0,0|1,0,1]=4 3329 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [1,0,0,1,0,0|1,0,1]=4 3330 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [1,0,0,1,0,0|1,0,1]=4 3331 B8R1.43 NCC1CC1C(=O)O Amb2694938 [1,0,0,1,0,0|0,0,1]=3 3332 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [1,0,0,1,0,0|0,0,1]=3 3333 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [1,0,0,1,0,0|0,0,1]=3 3334 B8R1.43 NC[C@@H]1C[C@@H]1C(N)=O Amb33042252 [1,0,0,1,0,0|1,0,1]=4 3335 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [1,0,0,1,0,0|0,0,1]=3 3336 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [1,0,0,1,0,0|0,0,1]=3 3337 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [1,0,0,1,0,0|0,0,1]=3 3338 B8R1.43 NNC1CC1C(=O)O Amb10576221 [1,0,0,1,0,0|1,0,1]=4 3339 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [1,0,0,1,0,0|1,0,1]=4 3340 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [1,0,0,1,0,0|1,0,1]=4 3341 B8R1.43 O=C(O)C1CC1CO Amb25173469 [1,0,0,1,0,0|1,0,1]=4 3342 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [1,0,0,1,0,0|1,0,1]=4 3343 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [1,0,0,1,0,0|1,0,1]=4 3344 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [1,0,0,1,0,0|1,0,1]=4 3345 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [1,0,0,1,0,0|1,0,1]=4 3346 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [1,0,0,1,0,0|1,0,1]=4 3347 B8R1.23 C=C(C)C1CC(=O)N1 Amb27858929 [1,0,0,1,0,0|2,0,0]=4 3348 B8R1.23 C=C(C)[C@@H]1CC(=O)N1 Amb28251769 [1,0,0,1,0,0|2,0,0]=4 3349 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [1,0,0,1,0,0|2,0,0]=4 3350 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [1,0,0,1,0,0|1,0,0]=3 3351 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [1,0,0,1,0,0|2,0,0]=4 3352 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [1,0,0,1,0,0|2,0,0]=4 3353 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [1,0,0,1,0,0|2,0,0]=4 3354 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [1,0,0,1,0,0|2,0,0]=4 3355 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [1,0,0,1,0,0|1,0,1]=4 3356 B8R1.23 CC(=O)N1CC(=O)C1 Amb22896668 [1,0,0,1,0,0|2,0,0]=4 3357 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [1,0,0,1,0,0|1,0,1]=4 3358 B8R1.23 CC(O)C1CC(=O)C1 Amb34159488 [1,0,0,1,0,0|1,0,1]=4 3359 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [1,0,0,1,0,0|1,0,1]=4 3360 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [1,0,0,1,0,0|1,0,1]=4 3361 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [1,0,0,1,0,0|1,0,1]=4 3362 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [1,0,0,1,0,0|2,0,0]=4 3363 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [1,0,0,1,0,0|1,0,1]=4 3364 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [1,0,0,1,0,0|1,0,1]=4 3365 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [1,0,0,1,0,0|1,0,1]=4 3366 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [1,0,0,1,0,0|1,0,1]=4 3367 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [1,0,0,1,0,0|1,0,1]=4 3368 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [1,0,0,1,0,0|1,0,1]=4 3369 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [1,0,0,1,0,0|1,0,0]=3 3370 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [1,0,0,1,0,0|1,0,1]=4 3371 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [1,0,0,1,0,0|1,0,1]=4 3372 B8R1.23 NS(=O)C1CC(=O)C1 Amb32720658 [1,0,0,1,0,0|2,0,0]=4 3373 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [1,0,0,1,0,0|1,0,1]=4 3374 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [1,0,0,1,0,0|1,0,1]=4 3375 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [1,0,0,1,0,0|1,0,1]=4 3376 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [1,0,0,1,0,0|1,0,1]=4 3377 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [1,0,0,1,0,0|1,0,1]=4 3378 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [1,0,0,1,0,0|1,0,1]=4 3379 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [1,0,0,1,0,0|1,0,1]=4 3380 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [1,0,0,1,0,0|0,0,2]=4 3381 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [1,0,0,1,0,0|1,0,0]=3 3382 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [1,0,0,1,0,0|1,0,1]=4 3383 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [1,0,0,1,0,0|1,0,1]=4 3384 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [1,0,0,1,0,0|1,0,1]=4 3385 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [1,0,0,1,0,0|0,0,2]=4 3386 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [1,0,0,1,0,0|1,0,1]=4 3387 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [1,0,0,1,0,0|1,0,1]=4 3388 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [1,0,0,1,0,0|1,0,1]=4 3389 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [1,0,0,1,0,0|0,0,2]=4 3390 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [1,0,0,1,0,0|1,0,0]=3 3391 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [1,0,0,1,0,0|0,0,0]=2 3392 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [1,0,0,1,0,0|0,0,0]=2 3393 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [1,0,0,1,0,0|1,0,0]=3 3394 B8R1.23 O=C1CC(S(=O)Cl)C1 Amb32720949 [1,0,0,1,0,0|2,0,0]=4 3395 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [1,0,0,1,0,0|1,0,0]=3 3396 B8R1.23 O=C1CN(C(=O)Cl)C1 Amb32864114 [1,0,0,1,0,0|2,0,0]=4 3397 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [1,0,0,1,0,0|0,0,0]=2 3398 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [1,0,0,1,0,0|0,0,0]=2 3399 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [1,0,0,1,0,0|1,0,1]=4 3400 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [1,0,0,1,0,0|1,0,1]=4 3401 B8R1.51 CS1(=O)=NC(=O)CC1 Amb33483218 [1,0,0,1,0,0|2,0,0]=4 3402 B8R1.51 O=C1CCS(=O)(=O)C1 Amb2373731 [1,0,0,1,0,0|1,0,1]=4 3403 B8R1.51 O=C1CCS(=O)(=O)N1 Amb25763419 [1,0,0,1,0,0|1,0,1]=4 3404 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [1,0,0,1,0,0|2,0,0]=4 3405 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [1,0,0,1,0,0|1,0,1]=4 3406 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [1,0,0,1,0,0|1,0,1]=4 3407 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [1,0,0,1,0,0|1,0,1]=4 3408 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [1,0,0,1,0,0|1,0,1]=4 3409 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [1,0,0,1,0,0|1,0,1]=4 3410 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,0,0,1,1,0|2,0,0]=4 3411 B8R1.18 CC1OC(=O)CC1=O Amb28290899 [0,0,0,1,1,0|1,0,0]=3 3412 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,0,0,1,1,0|2,0,0]=4 3413 B8R1.18 CC1OC(=O)OC1=O Amb28315579 [0,0,0,1,1,0|2,0,0]=4 3414 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,0,0,1,1,0|2,0,0]=4 3415 B8R1.18 NC1CC(=O)NC1=O Amb30585083 [0,0,0,1,1,0|2,0,0]=4 3416 B8R1.18 NC1CC(=O)NC1=O Amb9502460 [0,0,0,1,1,0|2,0,0]=4 3417 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,0,0,1,1,0|2,0,0]=4 3418 B8R1.18 NC1NC(=O)NC1=O Amb28118590 [0,0,0,1,1,0|2,0,0]=4 3419 B8R1.18 NC1SC(=O)NC1=O Amb2794365 [0,0,0,1,1,0|1,1,0]=4 3420 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,0,0,1,1,0|2,0,0]=4 3421 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,0,0,1,1,0|2,0,0]=4 3422 B8R1.18 N[C@H]1CC(=O)NC1=O Amb17134612 [0,0,0,1,1,0|2,0,0]=4 3423 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,0,0,1,1,0|2,0,0]=4 3424 B8R1.18 O=C1CC(=O)C(O)C1 Amb24330382 [0,0,0,1,1,0|2,0,0]=4 3425 B8R1.67 C=C1C(C)C1C(=O)O Amb27985954 [0,0,0,1,1,0|2,0,0]=4 3426 B8R1.67 C[C@@H]1[C@@H](N)[C@@H]1C(=O)O Amb28365983 [0,0,0,1,1,0|1,0,1]=4 3427 B10R1.13 C=C1CCC(C(=O)O)CC1 Amb15695314 [0,0,0,1,0,1|2,0,0]=4 3428 B10R1.13 CC(=O)C1=CCC(=O)CC1 Amb17593496 [0,0,0,1,0,1|2,0,0]=4 3429 B10R1.13 CC(=O)C1CCC(=O)CC1 Amb27597007 [0,0,0,1,0,1|2,0,0]=4 3430 B10R1.13 CC(=O)N1CCC(=O)CC1 Amb2582739 [0,0,0,1,0,1|2,0,0]=4 3431 B10R1.13 CC1=CCC(C(=O)O)CC1 Amb18124574 [0,0,0,1,0,1|2,0,0]=4 3432 B10R1.13 CC1CCC(C(=O)O)NC1 Amb25324436 [0,0,0,1,0,1|1,0,1]=4 3433 B10R1.13 CC1CCC(C(=O)O)NC1 Amb33482831 [0,0,0,1,0,1|1,0,1]=4 3434 B10R1.13 CC1CNC(C(=O)O)CN1 Amb28049378 [0,0,0,1,0,1|1,0,1]=4 3435 B10R1.13 CC1CNC(C(=O)O)CO1 Amb26356239 [0,0,0,1,0,1|1,0,1]=4 3436 B10R1.13 CC1CNC(C(=O)O)CO1 Amb32653486 [0,0,0,1,0,1|1,0,1]=4 3437 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33017682 [0,0,0,1,0,1|1,0,1]=4 3438 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Amb33299403 [0,0,0,1,0,1|1,0,1]=4 3439 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)NC1 Amb33804580 [0,0,0,1,0,1|1,0,1]=4 3440 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb25949341 [0,0,0,1,0,1|1,0,1]=4 3441 B10R1.13 C[C@@H]1CN[C@@H](C(=O)O)CO1 Amb31156297 [0,0,0,1,0,1|1,0,1]=4 3442 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb24694579 [0,0,0,1,0,1|1,0,1]=4 3443 B10R1.13 C[C@@H]1CN[C@H](C(=O)O)CO1 Amb32661059 [0,0,0,1,0,1|1,0,1]=4 3444 B10R1.13 C[C@H]1CN[C@@H](C(=O)O)CO1 Amb28367492 [0,0,0,1,0,1|1,0,1]=4 3445 B10R1.13 C[C@H]1CN[C@H](C(=O)O)CO1 Amb35746793 [0,0,0,1,0,1|1,0,1]=4 3446 B10R1.13 NC(=O)C1CCC(=O)CC1 Amb21964140 [0,0,0,1,0,1|2,0,0]=4 3447 B10R1.13 NC(=O)C1CCC(=O)NC1 Amb20668378 [0,0,0,1,0,1|2,0,0]=4 3448 B10R1.13 NC(=O)C1CNC(=O)CN1 Amb26400442 [0,0,0,1,0,1|1,0,0]=3 3449 B10R1.13 NC(=O)C1CNC(=O)CN1 Amb33482851 [0,0,0,1,0,1|1,0,0]=3 3450 B10R1.13 NC(=O)N1CCC(=O)CC1 Amb1158070 [0,0,0,1,0,1|2,0,0]=4 3451 B10R1.13 NC1=NCC(C(=O)O)CC1 Amb27760065 [0,0,0,1,0,1|2,0,0]=4 3452 B10R1.13 NC1=NCC(C(=O)O)CC1 Amb28555528 [0,0,0,1,0,1|2,0,0]=4 3453 B10R1.13 O=C(O)C1CC=C(Br)CC1 Amb26015030 [0,0,0,1,0,1|2,0,0]=4 3454 B10R1.13 O=C(O)C1CC=C(F)CC1 Amb27628828 [0,0,0,1,0,1|2,0,0]=4 3455 B10R1.13 O=C(O)C1CCC(O)CN1 Amb22034512 [0,0,0,1,0,1|0,0,2]=4 3456 B10R1.13 O=C(O)C1CCC(O)CN1 Amb5719819 [0,0,0,1,0,1|0,0,2]=4 3457 B10R1.13 O=C(O)C1CCS(=O)CC1 Amb25295426 [0,0,0,1,0,1|2,0,0]=4 3458 B10R1.13 O=C(O)C1CNC(O)CN1 Amb25332404 [0,0,0,1,0,1|0,0,2]=4 3459 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb24763804 [0,0,0,1,0,1|1,0,1]=4 3460 B10R1.13 O=C(O)[C@@H]1CC[C@@H](F)CN1 Amb35752872 [0,0,0,1,0,1|1,0,1]=4 3461 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb24120629 [0,0,0,1,0,1|0,0,2]=4 3462 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Amb2697173 [0,0,0,1,0,1|0,0,2]=4 3463 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb28132662 [0,0,0,1,0,1|0,0,2]=4 3464 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 Amb33726118 [0,0,0,1,0,1|0,0,2]=4 3465 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440007 [0,0,0,1,0,1|0,0,2]=4 3466 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Amb23440183 [0,0,0,1,0,1|0,0,2]=4 3467 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CN1 Amb26401050 [0,0,0,1,0,1|0,0,2]=4 3468 B10R1.13 O=C1CCC(C(=O)Cl)CC1 Amb10071440 [0,0,0,1,0,1|2,0,0]=4 3469 B10R1.13 O=C1CCC(C(=O)O)=NN1 Amb6336556 [0,0,0,1,0,1|1,0,1]=4 3470 B10R1.13 O=C1CCC(C(=O)O)CC1 Amb5719059 [0,0,0,1,0,1|1,0,0]=3 3471 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb8503400 [0,0,0,1,0,1|1,0,0]=3 3472 B10R1.13 O=C1CCC(C(=O)O)CN1 Amb9721708 [0,0,0,1,0,1|1,0,0]=3 3473 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb21960863 [0,0,0,1,0,1|0,0,0]=2 3474 B10R1.13 O=C1CCC(C(=O)O)NC1 Amb5719827 [0,0,0,1,0,1|0,0,0]=2 3475 B10R1.13 O=C1CCC(C(=O)O)NN1 Amb23441127 [0,0,0,1,0,1|1,0,0]=3 3476 B10R1.13 O=C1CCC(C(=O)O)SC1 Amb23596925 [0,0,0,1,0,1|1,0,0]=3 3477 B10R1.13 O=C1CCN(C(=O)Cl)CC1 Amb27839162 [0,0,0,1,0,1|2,0,0]=4 3478 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Amb26878933 [0,0,0,1,0,1|1,0,0]=3 3479 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb24655763 [0,0,0,1,0,1|0,0,0]=2 3480 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Amb31291189 [0,0,0,1,0,1|0,0,0]=2 3481 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Amb26515676 [0,0,0,1,0,1|1,0,0]=3 3482 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb27648107 [0,0,0,1,0,1|0,0,0]=2 3483 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Amb31291190 [0,0,0,1,0,1|0,0,0]=2 3484 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22235954 [0,0,0,1,0,1|0,0,0]=2 3485 B10R1.13 O=C1CNC(C(=O)O)CN1 Amb22641428 [0,0,0,1,0,1|0,0,0]=2 3486 B10R1.13 O=C1CN[C@@H](C(=O)O)CN1 Amb24423079 [0,0,0,1,0,1|0,0,0]=2 3487 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 Amb22756547 [0,0,0,1,0,1|0,0,0]=2 3488 B10R1.13 O=C1COC(C(=O)O)CN1 Amb27872662 [0,0,0,1,0,1|1,0,0]=3 3489 B10R1.13 O=C1NCC(C(=O)O)CN1 Amb27469166 [0,0,0,1,0,1|2,0,0]=4 3490 B10R1.14 C#CC(=O)[C@@H]1CCC(=O)O1 Amb28324390 [0,0,0,1,0,1|1,0,1]=4 3491 B10R1.14 C=C(CCl)C1CCC(=O)O1 Amb27462812 [0,0,0,1,0,1|2,0,0]=4 3492 B10R1.14 C=C1CCN(C(=O)CN)C1 Amb35648621 [0,0,0,1,0,1|2,0,0]=4 3493 B10R1.14 C=CC(=O)C1CCC(=O)O1 Amb27771531 [0,0,0,1,0,1|1,0,1]=4 3494 B10R1.14 CCC(=O)N1CCC(=O)N1 Amb32721865 [0,0,0,1,0,1|2,0,0]=4 3495 B10R1.14 CNC(=O)C1CCC(=O)O1 Amb27794838 [0,0,0,1,0,1|2,0,0]=4 3496 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 Amb24442752 [0,0,0,1,0,1|2,0,0]=4 3497 B10R1.14 CNC(=O)[C@H]1CCC(=O)O1 Amb27204655 [0,0,0,1,0,1|2,0,0]=4 3498 B10R1.14 COC(=O)C1CCC(=O)O1 Amb22230883 [0,0,0,1,0,1|2,0,0]=4 3499 B10R1.14 COC(=O)C1CNC(=O)O1 Amb33530541 [0,0,0,1,0,1|2,0,0]=4 3500 B10R1.14 COC(=O)[C@@H]1CCC(=O)O1 Amb22226740 [0,0,0,1,0,1|2,0,0]=4 3501 B10R1.14 COC(=O)[C@@H]1CNC(=O)O1 Amb25888968 [0,0,0,1,0,1|2,0,0]=4 3502 B10R1.14 COC(=O)[C@H]1CCC(=O)O1 Amb22225396 [0,0,0,1,0,1|2,0,0]=4 3503 B10R1.14 C[C@@H]1CCC(C(=O)CN)O1 Amb33423431 [0,0,0,1,0,1|1,0,1]=4 3504 B10R1.14 NCC(=O)N1CC[C@@H](O)C1 Amb28126036 [0,0,0,1,0,1|1,0,1]=4 3505 B10R1.14 NNC(=O)C1CCC(=O)N1 Amb1781033 [0,0,0,1,0,1|2,0,0]=4 3506 B10R1.14 NNC(=O)C1CNC(=O)C1 Amb9175028 [0,0,0,1,0,1|2,0,0]=4 3507 B10R1.14 NNC(=O)[C@H]1CCC(=O)N1 Amb28046389 [0,0,0,1,0,1|2,0,0]=4 3508 B10R1.14 O=C1CC(C(=O)CCl)CO1 Amb24738564 [0,0,0,1,0,1|2,0,0]=4 3509 B10R1.14 O=C1CCN(C(=O)CCl)N1 Amb2408365 [0,0,0,1,0,1|2,0,0]=4 3510 B10R1.31 CCC1=NC(C(=O)O)CC1 Amb23560251 [0,0,0,1,0,1|2,0,0]=4 3511 B10R1.31 CCC1=NC(C(=O)O)CS1 Amb24529169 [0,0,0,1,0,1|2,0,0]=4 3512 B10R1.31 CCC1=NCC(C(=O)O)S1 Amb27638215 [0,0,0,1,0,1|1,1,0]=4 3513 B10R1.31 CCC1=N[C@@H](C(=O)O)CS1 Amb32676212 [0,0,0,1,0,1|2,0,0]=4 3514 B10R1.31 CCC1=N[C@H](C(=O)O)CS1 Amb35648202 [0,0,0,1,0,1|2,0,0]=4 3515 B10R1.31 NCC1CCC(C(=O)O)C1 Amb28202595 [0,0,0,1,0,1|1,0,1]=4 3516 B10R1.31 NCC1CCC(C(=O)O)O1 Amb27451875 [0,0,0,1,0,1|0,0,2]=4 3517 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066932 [0,0,0,1,0,1|1,0,1]=4 3518 B10R1.31 NC[C@@H]1CC[C@@H](C(=O)O)O1 Amb27420232 [0,0,0,1,0,1|0,0,2]=4 3519 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb32645997 [0,0,0,1,0,1|0,0,2]=4 3520 B10R1.31 NC[C@@H]1CC[C@H](C(=O)O)O1 Amb33098523 [0,0,0,1,0,1|0,0,2]=4 3521 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb24117206 [0,0,0,1,0,1|1,0,1]=4 3522 B10R1.31 NC[C@@H]1CN[C@H](C(=O)O)C1 Amb26415233 [0,0,0,1,0,1|1,0,1]=4 3523 B10R1.31 NC[C@H]1CC[C@@H](C(=O)O)O1 Amb27959990 [0,0,0,1,0,1|0,0,2]=4 3524 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb24117205 [0,0,0,1,0,1|1,0,1]=4 3525 B10R1.31 NC[C@H]1CN[C@H](C(=O)O)C1 Amb25912130 [0,0,0,1,0,1|1,0,1]=4 3526 B10R1.31 NNC1=NC(C(=O)O)CN1 Amb28346425 [0,0,0,1,0,1|2,0,0]=4 3527 B10R1.54 C=C1CCN(CC(=O)O)C1 Amb30028134 [0,0,0,1,0,1|2,0,0]=4 3528 B10R1.54 CC(=O)CC1CCC(=O)C1 Amb28122070 [0,0,0,1,0,1|2,0,0]=4 3529 B10R1.54 CC(=O)CC1CCC(=O)N1 Amb18831756 [0,0,0,1,0,1|2,0,0]=4 3530 B10R1.54 CC(=O)NC1CCC(=O)C1 Amb27425009 [0,0,0,1,0,1|2,0,0]=4 3531 B10R1.54 CC(=O)S[C@H]1CCC(=O)C1 Amb27750249 [0,0,0,1,0,1|2,0,0]=4 3532 B10R1.54 CC1CNC(CC(=O)O)C1 Amb8387922 [0,0,0,1,0,1|1,0,1]=4 3533 B10R1.54 NC(=O)CC1CC(=O)NN1 Amb35694043 [0,0,0,1,0,1|2,0,0]=4 3534 B10R1.54 O=C(Cl)CC1CCC(=O)C1 Amb27614921 [0,0,0,1,0,1|2,0,0]=4 3535 B10R1.54 O=C(O)CC1=CC(=O)CC1 Amb27813115 [0,0,0,1,0,1|1,0,1]=4 3536 B10R1.54 O=C(O)CC1=CC(=O)NN1 Amb18202650 [0,0,0,1,0,1|1,0,1]=4 3537 B10R1.54 O=C(O)CC1=CC(=O)ON1 Amb28348890 [0,0,0,1,0,1|1,0,1]=4 3538 B10R1.54 O=C(O)CC1=NC(=O)CS1 Amb9774271 [0,0,0,1,0,1|1,0,1]=4 3539 B10R1.54 O=C(O)CC1=NNC(=O)C1 Amb8826416 [0,0,0,1,0,1|1,0,1]=4 3540 B10R1.54 O=C(O)CC1=NOC(=O)C1 Amb18202495 [0,0,0,1,0,1|1,0,1]=4 3541 B10R1.54 O=C(O)CC1CC(=O)CN1 Amb27860610 [0,0,0,1,0,1|0,0,0]=2 3542 B10R1.54 O=C(O)CC1CC(O)CN1 Amb25082530 [0,0,0,1,0,1|0,0,2]=4 3543 B10R1.54 O=C(O)CC1CCC(=O)C1 Amb18643816 [0,0,0,1,0,1|1,0,0]=3 3544 B10R1.54 O=C(O)CC1CCC(=O)N1 Amb2372619 [0,0,0,1,0,1|1,0,0]=3 3545 B10R1.54 O=C(O)CC1CCC(=O)O1 Amb6316138 [0,0,0,1,0,1|1,0,0]=3 3546 B10R1.54 O=C(O)CC1CNC(=O)C1 Amb18831602 [0,0,0,1,0,1|2,0,0]=4 3547 B10R1.54 O=C(O)CC1COC(=O)C1 Amb20669416 [0,0,0,1,0,1|2,0,0]=4 3548 B10R1.54 O=C(O)CC1COC(=O)N1 Amb27838109 [0,0,0,1,0,1|2,0,0]=4 3549 B10R1.54 O=C(O)CC1C[C@@H](O)CN1 Amb32990253 [0,0,0,1,0,1|0,0,2]=4 3550 B10R1.54 O=C(O)CC1C[C@H](O)CN1 Amb32990254 [0,0,0,1,0,1|0,0,2]=4 3551 B10R1.54 O=C(O)C[C@@H]1C=CC(=O)O1 Amb28314258 [0,0,0,1,0,1|1,0,1]=4 3552 B10R1.54 O=C(O)C[C@@H]1CC(O)CN1 Amb34915761 [0,0,0,1,0,1|0,0,2]=4 3553 B10R1.54 O=C(O)C[C@@H]1CCC(=O)C1 Amb24480441 [0,0,0,1,0,1|1,0,0]=3 3554 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 Amb22587587 [0,0,0,1,0,1|1,0,0]=3 3555 B10R1.54 O=C(O)C[C@@H]1CNC(=O)C1 Amb24410373 [0,0,0,1,0,1|2,0,0]=4 3556 B10R1.54 O=C(O)C[C@@H]1C[C@@H](F)CN1 Amb33329938 [0,0,0,1,0,1|1,0,1]=4 3557 B10R1.54 O=C(O)C[C@@H]1C[C@@H](F)CN1 Amb33457872 [0,0,0,1,0,1|1,0,1]=4 3558 B10R1.54 O=C(O)C[C@@H]1C[C@@H](O)CN1 Amb26930782 [0,0,0,1,0,1|0,0,2]=4 3559 B10R1.54 O=C(O)C[C@@H]1C[C@@H](O)CN1 Amb6754088 [0,0,0,1,0,1|0,0,2]=4 3560 B10R1.54 O=C(O)C[C@@H]1C[C@H](F)CN1 Amb33329502 [0,0,0,1,0,1|1,0,1]=4 3561 B10R1.54 O=C(O)C[C@@H]1C[C@H](F)CN1 Amb33330670 [0,0,0,1,0,1|1,0,1]=4 3562 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 Amb22898751 [0,0,0,1,0,1|1,0,0]=3 3563 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 Amb22587585 [0,0,0,1,0,1|1,0,0]=3 3564 B10R1.54 O=C(O)C[C@H]1CCC(=O)O1 Amb26025159 [0,0,0,1,0,1|1,0,0]=3 3565 B10R1.54 O=C(O)C[C@H]1CNC(=O)C1 Amb26611732 [0,0,0,1,0,1|2,0,0]=4 3566 B10R1.54 O=C(O)C[C@H]1COC(=O)N1 Amb25744486 [0,0,0,1,0,1|2,0,0]=4 3567 B10R1.54 O=C(O)C[C@H]1C[C@H](O)CN1 Amb22756736 [0,0,0,1,0,1|0,0,2]=4 3568 B10R1.79 O=C1CCCC(=O)CCC1 Amb2780678 [0,0,0,1,0,1|2,0,0]=4 3569 B10R1.79 O=C1CCNC(=O)CCN1 Amb23403556 [0,0,0,1,0,1|2,0,0]=4 3570 B10R1.80 CC(=O)OC1NC(=O)C1N Amb27838093 [0,0,0,1,0,1|2,0,0]=4 3571 B10R1.117 O=C(O)CCN1CCC1=O Amb27782123 [0,0,0,1,0,1|1,0,0]=3 3572 B10R1.150 CCC(=O)CC1CC(=O)N1 Amb32676998 [0,0,0,1,0,1|2,0,0]=4 3573 B10R1.150 NCC(=O)NC1CC(O)C1 Amb27471630 [0,0,0,1,0,1|1,0,1]=4 3574 B10R1.168 NCC1CC(CC(=O)O)C1 Amb32992849 [0,0,0,1,0,1|1,0,1]=4 3575 B10R1.194 C=C1C(=O)CC[C@@H]1C(=O)O Amb28050151 [0,0,0,1,0,1|1,0,1]=4 3576 B10R1.194 C=C1CCC(C(=O)O)C1C Amb27442987 [0,0,0,1,0,1|2,0,0]=4 3577 B10R1.194 C=C1CCC(C(=O)O)C1N Amb25690409 [0,0,0,1,0,1|1,0,0]=3 3578 B10R1.194 C=C1CC[C@@H](C(=O)O)[C@H]1N Amb26884928 [0,0,0,1,0,1|1,0,0]=3 3579 B10R1.194 C=C1CC[C@H](C(=O)O)[C@@H]1C Amb27961118 [0,0,0,1,0,1|2,0,0]=4 3580 B10R1.194 C=C1CC[C@H](C(=O)O)[C@@H]1N Amb28345701 [0,0,0,1,0,1|1,0,0]=3 3581 B10R1.194 CC(=O)C1COC(=O)C1C Amb27863667 [0,0,0,1,0,1|2,0,0]=4 3582 B10R1.194 CC(=O)[C@@H]1COC(=O)[C@@H]1C Amb18202639 [0,0,0,1,0,1|2,0,0]=4 3583 B10R1.194 CC(O)C1CNC(=O)C1N Amb27838020 [0,0,0,1,0,1|1,0,1]=4 3584 B10R1.194 CC1C(=O)C=CC1C(=O)O Amb27408528 [0,0,0,1,0,1|1,0,1]=4 3585 B10R1.194 CC1C(=O)NCC1C(=O)O Amb27660444 [0,0,0,1,0,1|1,0,0]=3 3586 B10R1.194 CC1C(=O)NCC1C(N)=O Amb27804069 [0,0,0,1,0,1|2,0,0]=4 3587 B10R1.194 CC1C(=O)OCC1C(=O)O Amb4022599 [0,0,0,1,0,1|1,0,0]=3 3588 B10R1.194 CC1CCC(C(=O)O)C1N Amb20623936 [0,0,0,1,0,1|1,0,1]=4 3589 B10R1.194 CC1CC[C@@H](C(=O)O)[C@H]1N Amb27789618 [0,0,0,1,0,1|1,0,1]=4 3590 B10R1.194 CN1C(=O)CCC1C(=O)O Amb18279438 [0,0,0,1,0,1|2,0,0]=4 3591 B10R1.194 CN1C(=O)CC[C@@H]1C(=O)O Amb24480932 [0,0,0,1,0,1|2,0,0]=4 3592 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O Amb22756511 [0,0,0,1,0,1|2,0,0]=4 3593 B10R1.194 CN1C(=O)NCC1C(=O)O Amb27184588 [0,0,0,1,0,1|2,0,0]=4 3594 B10R1.194 CN1C(=O)NC[C@@H]1C(=O)O Amb27946880 [0,0,0,1,0,1|2,0,0]=4 3595 B10R1.194 CN1C(=O)NC[C@H]1C(=O)O Amb28042993 [0,0,0,1,0,1|2,0,0]=4 3596 B10R1.194 CN1C(=O)OCC1C(=O)O Amb25800781 [0,0,0,1,0,1|2,0,0]=4 3597 B10R1.194 CN1C(=O)OC[C@@H]1C(=O)O Amb32673921 [0,0,0,1,0,1|2,0,0]=4 3598 B10R1.194 C[C@@H]1C(=O)OC[C@H]1C(=O)O Amb28429847 [0,0,0,1,0,1|1,0,0]=3 3599 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)[C@H]1N Amb27874070 [0,0,0,1,0,1|1,0,1]=4 3600 B10R1.194 C[C@@H]1CC[C@H](C(=O)O)[C@H]1N Amb24618144 [0,0,0,1,0,1|1,0,1]=4 3601 B10R1.194 C[C@H]1C(=O)CC[C@H]1C(=O)O Amb27778459 [0,0,0,1,0,1|1,0,0]=3 3602 B10R1.194 C[C@H]1C(=O)CN[C@@H]1C(=O)O Amb18831599 [0,0,0,1,0,1|1,0,0]=3 3603 B10R1.194 C[C@H]1C(=O)NC[C@@H]1C(=O)O Amb27858486 [0,0,0,1,0,1|1,0,0]=3 3604 B10R1.194 NC1C(=O)NCC1C(=O)O Amb25683449 [0,0,0,1,0,1|0,0,0]=2 3605 B10R1.194 NC1C(=O)NCC1C(=O)O Amb32721524 [0,0,0,1,0,1|0,0,0]=2 3606 B10R1.194 NC1C(=O)NN=C1C(=O)O Amb27760350 [0,0,0,1,0,1|1,0,1]=4 3607 B10R1.194 NC1C(O)CCC1C(=O)O Amb28077395 [0,0,0,1,0,1|0,0,2]=4 3608 B10R1.194 NC1C(O)CNC1C(=O)O Amb28247453 [0,0,0,1,0,1|0,0,2]=4 3609 B10R1.194 NN1C(=O)CCC1C(=O)O Amb27839055 [0,0,0,1,0,1|1,0,0]=3 3610 B10R1.194 N[C@@H]1[C@@H](C(=O)O)NC[C@H]1O Amb24579561 [0,0,0,1,0,1|0,0,2]=4 3611 B10R1.194 N[C@H]1C(=O)NC[C@@H]1C(=O)O Amb25230623 [0,0,0,1,0,1|0,0,0]=2 3612 B10R1.194 N[C@H]1C(=O)NC[C@@H]1C(=O)O Amb32992773 [0,0,0,1,0,1|0,0,0]=2 3613 B10R1.194 N[C@H]1[C@@H](O)CC[C@@H]1C(=O)O Amb27473358 [0,0,0,1,0,1|0,0,2]=4 3614 B10R1.194 O=C(O)C1CCC(=O)N1O Amb27807058 [0,0,0,1,0,1|2,0,0]=4 3615 B10R1.194 O=C(O)[C@@H]1CCC(=O)N1O Amb26357551 [0,0,0,1,0,1|2,0,0]=4 3616 B10R1.194 O=C1OCC(C(=O)O)C1O Amb26405203 [0,0,0,1,0,1|1,0,0]=3 3617 B10R1.277 CC1NC(=O)CCNC1=O Amb27184656 [0,0,0,1,0,1|2,0,0]=4 3618 B10R1.302 O=C1CNS(=O)(=O)CCN1 Amb26899383 [0,0,0,1,0,1|1,0,1]=4 3619 B10R1.408 CNC(=O)C1CC1C(=O)O Amb17606124 [0,0,0,1,0,1|2,0,0]=4 3620 B10R1.408 CNC(=O)[C@@H]1C[C@H]1C(=O)O Amb24055632 [0,0,0,1,0,1|2,0,0]=4 3621 B10R1.408 COC(=O)C1CC1C(=O)O Amb19314991 [0,0,0,1,0,1|2,0,0]=4 3622 B10R1.408 COC(=O)C1OC1C(=O)O Amb25072766 [0,0,0,1,0,1|2,0,0]=4 3623 B10R1.408 COC(=O)[C@@H]1C[C@@H]1C(=O)O Amb25949202 [0,0,0,1,0,1|2,0,0]=4 3624 B10R1.408 COC(=O)[C@@H]1C[C@H]1C(=O)O Amb24183508 [0,0,0,1,0,1|2,0,0]=4 3625 B10R1.408 COC(=O)[C@@H]1O[C@H]1C(=O)O Amb25174796 [0,0,0,1,0,1|2,0,0]=4 3626 B10R1.408 COC(=O)[C@H]1C[C@@H]1C(=O)O Amb27254210 [0,0,0,1,0,1|2,0,0]=4 3627 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O Amb26397116 [0,0,0,1,0,1|2,0,0]=4 3628 B10R1.408 COC(=O)[C@H]1O[C@@H]1C(=O)O Amb24745530 [0,0,0,1,0,1|2,0,0]=4 3629 B10R1.408 COC(=O)[C@H]1O[C@H]1C(=O)O Amb24601831 [0,0,0,1,0,1|2,0,0]=4 3630 B10R1.408 NCC(N)C1CC1C(=O)O Amb25877789 [0,0,0,1,0,1|1,0,1]=4 3631 B10R1.408 O=C(O)C1CC1C(=O)CBr Amb27626250 [0,0,0,1,0,1|1,0,0]=3 3632 B10R1.58 C=C1CC(C(=O)O)CC1=O Amb28368152 [0,1,0,1,0,0|1,0,1]=4 3633 B10R1.58 C=C1CC(C(=O)O)CC1N Amb25996162 [0,1,0,1,0,0|1,0,0]=3 3634 B10R1.58 C=C1CC(C(=O)O)N=C1N Amb27828082 [0,1,0,1,0,0|1,0,1]=4 3635 B10R1.58 C=C1C[C@@H](C(=O)O)NC1=O Amb27437052 [0,1,0,1,0,0|1,0,1]=4 3636 B10R1.58 C=C1C[C@H](C(=O)O)C[C@@H]1N Amb25229776 [0,1,0,1,0,0|1,0,0]=3 3637 B10R1.58 CC(=O)C1CC(=O)C(C)C1 Amb26936800 [0,1,0,1,0,0|2,0,0]=4 3638 B10R1.58 CC1CC(C(=O)O)CC1=O Amb27413499 [0,1,0,1,0,0|1,0,0]=3 3639 B10R1.58 CC1CC(C(=O)O)NC1C Amb18831587 [0,1,0,1,0,0|1,0,1]=4 3640 B10R1.58 CC1CC(C(=O)O)OC1=O Amb27836333 [0,1,0,1,0,0|2,0,0]=4 3641 B10R1.58 CC1C[C@@H](C(=O)O)OC1=O Amb27615055 [0,1,0,1,0,0|2,0,0]=4 3642 B10R1.58 CC1NC(C(=O)O)CC1N Amb27768615 [0,1,0,1,0,0|1,0,1]=4 3643 B10R1.58 CC1NC(C(=O)O)CC1O Amb27876074 [0,1,0,1,0,0|0,0,2]=4 3644 B10R1.58 CC1NC(C(=O)O)C[C@H]1O Amb27167587 [0,1,0,1,0,0|0,0,2]=4 3645 B10R1.58 CC1OC(C(=O)O)OC1=O Amb27250530 [0,1,0,1,0,0|2,0,0]=4 3646 B10R1.58 CN1CC(C(=O)O)CC1=O Amb6315829 [0,1,0,1,0,0|2,0,0]=4 3647 B10R1.58 CN1C[C@H](C(=O)O)CC1=O Amb28326218 [0,1,0,1,0,0|2,0,0]=4 3648 B10R1.58 CN1NC(C(=O)O)CC1=O Amb27495618 [0,1,0,1,0,0|1,0,0]=3 3649 B10R1.58 C[C@@H]1C[C@@H](C(=O)O)N[C@@H]1C Amb27640711 [0,1,0,1,0,0|1,0,1]=4 3650 B10R1.58 C[C@@H]1N[C@H](C(=O)O)C[C@H]1F Amb27781898 [0,1,0,1,0,0|1,0,1]=4 3651 B10R1.58 NC1CC(C(=O)O)CC1F Amb27666691 [0,1,0,1,0,0|1,0,1]=4 3652 B10R1.58 NC1CC(C(=O)O)OC1=O Amb25147458 [0,1,0,1,0,0|1,0,0]=3 3653 B10R1.58 NN1CC(C(=O)O)CC1=O Amb27453836 [0,1,0,1,0,0|1,0,0]=3 3654 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb27630763 [0,1,0,1,0,0|0,0,2]=4 3655 B10R1.58 N[C@@H]1C[C@H](C(=O)O)C[C@H]1O Amb33017585 [0,1,0,1,0,0|0,0,2]=4 3656 B10R1.58 N[C@H]1CC(C(=O)O)C[C@@H]1O Amb27238051 [0,1,0,1,0,0|0,0,2]=4 3657 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1F Amb24568879 [0,1,0,1,0,0|1,0,1]=4 3658 B10R1.58 N[C@H]1C[C@@H](C(=O)O)C[C@@H]1O Amb27420224 [0,1,0,1,0,0|0,0,2]=4 3659 B10R1.58 N[C@H]1C[C@@H](C(=O)O)OC1=O Amb27782562 [0,1,0,1,0,0|1,0,0]=3 3660 B10R1.58 N[C@H]1C[C@@H](C(=O)O)SC1=O Amb27486281 [0,1,0,1,0,0|1,0,0]=3 3661 B10R1.58 N[C@H]1C[C@H](C(=O)O)C[C@@H]1O Amb28437238 [0,1,0,1,0,0|0,0,2]=4 3662 B10R1.58 O=C(O)C1CC(=O)N(O)C1 Amb27779851 [0,1,0,1,0,0|2,0,0]=4 3663 B10R1.58 O=C(O)[C@@H]1C[C@@H](Br)C(=O)O1 Amb28436779 [0,1,0,1,0,0|2,0,0]=4 3664 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Amb10839466 [0,1,0,1,0,0|2,0,0]=4 3665 B10R1.58 O=C1CC(C(=O)Cl)NC1=O Amb25060639 [0,1,0,1,0,0|1,0,1]=4 3666 B10R1.58 O=C1CC(C(=O)O)CC1=O Amb27948058 [0,1,0,1,0,0|1,0,1]=4 3667 B10R1.58 O=C1NC(C(=O)O)CC1F Amb24696741 [0,1,0,1,0,0|2,0,0]=4 3668 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@@H]1F Amb27421959 [0,1,0,1,0,0|2,0,0]=4 3669 B10R1.58 O=C1N[C@H](C(=O)O)CC1F Amb25360897 [0,1,0,1,0,0|2,0,0]=4 3670 B10R1.58 O=C1N[C@H](C(=O)O)CC1O Amb28208546 [0,1,0,1,0,0|2,0,0]=4 3671 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F Amb10838332 [0,1,0,1,0,0|2,0,0]=4 3672 B10R1.58 O=C1O[C@H](C(=O)O)C[C@@H]1O Amb25230626 [0,1,0,1,0,0|2,0,0]=4 3673 B10R1.83 C=C1CC(C(=O)O)C1(F)F Amb25132102 [0,1,0,1,0,0|2,0,0]=4 3674 B10R1.83 CC1(C)C(=O)CC1C(=O)O Amb23439763 [0,1,0,1,0,0|1,0,0]=3 3675 B10R1.83 CC1(C)C(=O)OC1C(=O)O Amb17593617 [0,1,0,1,0,0|2,0,0]=4 3676 B10R1.120 CC1(C)CC(=O)CCC1=O Amb25296618 [0,1,0,1,0,0|2,0,0]=4 3677 B10R1.120 CC1(C)NC(=O)CCC1=O Amb28347562 [0,1,0,1,0,0|2,0,0]=4 3678 B10R1.120 CC1(C)OC(=O)CCC1=O Amb27802853 [0,1,0,1,0,0|1,0,0]=3 3679 B10R1.147 NC1CS(=O)(=O)CCC1=O Amb32657812 [0,1,0,1,0,0|1,0,1]=4 3680 B10R1.190 NC(C[C@@H]1C[C@H]1N)C(=O)O Amb27783818 [0,1,0,1,0,0|1,0,1]=4 3681 B10R1.190 N[C@H](C[C@@H]1C[C@H]1N)C(=O)O Amb27194166 [0,1,0,1,0,0|1,0,1]=4 3682 B10R1.205 CC(N)C(=O)CCC1CO1 Amb33307856 [0,1,0,1,0,0|1,0,1]=4 3683 B10R1.205 C[C@@H](N)C(=O)CCC1CO1 Amb33307882 [0,1,0,1,0,0|1,0,1]=4 3684 B10R1.205 C[C@H](N)C(=O)CCC1CO1 Amb33307879 [0,1,0,1,0,0|1,0,1]=4 3685 B10R1.211 CC(=O)CCC(=O)C1CC1 Amb25983899 [0,1,0,1,0,0|2,0,0]=4 3686 B10R1.211 O=C(O)CCS(=O)C1CC1 Amb27228180 [0,1,0,1,0,0|2,0,0]=4 3687 B10R1.211 O=C(O)CNC(=O)C1CC1 Amb1116093 [0,1,0,1,0,0|2,0,0]=4 3688 B10R1.211 O=C(O)CNC(=O)C1CS1 Amb25288186 [0,1,0,1,0,0|2,0,0]=4 3689 B10R1.287 C=C1C(CC(=O)O)C1(F)F Amb27254119 [0,1,0,1,0,0|2,0,0]=4 3690 B10R1.332 C=C1CCC(=O)C(O)CC1 Amb28461134 [0,1,0,1,0,0|2,0,0]=4 3691 B10R1.332 C=C1CNC(=O)CNC1=O Amb33719118 [0,1,0,1,0,0|2,0,0]=4 3692 B10R1.332 O=C1CCC(=O)C(O)CN1 Amb27184436 [0,1,0,1,0,0|2,0,0]=4 3693 B10R1.359 CC1(C)CNC(C(=O)O)C1 Amb22756172 [0,1,0,1,0,0|1,0,1]=4 3694 B10R1.359 CC1(C)CNC(C(=O)O)C1 Amb33295174 [0,1,0,1,0,0|1,0,1]=4 3695 B10R1.359 CC1(C)CN[C@@H](C(=O)O)C1 Amb24620405 [0,1,0,1,0,0|1,0,1]=4 3696 B10R1.359 CC1(C)CN[C@H](C(=O)O)C1 Amb20671421 [0,1,0,1,0,0|1,0,1]=4 3697 B10R1.359 CC1(C)CN[C@H](C(=O)O)C1 Amb22751658 [0,1,0,1,0,0|1,0,1]=4 3698 B10R1.359 C[C@]1(O)CN[C@H](C(=O)O)C1 Amb27439990 [0,1,0,1,0,0|0,0,2]=4 3699 B10R1.359 C[Si]1(C)CNC(C(=O)O)C1 Amb29837967 [0,1,0,1,0,0|1,1,0]=4 3700 B10R1.359 NC(=O)C1CS(=O)(=O)CN1 Amb33716136 [0,1,0,1,0,0|2,0,0]=4 3701 B10R1.359 O=C(O)C1CC(F)(F)CN1 Amb19148521 [0,1,0,1,0,0|1,0,1]=4 3702 B10R1.359 O=C(O)C1CC(F)(F)CN1 Amb19149214 [0,1,0,1,0,0|1,0,1]=4 3703 B10R1.359 O=C(O)C1CCP(=O)(O)C1 Amb27450568 [0,1,0,1,0,0|2,0,0]=4 3704 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 Amb2568469 [0,1,0,1,0,0|2,0,0]=4 3705 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb19374734 [0,1,0,1,0,0|1,0,1]=4 3706 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb22169907 [0,1,0,1,0,0|1,0,1]=4 3707 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 Amb22747185 [0,1,0,1,0,0|1,0,1]=4 3708 B10R1.359 O=C(O)[C@H]1CC(F)(F)CN1 Amb26346483 [0,1,0,1,0,0|1,0,1]=4 3709 B10R1.359 O=C(O)[C@H]1CC(F)(F)CN1 Amb28989948 [0,1,0,1,0,0|1,0,1]=4 3710 B10R1.470 C=C1CCC(C)(C(=O)O)C1 Amb25789474 [0,1,0,1,0,0|2,0,0]=4 3711 B10R1.470 C=C1CCC(O)(C(=O)O)C1 Amb27620508 [0,1,0,1,0,0|2,0,0]=4 3712 B10R1.470 CC(=O)C1(C)CCC(=O)C1 Amb25146569 [0,1,0,1,0,0|2,0,0]=4 3713 B10R1.470 CC1(C(=O)O)CC(O)CN1 Amb27876103 [0,1,0,1,0,0|0,0,2]=4 3714 B10R1.470 CC1(C(=O)O)CC(O)CN1 Amb32666815 [0,1,0,1,0,0|0,0,2]=4 3715 B10R1.470 CC1(C(=O)O)CCC(=O)C1 Amb23454199 [0,1,0,1,0,0|1,0,0]=3 3716 B10R1.470 CC1(C(=O)O)CCC(=O)N1 Amb33545084 [0,1,0,1,0,0|2,0,0]=4 3717 B10R1.470 CC1(C(=O)O)CCC(=O)O1 Amb9783335 [0,1,0,1,0,0|2,0,0]=4 3718 B10R1.470 CC1(C(=O)O)CNC(=O)C1 Amb22546311 [0,1,0,1,0,0|2,0,0]=4 3719 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)N1 Amb28126701 [0,1,0,1,0,0|2,0,0]=4 3720 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)O1 Amb28067769 [0,1,0,1,0,0|2,0,0]=4 3721 B10R1.470 C[C@@]1(C(=O)O)C[C@@H](O)CN1 Amb26611422 [0,1,0,1,0,0|0,0,2]=4 3722 B10R1.470 C[C@]1(C(=O)O)CCC(=O)O1 Amb27881875 [0,1,0,1,0,0|2,0,0]=4 3723 B10R1.470 C[C@]1(C(=O)O)C[C@H](O)CN1 Amb24117149 [0,1,0,1,0,0|0,0,2]=4 3724 B10R1.470 NC1(C(=O)O)CCS(=O)C1 Amb26884927 [0,1,0,1,0,0|2,0,0]=4 3725 B10R1.470 O=C1CCC(O)(C(=O)O)O1 Amb28050065 [0,1,0,1,0,0|2,0,0]=4 3726 B10R1.470 O=C1C[C@@](O)(C(=O)O)CO1 Amb25084490 [0,1,0,1,0,0|2,0,0]=4 3727 B10R1.22 CC1CC(=O)CC(C)C1=O Amb28049885 [0,1,0,1,0,0|2,0,0]=4 3728 B10R1.22 C[C@@H]1OC(=O)C[C@H](O)C1=O Amb27629583 [0,1,0,1,0,0|1,0,0]=3 3729 B10R1.22 C[C@H]1CC(=O)C[C@H](C)C1=O Amb28052327 [0,1,0,1,0,0|2,0,0]=4 3730 B10R1.25 CCC1CCC(=O)OC1=O Amb27157859 [0,1,0,1,0,0|1,0,1]=4 3731 B10R1.64 C=C1COCC1CC(=O)O Amb27778654 [0,1,0,1,0,0|2,0,0]=4 3732 B10R1.64 CC(=O)CC1CCCC1=O Amb22363747 [0,1,0,1,0,0|2,0,0]=4 3733 B10R1.64 CC1CCNC1CC(=O)O Amb28059641 [0,1,0,1,0,0|1,0,1]=4 3734 B10R1.64 CC1CNCC1CC(=O)O Amb27643325 [0,1,0,1,0,0|1,0,1]=4 3735 B10R1.64 CC1CNCC1CC(=O)O Amb32753538 [0,1,0,1,0,0|1,0,1]=4 3736 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32683471 [0,1,0,1,0,0|1,0,1]=4 3737 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32684495 [0,1,0,1,0,0|1,0,1]=4 3738 B10R1.64 NC(=O)CC1CCCC1=O Amb26013400 [0,1,0,1,0,0|2,0,0]=4 3739 B10R1.64 NC(=O)CN1CNCC1=O Amb27254137 [0,1,0,1,0,0|2,0,0]=4 3740 B10R1.64 O=C(O)CC1=CCNC1=O Amb25125935 [0,1,0,1,0,0|1,0,1]=4 3741 B10R1.64 O=C(O)CC1=CNNC1=O Amb20036826 [0,1,0,1,0,0|1,0,1]=4 3742 B10R1.64 O=C(O)CC1CCCC1=O Amb18643831 [0,1,0,1,0,0|1,0,0]=3 3743 B10R1.64 O=C(O)CC1CCNC1=O Amb18831604 [0,1,0,1,0,0|1,0,0]=3 3744 B10R1.64 O=C(O)CC1CCOC1=O Amb18644064 [0,1,0,1,0,0|1,0,0]=3 3745 B10R1.64 O=C(O)CC1CNCC1=O Amb27797524 [0,1,0,1,0,0|0,0,0]=2 3746 B10R1.64 O=C(O)CC1CNCC1F Amb27434632 [0,1,0,1,0,0|1,0,1]=4 3747 B10R1.64 O=C(O)CC1CNCC1O Amb27789865 [0,1,0,1,0,0|0,0,2]=4 3748 B10R1.64 O=C(O)CC1NCCC1F Amb32990262 [0,1,0,1,0,0|1,0,1]=4 3749 B10R1.64 O=C(O)CC1OCOC1=O Amb27595868 [0,1,0,1,0,0|1,0,0]=3 3750 B10R1.64 O=C(O)CN1CCCC1=O Amb1154197 [0,1,0,1,0,0|2,0,0]=4 3751 B10R1.64 O=C(O)CN1CCNC1=O Amb2693086 [0,1,0,1,0,0|2,0,0]=4 3752 B10R1.64 O=C(O)CN1CCOC1=O Amb3941353 [0,1,0,1,0,0|2,0,0]=4 3753 B10R1.64 O=C(O)CN1CCSC1=O Amb433845 [0,1,0,1,0,0|2,0,0]=4 3754 B10R1.64 O=C(O)CN1COCC1=O Amb2692931 [0,1,0,1,0,0|2,0,0]=4 3755 B10R1.64 O=C(O)CN1CSCC1=O Amb1106003 [0,1,0,1,0,0|2,0,0]=4 3756 B10R1.64 O=C(O)C[C@H]1NCC[C@@H]1O Amb20242369 [0,1,0,1,0,0|0,0,2]=4 3757 B10R1.64 O=C(O)C[C@H]1OCOC1=O Amb27882671 [0,1,0,1,0,0|1,0,0]=3 3758 B10R1.163 CCN1CC(C(=O)O)C1=O Amb18862477 [0,1,0,1,0,0|2,0,0]=4 3759 B10R1.424 COC(=O)C1(C)CC(=O)O1 Amb27615111 [0,1,0,1,0,0|2,0,0]=4 3760 B10R1.424 COC(=O)[C@]1(C)CC(=O)O1 Amb27949184 [0,1,0,1,0,0|2,0,0]=4 3761 B10R1.71 O=C1CCCCC(=O)CC1 Amb4035103 [0,1,0,1,0,0|2,0,0]=4 3762 B10R1.119 CC1C(=O)CCC(=O)N1C Amb27390614 [0,1,0,1,0,0|2,0,0]=4 3763 B10R1.151 COC(=O)CCC1CNC1 Amb27246838 [0,1,0,1,0,0|1,0,1]=4 3764 B10R1.169 COC(=O)C1CC(CN)C1 Amb23439835 [0,1,0,1,0,0|1,0,1]=4 3765 B10R1.169 COC(=O)C1CC(CN)C1 Amb24670375 [0,1,0,1,0,0|1,0,1]=4 3766 B10R1.169 COC(=O)[C@H]1C[C@@H](CN)C1 Amb33715761 [0,1,0,1,0,0|1,0,1]=4 3767 B10R1.169 COC(=O)[C@H]1C[C@@H](CN)C1 Amb34139522 [0,1,0,1,0,0|1,0,1]=4 3768 B10R1.169 COC(=O)[C@H]1C[C@H](CN)C1 Amb33715757 [0,1,0,1,0,0|1,0,1]=4 3769 B10R1.169 COC(=O)[C@H]1C[C@H](CN)C1 Amb34164690 [0,1,0,1,0,0|1,0,1]=4 3770 B10R1.409 COC(=O)C1CC1(C)CN Amb26496288 [0,1,0,1,0,0|1,0,1]=4 3771 B10R1.409 COC(=O)[C@@H]1C[C@@]1(C)CN Amb27422018 [0,1,0,1,0,0|1,0,1]=4 3772 B10R1.412 C=C1C(=O)CC1C(=O)OC Amb26497563 [0,1,0,1,0,0|1,0,1]=4 3773 B10R1.412 COC(=O)C1NC(=O)C1C Amb27841623 [0,1,0,1,0,0|2,0,0]=4 3774 B10R1.412 COC(=O)C1NC(=O)C1N Amb28386017 [0,1,0,1,0,0|1,0,0]=3 3775 B10R1.412 COC(=O)[C@H]1NC(=O)[C@H]1C Amb27630717 [0,1,0,1,0,0|2,0,0]=4 3776 B10R1.113 CC(=O)C1C=CCC(=O)C1 Amb26476229 [0,1,0,1,0,0|2,0,0]=4 3777 B10R1.113 CC(=O)C1CCNC(=O)C1 Amb24511548 [0,1,0,1,0,0|2,0,0]=4 3778 B10R1.113 CC(=O)[C@@H]1CCCC(=O)C1 Amb27974638 [0,1,0,1,0,0|2,0,0]=4 3779 B10R1.113 CC1CCNC(C(=O)O)C1 Amb13886199 [0,1,0,1,0,0|1,0,1]=4 3780 B10R1.113 CC1CCNC(C(=O)O)C1 Amb19375550 [0,1,0,1,0,0|1,0,1]=4 3781 B10R1.113 CC1CNCC(C(=O)O)C1 Amb18643998 [0,1,0,1,0,0|1,0,1]=4 3782 B10R1.113 CN1CCNC(C(=O)O)C1 Amb10602764 [0,1,0,1,0,0|2,0,0]=4 3783 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22587697 [0,1,0,1,0,0|2,0,0]=4 3784 B10R1.113 CN1CCNC(C(=O)O)C1 Amb22754371 [0,1,0,1,0,0|2,0,0]=4 3785 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 Amb8393477 [0,1,0,1,0,0|1,0,1]=4 3786 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Amb28198256 [0,1,0,1,0,0|1,0,1]=4 3787 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb28186632 [0,1,0,1,0,0|1,0,1]=4 3788 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Amb35746974 [0,1,0,1,0,0|1,0,1]=4 3789 B10R1.113 C[C@@H]1C[C@H](C(=O)O)NCO1 Amb27618567 [0,1,0,1,0,0|1,0,1]=4 3790 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb22744764 [0,1,0,1,0,0|1,0,1]=4 3791 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Amb33330844 [0,1,0,1,0,0|1,0,1]=4 3792 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Amb26968513 [0,1,0,1,0,0|1,0,1]=4 3793 B10R1.113 NC(=O)C1CC(=O)CCN1 Amb18202632 [0,1,0,1,0,0|1,0,0]=3 3794 B10R1.113 NC(=O)C1CCCC(=O)C1 Amb24470598 [0,1,0,1,0,0|2,0,0]=4 3795 B10R1.113 NC(=O)C1CNCC(=O)N1 Amb27843743 [0,1,0,1,0,0|2,0,0]=4 3796 B10R1.113 NC1=NCCC(C(=O)O)C1 Amb28042963 [0,1,0,1,0,0|2,0,0]=4 3797 B10R1.113 N[C@@H]1CNC[C@@H](C(=O)O)C1 Amb27186917 [0,1,0,1,0,0|1,0,1]=4 3798 B10R1.113 O=C(O)C1CC(Cl)CNN1 Amb27837992 [0,1,0,1,0,0|1,0,1]=4 3799 B10R1.113 O=C(O)C1CC(F)CCN1 Amb24423965 [0,1,0,1,0,0|1,0,1]=4 3800 B10R1.113 O=C(O)C1CC(O)CCN1 Amb24117443 [0,1,0,1,0,0|0,0,2]=4 3801 B10R1.113 O=C(O)C1CNCC(O)C1 Amb2695137 [0,1,0,1,0,0|0,0,2]=4 3802 B10R1.113 O=C(O)C1CNCC(O)C1 Amb8630089 [0,1,0,1,0,0|0,0,2]=4 3803 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb26024462 [0,1,0,1,0,0|1,0,0]=3 3804 B10R1.113 O=C(O)C1CS(=O)CCN1 Amb33038317 [0,1,0,1,0,0|1,0,0]=3 3805 B10R1.113 O=C(O)[C@@H]1CNC[C@@H](O)C1 Amb27186916 [0,1,0,1,0,0|0,0,2]=4 3806 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Amb27447199 [0,1,0,1,0,0|1,0,1]=4 3807 B10R1.113 O=C(O)[C@@H]1CNC[C@H](O)C1 Amb27188671 [0,1,0,1,0,0|0,0,2]=4 3808 B10R1.113 O=C(O)[C@@H]1CS(=O)CCN1 Amb27444621 [0,1,0,1,0,0|1,0,0]=3 3809 B10R1.113 O=C(O)[C@@H]1C[C@@H](O)CCN1 Amb22388540 [0,1,0,1,0,0|0,0,2]=4 3810 B10R1.113 O=C(O)[C@@H]1C[C@H](F)CCN1 Amb27786906 [0,1,0,1,0,0|1,0,1]=4 3811 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CCN1 Amb22386828 [0,1,0,1,0,0|0,0,2]=4 3812 B10R1.113 O=C(O)[C@@H]1C[C@H](O)CNN1 Amb25949203 [0,1,0,1,0,0|0,0,2]=4 3813 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 Amb20241913 [0,1,0,1,0,0|0,0,2]=4 3814 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb22748263 [0,1,0,1,0,0|0,0,2]=4 3815 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Amb30982057 [0,1,0,1,0,0|0,0,2]=4 3816 B10R1.113 O=C(O)[C@H]1C[C@H](O)CNN1 Amb27450594 [0,1,0,1,0,0|0,0,2]=4 3817 B10R1.113 O=C1C=CCC(C(=O)O)C1 Amb18643491 [0,1,0,1,0,0|1,0,1]=4 3818 B10R1.113 O=C1CC(C(=O)O)CCN1 Amb33531218 [0,1,0,1,0,0|1,0,0]=3 3819 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb22546429 [0,1,0,1,0,0|1,0,0]=3 3820 B10R1.113 O=C1CC(C(=O)O)CNN1 Amb28144294 [0,1,0,1,0,0|1,0,0]=3 3821 B10R1.113 O=C1CC(C(=O)O)N=CN1 Amb24099645 [0,1,0,1,0,0|0,0,2]=4 3822 B10R1.113 O=C1CC=CC(C(=O)O)N1 Amb27785978 [0,1,0,1,0,0|2,0,0]=4 3823 B10R1.113 O=C1CCC=C(C(=O)O)C1 Amb2699959 [0,1,0,1,0,0|1,0,1]=4 3824 B10R1.113 O=C1CCCC(C(=O)O)C1 Amb6305244 [0,1,0,1,0,0|1,0,0]=3 3825 B10R1.113 O=C1CCCC(C(=O)O)N1 Amb2697230 [0,1,0,1,0,0|2,0,0]=4 3826 B10R1.113 O=C1CCCC(C(=O)O)O1 Amb27969173 [0,1,0,1,0,0|2,0,0]=4 3827 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 Amb28050152 [0,1,0,1,0,0|1,0,0]=3 3828 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 Amb10576327 [0,1,0,1,0,0|2,0,0]=4 3829 B10R1.113 O=C1CCC[C@H](C(=O)O)N1 Amb8631220 [0,1,0,1,0,0|2,0,0]=4 3830 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889088 [0,1,0,1,0,0|0,0,0]=2 3831 B10R1.113 O=C1CCNC(C(=O)O)C1 Amb13889089 [0,1,0,1,0,0|0,0,0]=2 3832 B10R1.113 O=C1CCN[C@@H](C(=O)O)C1 Amb27977165 [0,1,0,1,0,0|0,0,0]=2 3833 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb13889084 [0,1,0,1,0,0|0,0,0]=2 3834 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 Amb2699956 [0,1,0,1,0,0|0,0,0]=2 3835 B10R1.113 O=C1CCOC(C(=O)O)C1 Amb22496784 [0,1,0,1,0,0|1,0,0]=3 3836 B10R1.113 O=C1CNCC(C(=O)O)C1 Amb27244770 [0,1,0,1,0,0|0,0,0]=2 3837 B10R1.113 O=C1CNC[C@H](C(=O)O)N1 Amb27398104 [0,1,0,1,0,0|1,0,0]=3 3838 B10R1.113 O=C1COCC(C(=O)O)N1 Amb18862478 [0,1,0,1,0,0|2,0,0]=4 3839 B10R1.113 O=C1COCC(C(=O)O)O1 Amb27209316 [0,1,0,1,0,0|2,0,0]=4 3840 B10R1.113 O=C1COC[C@@H](C(=O)O)N1 Amb27164013 [0,1,0,1,0,0|2,0,0]=4 3841 B10R1.113 O=C1CSCC(C(=O)O)N1 Amb2693036 [0,1,0,1,0,0|2,0,0]=4 3842 B10R1.113 O=C1CSC[C@@H](C(=O)O)N1 Amb26516534 [0,1,0,1,0,0|2,0,0]=4 3843 B10R1.113 O=C1CSC[C@H](C(=O)O)N1 Amb27667984 [0,1,0,1,0,0|2,0,0]=4 3844 B10R1.113 O=C1NC(C(=O)O)CCO1 Amb28121893 [0,1,0,1,0,0|2,0,0]=4 3845 B10R1.113 O=C1NC(C(=O)O)CCS1 Amb28342373 [0,1,0,1,0,0|2,0,0]=4 3846 B10R1.116 O=C(O)C(O)C1CCC1=O Amb28349882 [0,1,0,1,0,0|1,0,0]=3 3847 B10R1.118 CC1NC(=O)C(C)OC1=O Amb27427452 [0,1,0,1,0,0|2,0,0]=4 3848 B10R1.118 CC1OC(=O)C(C)OC1=O Amb2720905 [0,1,0,1,0,0|2,0,0]=4 3849 B10R1.118 CC1OC(=O)[C@@H](C)NC1=O Amb27483050 [0,1,0,1,0,0|2,0,0]=4 3850 B10R1.118 CC1OC(=O)[C@H](C)NC1=O Amb27492923 [0,1,0,1,0,0|2,0,0]=4 3851 B10R1.118 C[C@@H]1NC(=O)[C@H](C)OC1=O Amb28075504 [0,1,0,1,0,0|2,0,0]=4 3852 B10R1.118 C[C@@H]1OC(=O)[C@H](C)OC1=O Amb22336588 [0,1,0,1,0,0|2,0,0]=4 3853 B10R1.118 C[C@H]1NC(=O)[C@@H](C)OC1=O Amb24569311 [0,1,0,1,0,0|2,0,0]=4 3854 B10R1.118 C[C@H]1OC(=O)[C@@H](C)OC1=O Amb25911854 [0,1,0,1,0,0|2,0,0]=4 3855 B10R1.204 NC(CC1=CCC1)C(=O)O Amb28239360 [0,1,0,1,0,0|2,0,0]=4 3856 B10R1.484 CC1(CN)CC1(C)C(=O)O Amb27474961 [0,1,0,1,0,0|1,0,1]=4 3857 B10R1.490 CC1(C(=O)O)CC(CN)C1 Amb32947149 [0,1,0,1,0,0|1,0,1]=4 3858 B10R1.490 NCC1CC(N)(C(=O)O)C1 Amb28384594 [0,1,0,1,0,0|1,0,1]=4 3859 B10R1.490 NC[C@H]1C[C@@](N)(C(=O)O)C1 Amb27599840 [0,1,0,1,0,0|1,0,1]=4 3860 B10R1.66 O=C(O)CCC1=CCCC1 Amb27591549 [0,1,0,1,0,0|2,0,0]=4 3861 B10R1.66 O=C(O)CCC1=NCCS1 Amb27796241 [0,1,0,1,0,0|1,1,0]=4 3862 B10R1.66 O=C(O)CCC1CCNC1 Amb20668417 [0,1,0,1,0,0|1,0,1]=4 3863 B10R1.66 O=C(O)CCC1CCNC1 Amb22059448 [0,1,0,1,0,0|1,0,1]=4 3864 B10R1.30 C=CC1OC(=O)CCC1=C Amb8389943 [0,1,0,1,0,0|2,0,0]=4 3865 B10R1.30 CCN1CC(=O)CCC1=O Amb23555699 [0,1,0,1,0,0|2,0,0]=4 3866 B10R1.30 CSC1OC(=O)OCC1=O Amb27218347 [0,1,0,1,0,0|2,0,0]=4 3867 B10R1.30 NC[C@@H]1NC(=O)CNC1=O Amb28068613 [0,1,0,1,0,0|2,0,0]=4 3868 B10R1.59 C=C1CC(N)C(C(=O)O)C1 Amb27779891 [0,1,0,1,0,0|1,0,0]=3 3869 B10R1.59 C=C1C[C@H](N)[C@@H](C(=O)O)C1 Amb10071928 [0,1,0,1,0,0|1,0,0]=3 3870 B10R1.59 C=C1C[C@H](N)[C@H](C(=O)O)C1 Amb17938168 [0,1,0,1,0,0|1,0,0]=3 3871 B10R1.59 CC(=O)[C@@H]1CC(=O)C[C@@H]1C Amb27844197 [0,1,0,1,0,0|2,0,0]=4 3872 B10R1.59 CC1=CC(C(=O)O)C(N)C1 Amb27838089 [0,1,0,1,0,0|1,0,1]=4 3873 B10R1.59 CC1=CC(N)C(C(=O)O)C1 Amb27408423 [0,1,0,1,0,0|1,0,0]=3 3874 B10R1.59 CC1=C[C@@H](C(=O)O)[C@@H](N)C1 Amb27629270 [0,1,0,1,0,0|1,0,1]=4 3875 B10R1.59 CC1=C[C@@H](N)[C@@H](C(=O)O)C1 Amb27956118 [0,1,0,1,0,0|1,0,0]=3 3876 B10R1.59 CC1=C[C@@H](N)[C@H](C(=O)O)C1 Amb27882639 [0,1,0,1,0,0|1,0,0]=3 3877 B10R1.59 CC1=C[C@H](C(=O)O)[C@@H](N)C1 Amb27975743 [0,1,0,1,0,0|1,0,1]=4 3878 B10R1.59 CC1=C[C@H](N)[C@H](C(=O)O)C1 Amb25174958 [0,1,0,1,0,0|1,0,0]=3 3879 B10R1.59 CC1CC(=O)NC1C(=O)O Amb25063723 [0,1,0,1,0,0|2,0,0]=4 3880 B10R1.59 CC1CC(N)C(C(=O)O)C1 Amb28075037 [0,1,0,1,0,0|1,0,1]=4 3881 B10R1.59 CC1C[C@H](N)[C@H](C(=O)O)C1 Amb27871980 [0,1,0,1,0,0|1,0,1]=4 3882 B10R1.59 CC1NC(=O)OC1C(=O)O Amb25046075 [0,1,0,1,0,0|2,0,0]=4 3883 B10R1.59 CC1OC(=O)NC1C(=O)O Amb18644184 [0,1,0,1,0,0|2,0,0]=4 3884 B10R1.59 CC1SC(=O)NC1C(=O)O Amb28208417 [0,1,0,1,0,0|2,0,0]=4 3885 B10R1.59 CC1SC(=O)SC1C(=O)O Amb23504453 [0,1,0,1,0,0|2,0,0]=4 3886 B10R1.59 CN1CC(F)CC1C(=O)O Amb28050082 [0,1,0,1,0,0|1,0,1]=4 3887 B10R1.59 CN1CC(F)CC1C(=O)O Amb32666364 [0,1,0,1,0,0|1,0,1]=4 3888 B10R1.59 CN1CC(N)CC1C(=O)O Amb27403072 [0,1,0,1,0,0|1,0,1]=4 3889 B10R1.59 CN1CC(O)CC1C(=O)O Amb5719759 [0,1,0,1,0,0|0,0,2]=4 3890 B10R1.59 CN1CC(O)C[C@H]1C(=O)O Amb27849693 [0,1,0,1,0,0|0,0,2]=4 3891 B10R1.59 CN1C[C@@H](N)C[C@@H]1C(=O)O Amb34915546 [0,1,0,1,0,0|1,0,1]=4 3892 B10R1.59 CN1C[C@@H](N)C[C@H]1C(=O)O Amb19516794 [0,1,0,1,0,0|1,0,1]=4 3893 B10R1.59 CN1C[C@@H](O)C[C@H]1C(=O)O Amb22757084 [0,1,0,1,0,0|0,0,2]=4 3894 B10R1.59 CN1C[C@@H](S)C[C@H]1C(=O)O Amb26027085 [0,1,0,1,0,0|0,1,1]=4 3895 B10R1.59 CN1C[C@H](F)C[C@@H]1C(=O)O Amb34916254 [0,1,0,1,0,0|1,0,1]=4 3896 B10R1.59 CN1C[C@H](F)C[C@H]1C(=O)O Amb25175012 [0,1,0,1,0,0|1,0,1]=4 3897 B10R1.59 CN1C[C@H](F)C[C@H]1C(=O)O Amb32662833 [0,1,0,1,0,0|1,0,1]=4 3898 B10R1.59 CN1C[C@H](N)C[C@H]1C(=O)O Amb23385233 [0,1,0,1,0,0|1,0,1]=4 3899 B10R1.59 CN1C[C@H](O)C[C@H]1C(=O)O Amb27447191 [0,1,0,1,0,0|0,0,2]=4 3900 B10R1.59 CN1N=C(Cl)CC1C(=O)O Amb27797504 [0,1,0,1,0,0|2,0,0]=4 3901 B10R1.59 CN1NC(=O)CC1C(=O)O Amb25761701 [0,1,0,1,0,0|1,0,0]=3 3902 B10R1.59 C[C@@H]1CC(=O)C[C@H]1C(=O)O Amb26891990 [0,1,0,1,0,0|1,0,0]=3 3903 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O Amb27188183 [0,1,0,1,0,0|2,0,0]=4 3904 B10R1.59 C[C@@H]1CC(=O)O[C@@H]1C(=O)O Amb28428901 [0,1,0,1,0,0|2,0,0]=4 3905 B10R1.59 C[C@@H]1C[C@@H](C(=O)O)N(C)C1 Amb30869371 [0,1,0,1,0,0|1,0,1]=4 3906 B10R1.59 C[C@@H]1C[C@H](C(=O)O)N(C)C1 Amb30869372 [0,1,0,1,0,0|1,0,1]=4 3907 B10R1.59 C[C@@H]1C[C@H](C(=O)O)N(C)C1 Amb33716166 [0,1,0,1,0,0|1,0,1]=4 3908 B10R1.59 C[C@@H]1NC(=O)C[C@@H]1C(N)=O Amb27445968 [0,1,0,1,0,0|2,0,0]=4 3909 B10R1.59 C[C@@H]1NC(=O)C[C@H]1C(=O)O Amb18202489 [0,1,0,1,0,0|1,0,0]=3 3910 B10R1.59 C[C@@H]1NC(=O)O[C@@H]1C(=O)O Amb28057719 [0,1,0,1,0,0|2,0,0]=4 3911 B10R1.59 C[C@@H]1NC(=O)O[C@H]1C(=O)O Amb27630658 [0,1,0,1,0,0|2,0,0]=4 3912 B10R1.59 C[C@@H]1OC(=O)C[C@@H]1C(=O)O Amb27810863 [0,1,0,1,0,0|1,0,0]=3 3913 B10R1.59 C[C@@H]1OC(=O)N[C@H]1C(=O)O Amb25243703 [0,1,0,1,0,0|2,0,0]=4 3914 B10R1.59 C[C@@H]1SC(=O)S[C@H]1C(=O)O Amb28384455 [0,1,0,1,0,0|2,0,0]=4 3915 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O Amb28429784 [0,1,0,1,0,0|2,0,0]=4 3916 B10R1.59 C[C@H]1CC(=O)O[C@@H]1C(=O)O Amb27230560 [0,1,0,1,0,0|2,0,0]=4 3917 B10R1.59 C[C@H]1C[C@@H](C(=O)O)N(C)C1 Amb33801092 [0,1,0,1,0,0|1,0,1]=4 3918 B10R1.59 C[C@H]1C[C@H](C(=O)O)N(C)C1 Amb34915561 [0,1,0,1,0,0|1,0,1]=4 3919 B10R1.59 C[C@H]1NC(=O)O[C@@H]1C(=O)O Amb28346276 [0,1,0,1,0,0|2,0,0]=4 3920 B10R1.59 C[C@H]1OC(=O)O[C@@H]1C(=O)O Amb27446650 [0,1,0,1,0,0|2,0,0]=4 3921 B10R1.59 NC1=C(C(=O)O)CC(=O)N1 Amb27169225 [0,1,0,1,0,0|0,0,2]=4 3922 B10R1.59 NC1CC(=O)CC1C(=O)O Amb24523031 [0,1,0,1,0,0|0,0,0]=2 3923 B10R1.59 NC1CC(O)CC1C(=O)O Amb26583126 [0,1,0,1,0,0|0,0,2]=4 3924 B10R1.59 NC1C[C@H](N)[C@H](C(=O)O)C1 Amb27202789 [0,1,0,1,0,0|1,0,1]=4 3925 B10R1.59 N[C@@H]1C[C@H](O)C[C@@H]1C(=O)O Amb32651666 [0,1,0,1,0,0|0,0,2]=4 3926 B10R1.59 N[C@@H]1C[C@H](O)C[C@@H]1C(=O)O Amb32992726 [0,1,0,1,0,0|0,0,2]=4 3927 B10R1.59 N[C@H]1CC(=O)C[C@H]1C(=O)O Amb27658876 [0,1,0,1,0,0|0,0,0]=2 3928 B10R1.59 N[C@H]1CC(O)C[C@H]1C(=O)O Amb27818161 [0,1,0,1,0,0|0,0,2]=4 3929 B10R1.59 O=C1CC(O)C(C(=O)O)N1 Amb27175349 [0,1,0,1,0,0|2,0,0]=4 3930 B10R1.59 O=C1CC(O)C(C(=O)O)O1 Amb27815003 [0,1,0,1,0,0|2,0,0]=4 3931 B10R1.59 O=C1C[C@@H](O)[C@H](C(=O)O)O1 Amb27254163 [0,1,0,1,0,0|2,0,0]=4 3932 B10R1.59 O=C1C[C@H](O)[C@@H](C(=O)O)N1 Amb27803055 [0,1,0,1,0,0|2,0,0]=4 3933 B10R1.82 NC1CC(CCC(=O)O)C1 Amb31254734 [0,1,0,1,0,0|1,0,1]=4 3934 B10R1.82 NC1CC(CCC(=O)O)C1 Amb33457338 [0,1,0,1,0,0|1,0,1]=4 3935 B10R1.82 N[C@H]1C[C@@H](CCC(=O)O)C1 Amb32828693 [0,1,0,1,0,0|1,0,1]=4 3936 B10R1.82 N[C@H]1C[C@@H](CCC(=O)O)C1 Amb33330526 [0,1,0,1,0,0|1,0,1]=4 3937 B10R1.138 CNCC(=O)CCC1CO1 Amb33307858 [0,1,0,1,0,0|1,0,1]=4 3938 B10R1.138 NCCC(=O)CCC1CO1 Amb33307857 [0,1,0,1,0,0|1,0,1]=4 3939 B10R1.140 CCNC(=O)C1CC(=O)C1 Amb27650010 [0,1,0,1,0,0|2,0,0]=4 3940 B10R1.140 CCOC(=O)C1CC(=O)C1 Amb19958420 [0,1,0,1,0,0|2,0,0]=4 3941 B10R1.140 CCOC(=O)C1CC(=O)N1 Amb27170656 [0,1,0,1,0,0|2,0,0]=4 3942 B10R1.140 CCOC(=O)C1CC(=O)O1 Amb27758789 [0,1,0,1,0,0|1,0,0]=3 3943 B10R1.140 CCOC(=O)[C@@H]1CC(=O)O1 Amb26494205 [0,1,0,1,0,0|1,0,0]=3 3944 B10R1.140 CCOC(=O)[C@H]1CC(=O)O1 Amb26479677 [0,1,0,1,0,0|1,0,0]=3 3945 B10R1.288 CC1(C)C[C@H](C(=O)O)[C@H]1N Amb25313341 [0,1,0,1,0,0|1,0,1]=4 3946 B10R1.351 O=C(O)CC1CCS1(=O)=O Amb28435286 [0,1,0,1,0,0|2,0,0]=4 3947 B10R2.30 O=C1C[C@H]2C(=O)CC[C@@H]12 Amb27440452 [0,0,0,2,0,0|2,0,0]=4 3948 B10R2.60 O=C1CC2CC1CC2=O Amb26421003 [0,0,0,2,0,0|2,0,0]=4 3949 B10R2.60 O=C1C[C@@H]2C[C@H]1CC2=O Amb26528589 [0,0,0,2,0,0|2,0,0]=4 3950 B10R2.60 O=C1C[C@H]2C[C@@H]1CC2=O Amb27619782 [0,0,0,2,0,0|2,0,0]=4 3951 B10R2.64 O=C1C[C@@H]2C(=O)O[C@@H]2C1 Amb26034562 [0,0,0,2,0,0|1,0,0]=3 3952 B10R2.64 O=C1C[C@@H]2OC(=O)[C@@H]2C1 Amb27793026 [0,0,0,2,0,0|1,0,0]=3 3953 B10R2.348 O=C(O)C12CC(CN1)C2 Amb2371884 [0,0,0,2,0,0|1,0,1]=4 3954 B10R2.348 O=C(O)C12CC(CN1)C2 Amb475056 [0,0,0,2,0,0|1,0,1]=4 3955 B10R2.355 O=C(O)C1NCC2CC21 Amb2444163 [0,0,0,2,0,0|1,0,1]=4 3956 B10R2.355 O=C(O)C1NCC2CC21 Amb30869339 [0,0,0,2,0,0|1,0,1]=4 3957 B10R2.355 O=C(O)C1NC[C@@H]2C[C@H]12 Amb27474270 [0,0,0,2,0,0|1,0,1]=4 3958 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb22737256 [0,0,0,2,0,0|1,0,1]=4 3959 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2C[C@@H]21 Amb30869362 [0,0,0,2,0,0|1,0,1]=4 3960 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb18792526 [0,0,0,2,0,0|1,0,1]=4 3961 B10R2.355 O=C(O)[C@@H]1NC[C@H]2C[C@H]21 Amb23440593 [0,0,0,2,0,0|1,0,1]=4 3962 B10R2.355 O=C(O)[C@H]1NC[C@@H]2CC12 Amb25924032 [0,0,0,2,0,0|1,0,1]=4 3963 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@@H]12 Amb27655855 [0,0,0,2,0,0|1,0,1]=4 3964 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb17913042 [0,0,0,2,0,0|1,0,1]=4 3965 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Amb2372045 [0,0,0,2,0,0|1,0,1]=4 3966 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb2372044 [0,0,0,2,0,0|1,0,1]=4 3967 B10R2.355 O=C(O)[C@H]1NC[C@H]2C[C@H]21 Amb33801121 [0,0,0,2,0,0|1,0,1]=4 3968 B10R2.357 O=C(O)C1CC2CC2N1 Amb18203281 [0,0,0,2,0,0|1,0,1]=4 3969 B10R2.357 O=C(O)C1CC2CC2N1 Amb505664 [0,0,0,2,0,0|1,0,1]=4 3970 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb18792527 [0,0,0,2,0,0|1,0,1]=4 3971 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb23439721 [0,0,0,2,0,0|1,0,1]=4 3972 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Amb2372541 [0,0,0,2,0,0|1,0,1]=4 3973 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb17719277 [0,0,0,2,0,0|1,0,1]=4 3974 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Amb2372046 [0,0,0,2,0,0|1,0,1]=4 3975 B10R2.357 O=C(O)[C@H]1C[C@H]2C[C@H]2N1 Amb33801107 [0,0,0,2,0,0|1,0,1]=4 3976 B10R2.73 O=C1CCC(=O)C2CC12 Amb27828905 [0,0,0,2,0,0|2,0,0]=4 3977 B10R2.638 O=C(O)C1CC12CNC2 Amb27808558 [0,0,0,2,0,0|1,0,1]=4 3978 B10R2.638 O=C(O)C1CC12CNC2 Amb32664978 [0,0,0,2,0,0|1,0,1]=4 3979 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,0,0,0,1,0|1,0,0]=3 3980 B6R0.2 C=C(C)CC(C)=O Amb17593075 [1,0,0,0,1,0|2,0,0]=4 3981 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,0,0,0,1,0|1,0,1]=4 3982 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,0,0,0,1,0|1,0,1]=4 3983 B6R0.2 CC(=O)CC(=O)F Amb28122452 [1,0,0,0,1,0|1,0,0]=3 3984 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,0,0,0,1,0|0,0,0]=2 3985 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [1,0,0,0,1,0|0,0,1]=3 3986 B6R0.2 CC(=O)CC(C)=O Amb2716228 [1,0,0,0,1,0|1,0,0]=3 3987 B6R0.2 CC(=O)CC(C)=S Amb28381251 [1,0,0,0,1,0|1,1,0]=4 3988 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,0,0,0,1,0|1,0,1]=4 3989 B6R0.2 CC(=O)CC(N)=O Amb6608777 [1,0,0,0,1,0|1,0,0]=3 3990 B6R0.2 CC(=O)C[N+](=O)[O-] Amb18833135 [1,0,0,0,1,0|1,0,1]=4 3991 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,0,0,0,1,0|1,0,0]=3 3992 B6R0.2 CC(=O)NC(C)=O Amb4066511 [1,0,0,0,1,0|2,0,0]=4 3993 B6R0.2 CC(=O)NC(N)=O Amb6891959 [1,0,0,0,1,0|2,0,0]=4 3994 B6R0.2 CC(=O)OC(C)=O Amb2793035 [1,0,0,0,1,0|2,0,0]=4 3995 B6R0.2 CC(=O)OC(N)=O Amb28283882 [1,0,0,0,1,0|2,0,0]=4 3996 B6R0.2 CC(=O)SC(=O)Cl Amb32679653 [1,0,0,0,1,0|2,0,0]=4 3997 B6R0.2 CC(=O)SC(C)=O Amb4025813 [1,0,0,0,1,0|2,0,0]=4 3998 B6R0.2 CC(=O)[CH-]C(C)=O Amb34196937 [1,0,0,0,1,0|1,0,1]=4 3999 B6R0.2 CC(=O)[CH-]C(C)=O Amb9787378 [1,0,0,0,1,0|1,0,1]=4 4000 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [1,0,0,0,1,0|1,0,1]=4 4001 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,0,0,0,1,0|0,1,0]=3 4002 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,0,0,0,1,0|1,0,1]=4 4003 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,0,0,0,1,0|1,0,1]=4 4004 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,0,0,0,1,0|1,0,1]=4 4005 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,0,0,0,1,0|1,0,1]=4 4006 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,0,0,0,1,0|1,0,1]=4 4007 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,0,0,0,1,0|1,0,1]=4 4008 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,0,0,0,1,0|0,0,2]=4 4009 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,0,0,0,1,0|1,0,1]=4 4010 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,0,0,0,1,0|0,1,1]=4 4011 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,0,0,0,1,0|2,0,0]=4 4012 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,0,0,0,1,0|2,0,0]=4 4013 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,0,0,0,1,0|2,0,0]=4 4014 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,0,0,0,1,0|1,0,1]=4 4015 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,0,0,0,1,0|2,0,0]=4 4016 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,0,0,0,1,0|1,0,1]=4 4017 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,0,0,0,1,0|1,0,1]=4 4018 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,0,0,0,1,0|1,0,1]=4 4019 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,0,0,0,1,0|1,0,1]=4 4020 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,0,0,0,1,0|0,0,2]=4 4021 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,0,0,0,1,0|1,0,1]=4 4022 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,0,0,0,1,0|1,0,1]=4 4023 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,0,0,0,1,0|1,0,1]=4 4024 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,0,0,0,1,0|0,0,2]=4 4025 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,0,0,0,1,0|2,0,0]=4 4026 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,0,0,0,1,0|2,0,0]=4 4027 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,0,0,0,1,0|1,0,1]=4 4028 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,0,0,0,1,0|1,0,1]=4 4029 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,0,0,0,1,0|1,0,1]=4 4030 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,0,0,0,1,0|1,0,1]=4 4031 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,0,0,0,1,0|1,0,1]=4 4032 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,0,0,0,1,0|1,0,1]=4 4033 B6R0.2 N=C(N)CC(N)=O Amb1981332 [1,0,0,0,1,0|2,0,0]=4 4034 B6R0.2 N=C(N)CC(N)=O Amb5719691 [1,0,0,0,1,0|2,0,0]=4 4035 B6R0.2 N=C([NH3+])CC(N)=O Amb2439350 [1,0,0,0,1,0|2,0,0]=4 4036 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,0,0,0,1,0|0,0,0]=2 4037 B6R0.2 NC(=O)CC(=O)[O-] Amb22263088 [1,0,0,0,1,0|0,0,1]=3 4038 B6R0.2 NC(=O)CC(N)=O Amb1971463 [1,0,0,0,1,0|1,0,0]=3 4039 B6R0.2 NC(=O)CC(N)=S Amb1155422 [1,0,0,0,1,0|1,1,0]=4 4040 B6R0.2 NC(=O)C[N+](=O)[O-] Amb1101925 [1,0,0,0,1,0|1,0,1]=4 4041 B6R0.2 NC(=O)NC(N)=O Amb6346179 [1,0,0,0,1,0|2,0,0]=4 4042 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,0,0,0,1,0|0,1,0]=3 4043 B6R0.2 NC(N)=CC(=O)O Amb27618962 [1,0,0,0,1,0|1,0,1]=4 4044 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,0,0,0,1,0|0,1,1]=4 4045 B6R0.2 O=C(Cl)CC(=O)Cl Amb3940237 [1,0,0,0,1,0|2,0,0]=4 4046 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,0,0,0,1,0|1,0,0]=3 4047 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,0,0,0,1,0|1,0,0]=3 4048 B6R0.2 O=C(O)CS(=O)O Amb27788997 [1,0,0,0,1,0|2,0,0]=4 4049 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516686 [1,0,0,0,1,0|1,0,1]=4 4050 B6R0.2 O=C([O-])CC(=O)[O-] Amb8516816 [1,0,0,0,1,0|1,0,1]=4 4051 B6R0.3 C=C(C)C(=O)CN Amb27150262 [0,0,0,0,2,0|2,0,0]=4 4052 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [0,0,0,0,2,0|2,0,0]=4 4053 B6R0.3 C=C(CC)C(=O)O Amb18639591 [0,0,0,0,2,0|2,0,0]=4 4054 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [0,0,0,0,2,0|2,0,0]=4 4055 B6R0.3 C=C(CO)C(=O)O Amb18121817 [0,0,0,0,2,0|2,0,0]=4 4056 B6R0.3 C=C(CS)C(=O)O Amb27263242 [0,0,0,0,2,0|2,0,0]=4 4057 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,0,0,0,2,0|2,0,0]=4 4058 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,0,0,0,2,0|2,0,0]=4 4059 B6R0.3 CC(CN)C(=O)O Amb2699128 [0,0,0,0,2,0|1,0,1]=4 4060 B6R0.3 CC(CN)C(=O)O Amb6773978 [0,0,0,0,2,0|1,0,1]=4 4061 B6R0.3 CC(CN)C(=O)O Amb8631418 [0,0,0,0,2,0|1,0,1]=4 4062 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [0,0,0,0,2,0|2,0,0]=4 4063 B6R0.3 CCC(=O)C(=O)O Amb3940359 [0,0,0,0,2,0|1,0,0]=3 4064 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [0,0,0,0,2,0|1,0,1]=4 4065 B6R0.3 CCC(=O)C(C)=O Amb8514604 [0,0,0,0,2,0|2,0,0]=4 4066 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,2,0|2,0,0]=4 4067 B6R0.3 CCC(=S)C(=O)O Amb27872099 [0,0,0,0,2,0|1,1,0]=4 4068 B6R0.3 CN(O)C(=O)CN Amb27593581 [0,0,0,0,2,0|2,0,0]=4 4069 B6R0.3 CN(O)C(=O)CN Amb33250369 [0,0,0,0,2,0|2,0,0]=4 4070 B6R0.3 CNC(=O)C(=O)O Amb2691295 [0,0,0,0,2,0|2,0,0]=4 4071 B6R0.3 COC(=O)C(=O)O Amb33545007 [0,0,0,0,2,0|2,0,0]=4 4072 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [0,0,0,0,2,0|1,0,1]=4 4073 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [0,0,0,0,2,0|1,0,1]=4 4074 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [0,0,0,0,2,0|1,0,1]=4 4075 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [0,0,0,0,2,0|1,0,1]=4 4076 B6R0.3 NCC(Br)C(=O)O Amb28385732 [0,0,0,0,2,0|1,0,1]=4 4077 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [0,0,0,0,2,0|1,0,1]=4 4078 B6R0.3 NCC(F)C(=O)O Amb22733051 [0,0,0,0,2,0|1,0,1]=4 4079 B6R0.3 NCC(F)C(=O)O Amb2688010 [0,0,0,0,2,0|1,0,1]=4 4080 B6R0.3 NCC(N)C(=O)O Amb22899095 [0,0,0,0,2,0|1,0,1]=4 4081 B6R0.3 NCC(N)C(=O)O Amb2697095 [0,0,0,0,2,0|1,0,1]=4 4082 B6R0.3 NCC(N)C(=O)O Amb8514284 [0,0,0,0,2,0|1,0,1]=4 4083 B6R0.3 NCC(O)C(=O)O Amb8517492 [0,0,0,0,2,0|0,0,2]=4 4084 B6R0.3 NCC(S)C(=O)O Amb17593238 [0,0,0,0,2,0|0,1,1]=4 4085 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [0,0,0,0,2,0|1,0,1]=4 4086 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [0,0,0,0,2,0|1,0,1]=4 4087 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [0,0,0,0,2,0|1,0,1]=4 4088 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [0,0,0,0,2,0|1,0,1]=4 4089 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [0,0,0,0,2,0|0,0,2]=4 4090 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [0,0,0,0,2,0|1,0,1]=4 4091 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [0,0,0,0,2,0|1,0,1]=4 4092 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [0,0,0,0,2,0|1,0,1]=4 4093 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [0,0,0,0,2,0|1,0,1]=4 4094 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [0,0,0,0,2,0|1,0,1]=4 4095 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [0,0,0,0,2,0|0,0,2]=4 4096 B6R0.3 NNC(=O)C(N)=O Amb6608760 [0,0,0,0,2,0|2,0,0]=4 4097 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [0,0,0,0,2,0|1,0,0]=3 4098 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [0,0,0,0,2,0|1,0,0]=3 4099 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [0,0,0,0,2,0|1,0,0]=3 4100 B6R0.3 O=C(O)C(=O)CI Amb27659477 [0,0,0,0,2,0|1,0,0]=3 4101 B6R0.3 O=C(O)C(=O)CO Amb6600025 [0,0,0,0,2,0|1,0,0]=3 4102 B6R0.3 O=C(O)C(=O)CS Amb6600041 [0,0,0,0,2,0|1,0,0]=3 4103 B6R0.3 O=C(O)C(=O)NI Amb27643666 [0,0,0,0,2,0|2,0,0]=4 4104 B6R0.3 O=C([O-])C(=O)CF Amb10839900 [0,0,0,0,2,0|1,0,1]=4 4105 B6R0.3 O=C([O-])C(=O)CS Amb22547761 [0,0,0,0,2,0|1,0,1]=4 4106 B6R0.3 O=C([O-])C(=O)CS Amb9825929 [0,0,0,0,2,0|1,0,1]=4 4107 B10R0.55 C#CC(=O)NCCCC(=O)O Amb6278585 [0,0,0,0,0,2|1,0,1]=4 4108 B10R0.55 C=CC(=O)NCCCC(=O)O Amb6264090 [0,0,0,0,0,2|1,0,1]=4 4109 B10R0.55 CC(=O)NCCNC(=O)CCl Amb6891986 [0,0,0,0,0,2|2,0,0]=4 4110 B10R0.55 CC(=O)NCCNC(=O)CI Amb27670943 [0,0,0,0,0,2|2,0,0]=4 4111 B10R0.55 CC(=O)NCCNC(=O)CS Amb28387078 [0,0,0,0,0,2|2,0,0]=4 4112 B10R0.55 CCC(=O)CCCCC(=O)O Amb6305227 [0,0,0,0,0,2|1,0,0]=3 4113 B10R0.55 CCC(=O)NCCNC(N)=O Amb27670229 [0,0,0,0,0,2|2,0,0]=4 4114 B10R0.55 CNC(=O)CCCCC(=O)O Amb9390746 [0,0,0,0,0,2|2,0,0]=4 4115 B10R0.55 CNC(=O)NCCCC(=O)O Amb18305512 [0,0,0,0,0,2|2,0,0]=4 4116 B10R0.55 COC(=O)CCCCC(=O)O Amb3939891 [0,0,0,0,0,2|2,0,0]=4 4117 B10R0.55 COC(=O)CSCCC(=O)O Amb9005247 [0,0,0,0,0,2|2,0,0]=4 4118 B10R0.55 COC(=O)NCCCC(=O)O Amb6668735 [0,0,0,0,0,2|2,0,0]=4 4119 B10R0.55 NC(=O)NCCNC(=O)CBr Amb27670468 [0,0,0,0,0,2|2,0,0]=4 4120 B10R0.55 NC(=O)NCCNC(=O)CCl Amb27670469 [0,0,0,0,0,2|2,0,0]=4 4121 B10R0.55 NC(=O)NCCNC(=O)CS Amb27670474 [0,0,0,0,0,2|2,0,0]=4 4122 B10R0.55 NCC(=O)NCCNC(N)=O Amb27670467 [0,0,0,0,0,2|1,0,0]=3 4123 B10R0.55 NNC(=O)CCCNC(N)=O Amb26990810 [0,0,0,0,0,2|2,0,0]=4 4124 B10R0.55 NNC(=O)NCCOC(N)=O Amb27271167 [0,0,0,0,0,2|2,0,0]=4 4125 B10R0.55 NNC(=S)NCCCC(=O)O Amb27272376 [0,0,0,0,0,2|1,1,0]=4 4126 B10R0.55 O=C(O)CCCNC(=O)CCl Amb18791069 [0,0,0,0,0,2|1,0,0]=3